formula_sc,formula_similarity,totreldiff,formula_frac,correct_formula_frac,formula_2,orig_formula_cif,tc,sc_class,sc_class_unique_sc,norm_formula_sc,chemical_composition_sc,num_elements_sc,origin_sc,old_formula_sc,database_id_2,original_formula_2,chemical_composition_2,norm_formula_2,spacegroup_2,crystal_system_2,lata_2,latb_2,latc_2,cif,original_cif_2,material_id_2,band_gap_2,band_structure_2,created_at_2,density_2,doi_2,doi_bibtex_2,dos_2,e_above_hull_2,efermi_2,encut_2,energy_2,energy_per_atom_2,exp_2,final_energy_2,final_energy_per_atom_2,formation_energy_per_atom_2,has_2,has_bandstructure_2,icsd_ids_2,is_ordered_2,last_updated_2,magnetic_type_2,nsites_2,ntask_ids_2,original_task_id_2,oxide_type_2,pretty_formula_2,pseudo_potential_2,reduced_cell_formula_2,run_type_2,task_id_2,task_ids_2,total_magnetization_2,unit_cell_formula_2,cell_volume_2,warnings_2,ordering_2,is_magnetic_2,exchange_symmetry_2,num_unique_magnetic_sites_2,magmoms_2,total_magnetization_normalized_vol_2,total_magnetization_normalized_formula_units_2,num_magnetic_sites_2,true_total_magnetization_2,origin_2,cif_before_synthetic_doping,synth_doped,Reason for exclusion,graph,crystal_temp_2,no_crystal_temp_given_2,point_group_2,cubic,hexagonal,monoclinic,orthorhombic,tetragonal,triclinic,trigonal,primitive,base-centered,body-centered,face-centered,weight,cif_exists
As2Eu1Fe1.8P0.2,3,0.0799999999999999,1.0,True,As2Eu1Fe1.8P0.2,As2Eu1Fe2,0.0,Ferrite,True,As40Eu20Fe36P4,As-Eu-Fe-P,4,Supercon,Eu1Fe1.8As2P0.2,MP-mp-20890,Eu1Fe2As2,As-Eu-Fe,As40Eu20Fe40,I 4/m m m,tetragonal,3.9736679999368567,3.9736679999368567,6.07120609,data/final/MP/cifs/As2Eu1Fe1.8P0.2-MP-mp-20890-synth_doped.cif,data/source/MP/raw/cifs/mp-20890.cif,mp-20890,0.0,,2014-02-21 09:03:25,8.079887417044961,10.17188/1196086,"@misc{osti_1196086,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Eu(FeAs)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196086"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687595'}},0.0,5.69045342,520.0,-39.43180547,-7.886361094,"{'tags': ['High pressure experimental phase', 'Europium diiron diarsenide - HP', 'Europium diiron diarsenide', 'Europium iron arsenide (1/2/2)']}",-39.43180547,-7.886361094,-0.5763016570000005,"['xas', 'bandstructure']",True,"[169689, 169687, 185355, 169691, 163211, 185356, 610431, 169690, 169688, 163210]",True,2021-05-12 10:56:57.051000,FM,5,16,mp-20890,,Eu(FeAs)2,"{'functional': 'PBE', 'labels': ['Eu', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Eu': 1.0, 'Fe': 2.0, 'As': 2.0}",GGA,mp-20890,"['mp-991161', 'mp-993140', 'mp-20890', 'mp-1069324', 'mp-1069480', 'mp-1069596', 'mp-1069907', 'mp-1070115', 'mp-1069978', 'mp-1442076', 'mp-1687595', 'mp-1782260', 'mp-994461', 'mp-1594012', 'mp-1069557', 'mp-1070074']",6.9579645,"{'Eu': 1.0, 'Fe': 2.0, 'As': 2.0}",84.97992844321493,[],FM,True,139,1,"[6.7, -0.0, -0.0, 0.0, 0.0]",0.0818777401613068,6.9579645,1,6.9579645,MP,data/source/MP/cleaned/cifs/MP-mp-20890.cif,True,,data/final/MP/graphs/As2Eu1Fe1.8P0.2-MP-mp-20890-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ba2Cu3Dy0.1Pr0.9O7,2,0.0153846153846153,1.0,True,Ba2Cu3Dy0.1Pr0.9O7,Ba2Cu3Pr1O7,0.0,Cuprate,True,Ba15.385Cu23.077Dy0.769Pr6.923O53.84615384615385,Ba-Cu-Dy-Pr-O,5,Supercon,Dy0.1Pr0.9Ba2Cu3O7,MP-mp-20936,Ba2Pr1Cu3O7,Ba-Cu-Pr-O,Ba15.385Cu23.077Pr7.692O53.84615384615385,P m m m,orthorhombic,3.903923,3.95568,11.916432,data/final/MP/cifs/Ba2Cu3Dy0.1Pr0.9O7-MP-mp-20936-synth_doped.cif,data/source/MP/raw/cifs/mp-20936.cif,mp-20936,0.0,,2014-02-22 14:41:55,6.480717836004672,10.17188/1196129,"@misc{osti_1196129,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2PrCu3O7 (SG:47) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196129"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698257'}},0.0256000172756332,3.18514576,520.0,-78.62827906,-6.048329158461538,"{'tags': ['Dibarium praseodymium tricopper heptaoxide', 'Praseodymium dibarium dicopper copper(III) oxide', 'Praseodymium dibarium tricopper heptaoxide', 'Praseodymium dibarium copper(III) dicopper oxide']}",-78.62827906,-6.048329158461538,-2.145007016153845,"['xas', 'bandstructure']",True,"[41452, 94377, 81168, 173910, 89221]",True,2021-05-12 10:56:57.051000,NM,13,8,mp-20936,oxide,Ba2PrCu3O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Pr_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Pr': 1.0, 'Cu': 3.0, 'O': 7.0}",GGA,mp-20936,"['mp-988090', 'mp-987725', 'mp-20936', 'mp-1417367', 'mp-1698257', 'mp-1833655', 'mp-988324', 'mp-1602318']",0.0007234,"{'Ba': 2.0, 'Pr': 1.0, 'Cu': 3.0, 'O': 7.0}",184.02152853403555,[],NM,False,47,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.931061793491212e-06,0.0007234,0,0.0007234,MP,data/source/MP/cleaned/cifs/MP-mp-20936.cif,True,,data/final/MP/graphs/Ba2Cu3Dy0.1Pr0.9O7-MP-mp-20936-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
In1Pd1,1,0.0,1.0,True,In1Pd1,In1Pd1,0.7,Other,True,In50Pd50,In-Pd,2,Supercon,In1Pd1,MP-mp-21215,In1Pd1,In-Pd,In50Pd50,P m -3 m,cubic,3.309616,3.309616,3.309616,data/final/MP/cifs/In1Pd1-MP-mp-21215.cif,data/source/MP/raw/cifs/mp-21215.cif,mp-21215,0.0,,2014-02-21 07:25:50,10.133885637642187,10.17188/1196490,"@misc{osti_1196490,
    author = ""Persson, Kristin"",
    title = ""Materials Data on InPd (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196490"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668217'}},0.0,8.05780169,520.0,-8.92246151,-4.461230755,{'tags': ['Indium palladium (1/1)']},-8.92246151,-4.461230755,-0.4954479849999997,"['xas', 'elasticity', 'bandstructure']",True,"[59474, 59473, 640228]",True,2021-05-12 10:56:16.728000,NM,2,9,mp-21215,,InPd,"{'functional': 'PBE', 'labels': ['In_d', 'Pd'], 'pot_type': 'paw'}","{'In': 1.0, 'Pd': 1.0}",GGA,mp-21215,"['mp-991670', 'mp-993577', 'mp-21215', 'mp-1140147', 'mp-1440226', 'mp-1668217', 'mp-1791049', 'mp-994872', 'mp-1588915']",0.000302,"{'In': 1.0, 'Pd': 1.0}",36.25207103698146,[],NM,False,221,0,"[0, 0]",8.33055854083271e-06,0.000302,0,0.000302,MP,data/source/MP/cleaned/cifs/MP-mp-21215.cif,False,,data/final/MP/graphs/In1Pd1-MP-mp-21215.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Cr2Ti1,1,0.0,2.0,False,Cr4Ti2,Cr4Ti2,0.0,Other,True,Cr66.667Ti33.333,Cr-Ti,2,Supercon,Cr2Ti1,MP-mp-1425,Ti2Cr4,Cr-Ti,Cr66.667Ti33.333,F d -3 m,cubic,4.85374499,4.853744989999999,4.85374499,data/final/MP/cifs/Cr2Ti1-MP-mp-1425.cif,data/source/MP/raw/cifs/mp-1425.cif,mp-1425,0.0,,2011-05-13 13:19:58,6.2374105641628494,10.17188/1190580,"@misc{osti_1190580,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TiCr2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1190580"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1674321'}},0.0,6.18249909,520.0,-55.0296813,-9.17161355,"{'tags': ['Chromium titanium (2/1) - LT', 'Chromium titanium hydride (2/1/1)', 'Chromium titanium (2/1)']}",-55.0296813,-9.17161355,-0.1044178977777778,"['xas', 'elasticity', 'bandstructure']",True,"[626917, 102851, 626918, 626910, 626124]",True,2021-05-12 10:56:12.755000,NM,6,9,mp-1425,,TiCr2,"{'functional': 'PBE', 'labels': ['Ti_pv', 'Cr_pv'], 'pot_type': 'paw'}","{'Ti': 1.0, 'Cr': 2.0}",GGA,mp-1425,"['mp-928359', 'mp-928861', 'mp-912344', 'mp-1425', 'mp-1077747', 'mp-1437894', 'mp-1674321', 'mp-1799932', 'mp-1588451']",0.0030934,"{'Ti': 2.0, 'Cr': 4.0}",80.85667333539308,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",7.651563865776649e-05,0.0030934,0,0.0061868,MP,data/source/MP/cleaned/cifs/MP-mp-1425.cif,False,,data/final/MP/graphs/Cr2Ti1-MP-mp-1425.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Rh1Zr3,1,0.0,4.0,False,Rh4Zr12,Rh4Zr12,7.1033333335,Other,True,Rh25Zr75,Rh-Zr,2,Supercon,Rh1Zr3,MP-mp-1188413,Zr12Rh4,Rh-Zr,Rh25Zr75,I -4 2 m,tetragonal,5.750105997369286,8.133162878649543,8.13316288,data/final/MP/cifs/Rh1Zr3-MP-mp-1188413.cif,data/source/MP/raw/cifs/mp-1188413.cif,mp-1188413,0.0,,2019-01-11 19:25:26.786000,7.515208089275875,,,{'GGA': {'task_id': 'mp-1708881'}},0.0,4.73652502,520.0,-138.70039462,-8.66877466375,{'tags': []},-138.70039462,-8.66877466375,-0.4169222237500012,['bandstructure'],True,[],True,2021-05-12 10:58:31.620000,NM,16,5,mp-1188413,,Zr3Rh,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Rh_pv'], 'pot_type': 'paw'}","{'Zr': 3.0, 'Rh': 1.0}",GGA,mp-1188413,"['mp-1188413', 'mp-1426452', 'mp-1708881', 'mp-1811428', 'mp-1604423']",0.05184475,"{'Zr': 12.0, 'Rh': 4.0}",332.82998576972955,[],NM,False,121,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0006230778741897,0.05184475,0,0.207379,MP,data/source/MP/cleaned/cifs/MP-mp-1188413.cif,False,,data/final/MP/graphs/Rh1Zr3-MP-mp-1188413.json,0,True,-42m,0,0,0,0,6,0,0,0,0,1,0,1.0,False
Ge1.9La1Pd2Sn0.1,2,0.04,1.0,True,Ge1.9La1Pd2Sn0.1,Ge2La1Pd2,1.25,Other,True,Ge38La20Pd40Sn2,Ge-La-Pd-Sn,4,Supercon,La1Pd2Ge1.9Sn0.1,MP-mp-21033,La1Ge2Pd2,Ge-La-Pd,Ge40La20Pd40,I 4/m m m,tetragonal,4.421290001597606,4.421290001597606,5.97061441,data/final/MP/cifs/Ge1.9La1Pd2Sn0.1-MP-mp-21033-synth_doped.cif,data/source/MP/raw/cifs/mp-21033.cif,mp-21033,0.0,,2014-02-21 11:30:39,8.300326005582953,10.17188/1196295,"@misc{osti_1196295,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La(GePd)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196295"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701817'}},0.0,6.14890347,520.0,-28.82817588,-5.765635176,{'tags': ['Lanthanum palladium germanide (1/2/2)']},-28.82817588,-5.765635176,-0.8572698889999998,"['xas', 'bandstructure']",True,"[81760, 53662]",True,2021-05-12 10:56:57.051000,NM,5,8,mp-21033,,La(GePd)2,"{'functional': 'PBE', 'labels': ['La', 'Ge_d', 'Pd'], 'pot_type': 'paw'}","{'La': 1.0, 'Ge': 2.0, 'Pd': 2.0}",GGA,mp-21033,"['mp-990571', 'mp-992631', 'mp-21033', 'mp-1438097', 'mp-1701817', 'mp-1796178', 'mp-994077', 'mp-1596763']",0.0004025,"{'La': 1.0, 'Ge': 2.0, 'Pd': 2.0}",99.4334691764027,[],NM,False,139,0,"[0, 0, 0, 0, 0]",4.047932786956611e-06,0.0004025,0,0.0004025,MP,data/source/MP/cleaned/cifs/MP-mp-21033.cif,True,,data/final/MP/graphs/Ge1.9La1Pd2Sn0.1-MP-mp-21033-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As1Fe1Nd0.95Sr0.05O1,2,0.025,2.0,False,As2Fe2Nd1.9Sr0.1O2,As2Fe2Nd2O2,0.0,Ferrite,True,As25Fe25Nd23.75Sr1.25O25,As-Fe-Nd-Sr-O,5,Supercon,Nd0.95Sr0.05Fe1As1O1,MP-mp-622621,Nd2Fe2As2O2,As-Fe-Nd-O,As25Fe25Nd25O25,P 4/n m m,tetragonal,4.074653,4.074653,9.170967,data/final/MP/cifs/As1Fe1Nd0.95Sr0.05O1-MP-mp-622621-synth_doped.cif,data/source/MP/raw/cifs/mp-622621.cif,mp-622621,0.0,,2014-02-16 22:28:25,6.347279619112142,10.17188/1278150,"@misc{osti_1278150,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NdFeAsO (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278150"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-1677677'}},0.2809314202083302,3.74777613,520.0,-52.70842543,-6.58855317875,{'tags': ['Neodymium iron arsenic oxide (1/1/1/1)']},-52.70842543,-6.58855317875,-1.61299541125,"['xas', 'bandstructure']",True,"[163547, 164679, 422001, 163546, 236651, 236650, 602466, 164680, 164676]",True,2021-05-12 10:57:28.836000,FM,8,8,mp-622621,oxide,NdFeAsO,"{'functional': 'PBE', 'labels': ['Nd_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Nd': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-622621,"['mp-622621', 'mp-1079381', 'mp-1173401', 'mp-1438697', 'mp-1677677', 'mp-1772072', 'mp-1926310', 'mp-1592869']",3.83954265,"{'Nd': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",152.26370404041757,[],FM,True,129,1,"[0.0, 0.0, 3.6, 3.6, -0.0, -0.0, -0.0, -0.0]",0.0504328024094411,3.83954265,2,7.6790853,MP,data/source/MP/cleaned/cifs/MP-mp-622621.cif,True,,data/final/MP/graphs/As1Fe1Nd0.95Sr0.05O1-MP-mp-622621-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ge12Nd1Pt4,1,0.0,1.0,True,Ge12Nd1Pt4,Ge12Nd1Pt4,0.7,Other,True,Ge70.588Nd5.882Pt23.529,Ge-Nd-Pt,3,Supercon,Nd1Pt4Ge12,MP-mp-975665,Nd1Ge12Pt4,Ge-Nd-Pt,Ge70.588Nd5.882Pt23.529,I m -3,cubic,7.556650151675192,7.556650150000001,7.55665015,data/final/MP/cifs/Ge12Nd1Pt4-MP-mp-975665.cif,data/source/MP/raw/cifs/mp-975665.cif,mp-975665,0.0,,2015-09-17 09:23:47,8.97949172512815,10.17188/1314869,"@misc{osti_1314869,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nd(Ge3Pt)4 (SG:204) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1314869"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1707700'}},0.0123379989215717,4.24369266,520.0,-91.04011994,-5.355301172941176,{'tags': ['Neodymium platinum germanide (1/4/12)']},-91.04011994,-5.355301172941176,-0.383059507647059,"['xas', 'bandstructure']",True,[174555],True,2021-05-12 10:57:55.580000,NM,17,8,mp-975665,,Nd(Ge3Pt)4,"{'functional': 'PBE', 'labels': ['Nd_3', 'Ge_d', 'Pt'], 'pot_type': 'paw'}","{'Nd': 1.0, 'Ge': 12.0, 'Pt': 4.0}",GGA,mp-975665,"['mp-975665', 'mp-975820', 'mp-975763', 'mp-1504626', 'mp-1707700', 'mp-1806914', 'mp-975926', 'mp-1608664']",0.0023997,"{'Nd': 1.0, 'Ge': 12.0, 'Pt': 4.0}",332.1743227788557,[],NM,False,204,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",7.224218837642048e-06,0.0023997,0,0.0023997,MP,data/source/MP/cleaned/cifs/MP-mp-975665.cif,False,,data/final/MP/graphs/Ge12Nd1Pt4-MP-mp-975665.json,0,True,m-3,2,0,0,0,0,0,0,0,0,1,0,1.0,False
Co1In5La1,1,0.0,1.0,True,Co1In5La1,Co1In5La1,0.0,Other,True,Co14.286In71.429La14.286,Co-In-La,3,Supercon,La1Co1In5,MP-mp-21414,La1In5Co1,Co-In-La,Co14.286In71.429La14.286,P 4/m m m,tetragonal,4.667013,4.667013,7.688877,data/final/MP/cifs/Co1In5La1-MP-mp-21414.cif,data/source/MP/raw/cifs/mp-21414.cif,mp-21414,0.0,,2014-02-21 14:00:54,7.65394489498266,10.17188/1196860,"@misc{osti_1196860,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaIn5Co (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196860"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701108'}},0.0048449040476183,7.97451629,520.0,-27.70785565,-3.958265092857143,{'tags': ['Lanthanum cobalt indide (1/1/5)']},-27.70785565,-3.958265092857143,-0.272158871428572,"['xas', 'bandstructure']",True,"[150264, 150261]",True,2021-05-12 10:56:59.077000,NM,7,8,mp-21414,,LaIn5Co,"{'functional': 'PBE', 'labels': ['La', 'In_d', 'Co'], 'pot_type': 'paw'}","{'La': 1.0, 'In': 5.0, 'Co': 1.0}",GGA,mp-21414,"['mp-991097', 'mp-993086', 'mp-21414', 'mp-1433980', 'mp-1701108', 'mp-1786935', 'mp-994416', 'mp-1591465']",0.0044879,"{'La': 1.0, 'In': 5.0, 'Co': 1.0}",167.47150945666533,[],NM,False,123,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0]",2.6797990981034792e-05,0.0044879,0,0.0044879,MP,data/source/MP/cleaned/cifs/MP-mp-21414.cif,False,,data/final/MP/graphs/Co1In5La1-MP-mp-21414.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ir0.2Ru1.8Th1,3,0.1333333333333333,2.0,False,Ir0.4Ru3.6Th2,Ru4Th2,3.1,Other,True,Ir6.667Ru60Th33.333,Ir-Ru-Th,3,Supercon,Th1Ir0.2Ru1.8,MP-mp-574438,Th2Ru4,Ru-Th,Ru66.667Th33.333,F d -3 m,cubic,5.433971360000001,5.43397136,5.43397136,data/final/MP/cifs/Ir0.2Ru1.8Th1-MP-mp-574438-synth_doped.cif,data/source/MP/raw/cifs/mp-574438.cif,mp-574438,0.0,,2014-02-28 05:45:15,12.708957533514832,10.17188/1276579,"@misc{osti_1276579,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ThRu2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1276579"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-918592'}},0.0384871966666633,8.28589698,520.0,-53.8389712,-8.973161866666667,"{'tags': ['Ruthenium thorium (2/1)', 'Thorium ruthenium (1/2)']}",-53.8389712,-8.973161866666667,-0.3189493466666668,"['xas', 'elasticity', 'bandstructure']",True,"[650730, 150740, 106002, 650723, 650729, 650731, 106003]",True,2021-05-12 10:56:27.046000,NM,6,7,mp-574438,,ThRu2,"{'functional': 'PBE', 'labels': ['Th', 'Ru_pv'], 'pot_type': 'paw'}","{'Th': 1.0, 'Ru': 2.0}",GGA,mp-574438,"['mp-919588', 'mp-905408', 'mp-918592', 'mp-574438', 'mp-1439663', 'mp-1802924', 'mp-1592175']",0.00057545,"{'Th': 2.0, 'Ru': 4.0}",113.45850020968712,[],NM,False,166,0,"[0.0, 0.0, 0.0, 0.0, 0.0, -0.0]",1.0143797052428654e-05,0.00057545,0,0.0011509,MP,data/source/MP/cleaned/cifs/MP-mp-574438.cif,True,,data/final/MP/graphs/Ir0.2Ru1.8Th1-MP-mp-574438-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Co35Zr65,2,0.0333333333333333,0.0571406593406593,False,Co2Zr3.714,Co2Zr4,2.48,Other,True,Co35Zr65,Co-Zr,2,Supercon,Co35Zr65,MP-mp-628,Zr4Co2,Co-Zr,Co33.333Zr66.667,I 4/m c m,tetragonal,5.27792884001752,5.27792884,5.277928840000001,data/final/MP/cifs/Co35Zr65-MP-mp-628-synth_doped.cif,data/source/MP/raw/cifs/mp-628.cif,mp-628,0.0,,2011-05-13 12:16:44,7.17077101131263,10.17188/1278899,"@misc{osti_1278899,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Zr2Co (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278899"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677545'}},0.0,4.51380976,520.0,-49.95120762,-8.325201269999999,"{'tags': ['Cobalt zirconium (1/2)', 'Zirconium cobalt (2/1)']}",-49.95120762,-8.325201269999999,-0.2572949183333328,"['xas', 'elasticity', 'bandstructure']",True,"[625671, 191386, 625688, 102740, 625665]",True,2021-05-12 10:56:27.046000,NM,6,20,mp-628,,Zr2Co,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Co'], 'pot_type': 'paw'}","{'Zr': 2.0, 'Co': 1.0}",GGA,mp-628,"['mp-928347', 'mp-912327', 'mp-928866', 'mp-628', 'mp-1071352', 'mp-1071381', 'mp-1071431', 'mp-1071762', 'mp-1071803', 'mp-1071859', 'mp-1071883', 'mp-1071742', 'mp-1071925', 'mp-1441633', 'mp-1677545', 'mp-1802810', 'mp-1591799', 'mp-1071792', 'mp-1071416', 'mp-1071915']",0.0001226,"{'Zr': 4.0, 'Co': 2.0}",111.79353060019714,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0]",2.1933290654975308e-06,0.0001226,0,0.0002452,MP,data/source/MP/cleaned/cifs/MP-mp-628.cif,True,,data/final/MP/graphs/Co35Zr65-MP-mp-628-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
N4Th3,1,0.0,1.0,True,N4Th3,N4Th3,0.0,Other,True,N57.143Th42.857,N-Th,2,Supercon,N4Th3,MP-mp-467,Th3N4,N-Th,N57.143Th42.857,R -3 m,trigonal,3.881763874988134,3.881763874988134,9.43064237,data/final/MP/cifs/N4Th3-MP-mp-467.cif,data/source/MP/raw/cifs/mp-467.cif,mp-467,1.668,,2011-05-13 07:10:10,10.448199205066368,10.17188/1208328,"@misc{osti_1208328,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Th3N4 (SG:166) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208328"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703931'}},0.0,6.40252985,520.0,-66.84960138,-9.549943054285714,"{'tags': ['Thorium nitride (3/4)', 'Thorium nitride', 'Trithorium tetranitride']}",-66.84960138,-9.549943054285714,-1.8151495614285715,"['xas', 'elasticity', 'bandstructure']",True,"[644748, 9052, 644750, 14336, 192151]",True,2021-05-12 10:56:20.740000,NM,7,9,mp-467,,Th3N4,"{'functional': 'PBE', 'labels': ['Th', 'N'], 'pot_type': 'paw'}","{'Th': 3.0, 'N': 4.0}",GGA,mp-467,"['mp-670725', 'mp-661149', 'mp-467', 'mp-1077956', 'mp-1438219', 'mp-1703931', 'mp-1802567', 'mp-1590380', 'mp-687770']",6.01e-05,"{'Th': 3.0, 'N': 4.0}",119.53825308720992,[],NM,False,166,0,"[0, 0, 0, 0, 0, 0, 0]",5.027679294941147e-07,6.01e-05,0,6.01e-05,MP,data/source/MP/cleaned/cifs/MP-mp-467.cif,False,,data/final/MP/graphs/N4Th3-MP-mp-467.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Bi2Cu1Sr2O6,1,0.0,2.0,False,Bi4Cu2Sr4O12,Bi4Cu2Sr4O12,7.38,Cuprate,True,Bi18.182Cu9.091Sr18.182O54.54545454545455,Bi-Cu-Sr-O,4,Supercon,Bi2Sr2Cu1O6,MP-mp-555827,Sr4Cu2Bi4O12,Bi-Cu-Sr-O,Bi18.182Cu9.091Sr18.182O54.54545454545455,C c c m,orthorhombic,5.133052,5.52519599964684,13.01880065,data/final/MP/cifs/Bi2Cu1Sr2O6-MP-mp-555827.cif,data/source/MP/raw/cifs/mp-555827.cif,mp-555827,0.0,,2014-02-22 10:13:35,6.928457216674172,10.17188/1269010,"@misc{osti_1269010,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr2Cu(BiO3)2 (SG:66) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1269010"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1707731'}},0.0585641377272736,4.75363105,520.0,-126.5422218,-5.7519191727272725,{'tags': ['Dibismuth distrontium copper hexaoxide']},-126.5422218,-5.7519191727272725,-2.0406438793939388,"['xas', 'bandstructure']",True,[67426],True,2021-05-12 10:57:17.297000,NM,22,8,mp-555827,oxide,Sr2Cu(BiO3)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Cu': 1.0, 'Bi': 2.0, 'O': 6.0}",GGA,mp-555827,"['mp-932594', 'mp-931549', 'mp-918058', 'mp-555827', 'mp-1418436', 'mp-1707731', 'mp-1837530', 'mp-1605675']",0.00627605,"{'Sr': 4.0, 'Cu': 2.0, 'Bi': 4.0, 'O': 12.0}",360.8189966762927,[],NM,False,66,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",3.478780251490214e-05,0.00627605,0,0.0125521,MP,data/source/MP/cleaned/cifs/MP-mp-555827.cif,False,,data/final/MP/graphs/Bi2Cu1Sr2O6-MP-mp-555827.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
B2Cr0.02Mg0.98,2,0.0133333333333333,1.0,True,B2Cr0.02Mg0.98,B2Mg1,35.3,Other,True,B66.667Cr0.667Mg32.667,B-Cr-Mg,3,Supercon,Mg0.98Cr0.02B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B2Cr0.02Mg0.98-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B2Cr0.02Mg0.98-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Cu1La2O4.086,2,0.0104028063384541,0.9789841736009136,True,Cu0.979La1.958O4,Cu1La2O4,45.2,Cuprate,True,Cu14.112La28.225O57.66299745977985,Cu-La-O,3,Supercon,La2Cu1O4.086,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La2O4.086-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La2O4.086-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ce2Co1In8,1,0.0,1.0,True,Ce2Co1In8,Ce2Co1In8,0.4,Heavy_fermion,True,Ce18.182Co9.091In72.727,Ce-Co-In,3,Supercon,Ce2Co1In8,MP-mp-19989,Ce2In8Co1,Ce-Co-In,Ce18.182Co9.091In72.727,P 4/m m m,tetragonal,4.663109,4.663109,12.345552,data/final/MP/cifs/Ce2Co1In8-MP-mp-19989.cif,data/source/MP/raw/cifs/mp-19989.cif,mp-19989,0.0,,2014-02-22 19:40:37,7.779786628544782,10.17188/1195167,"@misc{osti_1195167,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ce2In8Co (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195167"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700296'}},0.0,7.90336295,520.0,-44.33807128,-4.030733752727273,{'tags': ['Cerium cobalt indium (2/1/8)']},-44.33807128,-4.030733752727273,-0.3045550304545456,"['xas', 'bandstructure']",True,[102109],True,2021-05-12 10:56:57.051000,FiM,11,7,mp-19989,,Ce2In8Co,"{'functional': 'PBE', 'labels': ['Ce', 'In_d', 'Co'], 'pot_type': 'paw'}","{'Ce': 2.0, 'In': 8.0, 'Co': 1.0}",GGA,mp-19989,"['mp-991629', 'mp-993547', 'mp-19989', 'mp-1421802', 'mp-1700296', 'mp-994958', 'mp-1608422']",0.2759206,"{'Ce': 2.0, 'In': 8.0, 'Co': 1.0}",268.44891157512234,[],FiM,True,123,2,"[0.1, 0.1, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.1]",0.0010278328132568,0.2759206,3,0.2759206,MP,data/source/MP/cleaned/cifs/MP-mp-19989.cif,False,,data/final/MP/graphs/Ce2Co1In8-MP-mp-19989.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ba0.199Cu1La1.801O4,3,0.0568571428571428,1.0,True,Ba0.199Cu1La1.801O4,Cu1La2O4,23.5,Cuprate,True,Ba2.843Cu14.286La25.729O57.142857142857146,Ba-Cu-La-O,4,Supercon,La1.801Ba0.199Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ba0.199Cu1La1.801O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ba0.199Cu1La1.801O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Nb0.71Sn0.29,3,0.08,8.0,False,Nb5.68Sn2.32,Nb6Sn2,18.3,Other,True,Nb71Sn29,Nb-Sn,2,Supercon,Nb0.71Sn0.29,MP-mp-1326,Nb6Sn2,Nb-Sn,Nb75Sn25,P m -3 n,cubic,5.334611,5.334611,5.334611,data/final/MP/cifs/Nb0.71Sn0.29-MP-mp-1326-synth_doped.cif,data/source/MP/raw/cifs/mp-1326.cif,mp-1326,0.0,,2011-05-14 09:51:48,8.694218121896231,10.17188/1189484,"@misc{osti_1189484,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Sn (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189484"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668415'}},0.0,6.59372491,520.0,-69.93787048,-8.74223381,{'tags': ['Niobium tin (3/1)']},-69.93787048,-8.74223381,-0.163862066250001,"['xas', 'elasticity', 'bandstructure']",True,"[105230, 645503, 645489, 105231, 645498, 645485, 645474, 645496, 645480, 645488, 645482, 645487, 645500, 645493, 645477, 645484, 645502, 645483, 150878, 645479, 645481, 645486, 645473]",True,2021-05-12 10:56:12.755000,NM,8,9,mp-1326,,Nb3Sn,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Sn_d'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Sn': 1.0}",GGA,mp-1326,"['mp-930046', 'mp-913770', 'mp-930577', 'mp-1326', 'mp-1440651', 'mp-1668415', 'mp-1880085', 'mp-1594093', 'mp-1594507']",0.62023085,"{'Nb': 6.0, 'Sn': 2.0}",151.81275738025872,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0081709977567491,0.62023085,0,1.2404617,MP,data/source/MP/cleaned/cifs/MP-mp-1326.cif,True,,data/final/MP/graphs/Nb0.71Sn0.29-MP-mp-1326-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
C1S1,1,0.0,2.0,False,C2S2,C2S2,9.0,Other,True,C50S50,C-S,2,Supercon,C1S1,MP-mp-1147643,C2S2,C-S,C50S50,P 4/n m m,tetragonal,3.564824,3.564824,4.126673,data/final/MP/cifs/C1S1-MP-mp-1147643.cif,data/source/MP/raw/cifs/mp-1147643.cif,mp-1147643,0.0,,2018-12-27 11:39:53.428000,2.791271420818031,,,{'GGA': {'task_id': 'mp-1766782'}},1.3462852578571436,6.50406374,520.0,-21.20705538,-5.301763845,{'tags': []},-21.20705538,-5.301763845,1.1283514384375,['bandstructure'],True,[],True,2021-05-12 10:58:22.271000,NM,4,5,mp-1147643,,CS,"{'functional': 'PBE', 'labels': ['C', 'S'], 'pot_type': 'paw'}","{'C': 1.0, 'S': 1.0}",GGA,mp-1147643,"['mp-1147643', 'mp-1437515', 'mp-1766782', 'mp-1794510', 'mp-1585021']",6.44e-05,"{'C': 2.0, 'S': 2.0}",52.441637306838594,[],NM,False,129,0,"[0, 0, 0, 0]",2.456063666479078e-06,6.44e-05,0,0.0001288,MP,data/source/MP/cleaned/cifs/MP-mp-1147643.cif,False,,data/final/MP/graphs/C1S1-MP-mp-1147643.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Rh1Se2,1,0.0,8.0,False,Rh8Se16,Rh8Se16,4.35,Other,True,Rh33.333Se66.667,Rh-Se,2,Supercon,Rh1Se2,MP-mp-1192175,Rh8Se16,Rh-Se,Rh33.333Se66.667,P n m a,orthorhombic,3.789183,6.02896,21.222951,data/final/MP/cifs/Rh1Se2-MP-mp-1192175.cif,data/source/MP/raw/cifs/mp-1192175.cif,mp-1192175,0.0,,2019-01-11 22:16:22.535000,7.146532597634877,,,{'GGA': {'task_id': 'mp-1735789'}},0.0,4.94409286,520.0,-125.11554259,-5.2131476079166665,{'tags': ['Rhodium selenide (1/2)']},-125.11554259,-5.2131476079166665,-0.7424373328125,['bandstructure'],True,[650286],True,2021-05-12 10:58:35.561000,NM,24,5,mp-1192175,,RhSe2,"{'functional': 'PBE', 'labels': ['Rh_pv', 'Se'], 'pot_type': 'paw'}","{'Rh': 1.0, 'Se': 2.0}",GGA,mp-1192175,"['mp-1192175', 'mp-1400105', 'mp-1735789', 'mp-1823453', 'mp-1585083']",2.24875e-05,"{'Rh': 8.0, 'Se': 16.0}",484.8347658374243,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.710542491507806e-07,2.24875e-05,0,0.0001799,MP,data/source/MP/cleaned/cifs/MP-mp-1192175.cif,False,,data/final/MP/graphs/Rh1Se2-MP-mp-1192175.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Pd1Tl2,1,0.0,2.0,False,Pd2Tl4,Pd2Tl4,1.32,Other,True,Pd33.333Tl66.667,Pd-Tl,2,Supercon,Pd1Tl2,MP-mp-570896,Tl4Pd2,Pd-Tl,Pd33.333Tl66.667,I 4/m c m,tetragonal,5.690531588983088,5.69053159,5.69053159,data/final/MP/cifs/Pd1Tl2-MP-mp-570896.cif,data/source/MP/raw/cifs/mp-570896.cif,mp-570896,0.0,,2014-02-16 13:07:44,12.240630699071868,10.17188/1275990,"@misc{osti_1275990,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Tl2Pd (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1275990"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699723'}},0.0,6.60456967,520.0,-20.55701302,-3.4261688366666667,{'tags': ['Palladium thallium (1/2)']},-20.55701302,-3.4261688366666667,-0.124446135555555,"['xas', 'elasticity', 'bandstructure']",True,"[649064, 102796, 649057]",True,2021-05-12 10:56:27.046000,NM,6,10,mp-570896,,Tl2Pd,"{'functional': 'PBE', 'labels': ['Tl_d', 'Pd'], 'pot_type': 'paw'}","{'Tl': 2.0, 'Pd': 1.0}",GGA,mp-570896,"['mp-941536', 'mp-941235', 'mp-934754', 'mp-570896', 'mp-1077324', 'mp-1077371', 'mp-1417388', 'mp-1699723', 'mp-1779615', 'mp-1591346']",0.00180655,"{'Tl': 4.0, 'Pd': 2.0}",139.7783328196796,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0]",2.584878447978817e-05,0.00180655,0,0.0036131,MP,data/source/MP/cleaned/cifs/MP-mp-570896.cif,False,,data/final/MP/graphs/Pd1Tl2-MP-mp-570896.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
C1Rh1,1,0.0,1.0,True,C1Rh1,C1Rh1,1.666666667,Other,True,C50Rh50,C-Rh,2,Supercon,C1Rh1,MP-mp-1009696,Rh1C1,C-Rh,C50Rh50,F -4 3 m,cubic,3.2537165,3.253716501396477,3.2537165000000003,data/final/MP/cifs/C1Rh1-MP-mp-1009696.cif,data/source/MP/raw/cifs/mp-1009696.cif,mp-1009696,0.0,,2016-09-22 04:22:47,7.834406991237518,10.17188/1326274,"@misc{osti_1326274,
    author = ""Persson, Kristin"",
    title = ""Materials Data on RhC (SG:216) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1326274"",
    place = ""United States"",
    year = ""2016"",
    month = ""9"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687924'}},0.5597167499999998,5.94528696,520.0,-15.47165507,-7.735827535,{'tags': ['Rhodium carbide (1/1) - ZB-type']},-15.47165507,-7.735827535,0.5597167499999998,"['xas', 'elasticity', 'bandstructure']",True,[183172],True,2021-05-12 10:56:08.727000,NM,2,12,mp-1009696,,RhC,"{'functional': 'PBE', 'labels': ['Rh_pv', 'C'], 'pot_type': 'paw'}","{'Rh': 1.0, 'C': 1.0}",GGA,mp-1009696,"['mp-1059717', 'mp-1059778', 'mp-1059740', 'mp-1009696', 'mp-1009744', 'mp-1009758', 'mp-1436316', 'mp-1687924', 'mp-1793336', 'mp-1009772', 'mp-1612052', 'mp-1059763']",0.0008668,"{'Rh': 1.0, 'C': 1.0}",24.35702404772268,[],NM,False,216,0,"[0, 0]",3.5587270361998255e-05,0.0008668,0,0.0008668,MP,data/source/MP/cleaned/cifs/MP-mp-1009696.cif,False,,data/final/MP/graphs/C1Rh1-MP-mp-1009696.json,0,True,-43m,5,0,0,0,0,0,0,0,0,0,1,1.0,False
La0.9Sr0.1Ti1O3,3,0.0933333333333333,3.0,False,La2.7Sr0.3Ti3O9,La2Sr1Ti3O9,0.0,Oxide,True,La18Sr2Ti20O60,La-Sr-Ti-O,4,Supercon,La0.9Sr0.1Ti1O3,MP-mp-1218904,Sr1La2Ti3O9,La-Sr-Ti-O,La13.333Sr6.667Ti20O60,P -3 m 1,trigonal,5.585068000772868,5.5850682,6.830672,data/final/MP/cifs/La0.9Sr0.1Ti1O3-MP-mp-1218904-synth_doped.cif,data/source/MP/raw/cifs/mp-1218904.cif,mp-1218904,0.0,,2019-01-12 19:59:48.166000,5.876637677567727,,,{'GGA': {'task_id': 'mp-1736640'}},0.023043555354187,8.53292476,520.0,-127.7619896,-8.517465973333334,{'tags': []},-127.7619896,-8.517465973333334,-3.611023789444446,[],False,[],True,2021-05-12 11:00:42.526000,NM,15,4,mp-1218904,oxide,SrLa2Ti3O9,"{'functional': 'PBE', 'labels': ['Sr_sv', 'La', 'Ti_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 1.0, 'La': 2.0, 'Ti': 3.0, 'O': 9.0}",GGA,mp-1218904,"['mp-1218904', 'mp-1406224', 'mp-1736640', 'mp-1828534']",0.0004049,"{'Sr': 1.0, 'La': 2.0, 'Ti': 3.0, 'O': 9.0}",184.52321560267407,[],NM,False,164,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.194303836932117e-06,0.0004049,0,0.0004049,MP,data/source/MP/cleaned/cifs/MP-mp-1218904.cif,True,,data/final/MP/graphs/La0.9Sr0.1Ti1O3-MP-mp-1218904-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
B1.96F0.04Mg1,2,0.0266666666666666,1.0,True,B1.96F0.04Mg1,B2Mg1,30.0,Other,True,B65.333F1.333Mg33.333,B-F-Mg,3,Supercon,Mg1B1.96F0.04,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B1.96F0.04Mg1-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B1.96F0.04Mg1-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
B2Er1Rh3,1,0.0,1.0,True,B2Er1Rh3,B2Er1Rh3,0.0,Other,True,B33.333Er16.667Rh50,B-Er-Rh,3,Supercon,Er1Rh3B2,MP-mp-5678,Er1B2Rh3,B-Er-Rh,B33.333Er16.667Rh50,P 6/m m m,hexagonal,3.121585,5.425844001330649,5.42584336,data/final/MP/cifs/B2Er1Rh3-MP-mp-5678.cif,data/source/MP/raw/cifs/mp-5678.cif,mp-5678,0.0,,2011-05-13 09:49:54,10.382141715294225,10.17188/1274057,"@misc{osti_1274057,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ErB2Rh3 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1274057"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677748'}},0.0122056085294115,6.36128031,520.0,-44.2676231,-7.377937183333334,"{'tags': ['Erbium trirhodium(I) boride', 'Erbium rhodium boride (1/3/2)']}",-44.2676231,-7.377937183333334,-0.7080328563888886,"['xas', 'bandstructure']",True,"[81614, 72568, 613803, 656228]",True,2021-05-12 10:57:23.123000,NM,6,9,mp-5678,,ErB2Rh3,"{'functional': 'PBE', 'labels': ['Er_3', 'B', 'Rh_pv'], 'pot_type': 'paw'}","{'Er': 1.0, 'B': 2.0, 'Rh': 3.0}",GGA,mp-5678,"['mp-5678', 'mp-923599', 'mp-922818', 'mp-908517', 'mp-1077574', 'mp-1438488', 'mp-1677748', 'mp-1799957', 'mp-1587673']",0.0068778,"{'Er': 1.0, 'B': 2.0, 'Rh': 3.0}",79.58667015450935,[],NM,False,191,0,"[-0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",8.64189943698795e-05,0.0068778,0,0.0068778,MP,data/source/MP/cleaned/cifs/MP-mp-5678.cif,False,,data/final/MP/graphs/B2Er1Rh3-MP-mp-5678.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ga1Mn0.102V2.898,3,0.0509999999999999,2.0,False,Ga2Mn0.204V5.796,Ga2V6,9.0,Other,True,Ga25Mn2.55V72.45,Ga-Mn-V,3,Supercon,V2.898Mn0.102Ga1,MP-mp-22568,V6Ga2,Ga-V,Ga25V75,P m -3 n,cubic,4.789645,4.789645,4.789645,data/final/MP/cifs/Ga1Mn0.102V2.898-MP-mp-22568-synth_doped.cif,data/source/MP/raw/cifs/mp-22568.cif,mp-22568,0.0,,2014-02-22 11:36:40,6.726541666276222,10.17188/1198793,"@misc{osti_1198793,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Ga (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198793"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686867'}},0.0,5.67452231,520.0,-61.95244347,-7.74405543375,{'tags': ['Gallium vanadium (1/3)']},-61.95244347,-7.74405543375,-0.1741018756249994,"['xas', 'elasticity', 'bandstructure']",True,"[635643, 635628, 635619, 635634, 104021, 635646, 635604, 635610, 635617, 635624, 635626, 635605, 635631, 635625, 635636, 635603, 104020, 635616, 635607]",True,2021-05-12 10:56:16.728000,FM,8,9,mp-22568,,V3Ga,"{'functional': 'PBE', 'labels': ['V_pv', 'Ga_d'], 'pot_type': 'paw'}","{'V': 3.0, 'Ga': 1.0}",GGA,mp-22568,"['mp-941343', 'mp-941663', 'mp-934924', 'mp-22568', 'mp-1440749', 'mp-1686867', 'mp-1804076', 'mp-1593784', 'mp-1595713']",0.09063635,"{'V': 6.0, 'Ga': 2.0}",109.87780534443452,[],FM,True,131,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.0, -0.0, -0.0]",0.0016497662965852,0.09063635,2,0.1812727,MP,data/source/MP/cleaned/cifs/MP-mp-22568.cif,True,,data/final/MP/graphs/Ga1Mn0.102V2.898-MP-mp-22568-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
As1Fe1Gd1O0.85,3,0.0584415584415584,2.0,False,As2Fe2Gd2O1.7,As2Fe2Gd2O2,53.5,Ferrite,True,As25.974Fe25.974Gd25.974O22.07792207792208,As-Fe-Gd-O,4,Supercon,Gd1Fe1As1O0.85,MP-mp-1078679,Gd2Fe2As2O2,As-Fe-Gd-O,As25Fe25Gd25O25,P 4/n m m,tetragonal,3.996524,3.996524,9.110606,data/final/MP/cifs/As1Fe1Gd1O0.85-MP-mp-1078679-synth_doped.cif,data/source/MP/raw/cifs/mp-1078679.cif,mp-1078679,0.0,,2018-04-12 14:54:44,6.938465251324023,,,{'GGA+U': {'task_id': 'mp-1704492'}},0.2756975050000001,4.06882668,520.0,-71.78498399,-8.97312299875,{'tags': ['Gadolinium iron arsenic oxide (1/1/1/1)']},-71.78498399,-8.97312299875,-1.670570473750001,['bandstructure'],True,"[425013, 422003, 425006, 425015, 425010, 236655, 425016]",True,2021-05-12 10:58:16.596000,FM,8,10,mp-1078679,oxide,GdFeAsO,"{'functional': 'PBE', 'labels': ['Gd', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Gd': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-1078679,"['mp-1078679', 'mp-1079389', 'mp-1079927', 'mp-1080502', 'mp-1080613', 'mp-1095209', 'mp-1438268', 'mp-1704492', 'mp-1864230', 'mp-1589235']",10.7990939,"{'Gd': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",145.5164583479414,[],FM,True,129,2,"[6.9, 6.9, 3.6, 3.6, 0.0, 0.0, 0.0, 0.0]",0.1484243641248952,10.7990939,4,21.5981878,MP,data/source/MP/cleaned/cifs/MP-mp-1078679.cif,True,,data/final/MP/graphs/As1Fe1Gd1O0.85-MP-mp-1078679-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B5Mo1.7Ti0.3,3,0.0857142857142857,1.0,True,B5Mo1.7Ti0.3,B5Mo2,7.1,Other,True,B71.429Mo24.286Ti4.286,B-Mo-Ti,3,Supercon,B5Mo1.7Ti0.3,MP-mp-7229,B5Mo2,B-Mo,B71.429Mo28.571,R -3 m,trigonal,3.086062143206312,3.086062143206312,7.38317517,data/final/MP/cifs/B5Mo1.7Ti0.3-MP-mp-7229-synth_doped.cif,data/source/MP/raw/cifs/mp-7229.cif,mp-7229,0.0,,2011-05-27 17:15:57,6.910597742884047,10.17188/1287525,"@misc{osti_1287525,
    author = ""Persson, Kristin"",
    title = ""Materials Data on B5Mo2 (SG:166) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1287525"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678538'}},0.4354736101190504,10.26159619,520.0,-54.63026953,-7.804324218571429,"{'tags': ['Molybdenum boride (2/5)', 'Molybdenum boride (1/2.5) - epsilon']}",-54.63026953,-7.804324218571429,0.0654250548809522,['bandstructure'],True,"[157530, 614795, 614810, 24282]",True,2021-05-12 10:58:55.498000,NM,7,11,mp-7229,,B5Mo2,"{'functional': 'PBE', 'labels': ['B', 'Mo_pv'], 'pot_type': 'paw'}","{'B': 5.0, 'Mo': 2.0}",GGA,mp-7229,"['mp-1001204', 'mp-7229', 'mp-1007569', 'mp-1077992', 'mp-1078025', 'mp-1078031', 'mp-1441558', 'mp-1678538', 'mp-1793658', 'mp-1012321', 'mp-1593525']",0.0189101,"{'B': 5.0, 'Mo': 2.0}",59.09541989544843,[],NM,False,166,0,"[0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0]",0.0003199926497426,0.0189101,0,0.0189101,MP,data/source/MP/cleaned/cifs/MP-mp-7229.cif,True,,data/final/MP/graphs/B5Mo1.7Ti0.3-MP-mp-7229-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Au0.7Nb3Rh0.3,3,0.15,1.0,True,Au0.7Nb3Rh0.3,Au1Nb3,9.5,Other,True,Au17.5Nb75Rh7.5,Au-Nb-Rh,3,Supercon,Nb3Rh0.3Au0.7,MP-mp-1220645,Nb3Au1,Au-Nb,Au25Nb75,C m m m,orthorhombic,2.8256924000000003,2.8256924,9.314665,data/final/MP/cifs/Au0.7Nb3Rh0.3-MP-mp-1220645-synth_doped.cif,data/source/MP/raw/cifs/mp-1220645.cif,mp-1220645,0.0,,2019-01-12 21:27:35.806000,10.906576218653324,,,{'GGA': {'task_id': 'mp-1767853'}},0.0207435650000036,5.24602198,520.0,-33.86354254,-8.465885635,{'tags': []},-33.86354254,-8.465885635,-0.07143647,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,4,5,mp-1220645,,Nb3Au,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Au'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Au': 1.0}",GGA,mp-1220645,"['mp-1220645', 'mp-1416545', 'mp-1767853', 'mp-1799245', 'mp-1612990']",0.0051374,"{'Nb': 3.0, 'Au': 1.0}",72.42370908909766,[],NM,False,65,0,"[0, 0, 0, 0]",7.093533408624279e-05,0.0051374,0,0.0051374,MP,data/source/MP/cleaned/cifs/MP-mp-1220645.cif,True,,data/final/MP/graphs/Au0.7Nb3Rh0.3-MP-mp-1220645-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ga0.999V3Zn0.001,2,0.0005,2.0,False,Ga1.998V6Zn0.002,Ga2V6,10.2,Other,True,Ga24.975V75Zn0.025,Ga-V-Zn,3,Supercon,V3Ga0.999Zn0.001,MP-mp-22568,V6Ga2,Ga-V,Ga25V75,P m -3 n,cubic,4.789645,4.789645,4.789645,data/final/MP/cifs/Ga0.999V3Zn0.001-MP-mp-22568-synth_doped.cif,data/source/MP/raw/cifs/mp-22568.cif,mp-22568,0.0,,2014-02-22 11:36:40,6.726541666276222,10.17188/1198793,"@misc{osti_1198793,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Ga (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198793"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686867'}},0.0,5.67452231,520.0,-61.95244347,-7.74405543375,{'tags': ['Gallium vanadium (1/3)']},-61.95244347,-7.74405543375,-0.1741018756249994,"['xas', 'elasticity', 'bandstructure']",True,"[635643, 635628, 635619, 635634, 104021, 635646, 635604, 635610, 635617, 635624, 635626, 635605, 635631, 635625, 635636, 635603, 104020, 635616, 635607]",True,2021-05-12 10:56:16.728000,FM,8,9,mp-22568,,V3Ga,"{'functional': 'PBE', 'labels': ['V_pv', 'Ga_d'], 'pot_type': 'paw'}","{'V': 3.0, 'Ga': 1.0}",GGA,mp-22568,"['mp-941343', 'mp-941663', 'mp-934924', 'mp-22568', 'mp-1440749', 'mp-1686867', 'mp-1804076', 'mp-1593784', 'mp-1595713']",0.09063635,"{'V': 6.0, 'Ga': 2.0}",109.87780534443452,[],FM,True,131,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.0, -0.0, -0.0]",0.0016497662965852,0.09063635,2,0.1812727,MP,data/source/MP/cleaned/cifs/MP-mp-22568.cif,True,,data/final/MP/graphs/Ga0.999V3Zn0.001-MP-mp-22568-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
C0.77Nb1,3,0.1299435028248587,1.0,True,C0.77Nb1,C1Nb1,0.0,Other,True,C43.503Nb56.497,C-Nb,2,Supercon,Nb1C0.77,MP-mp-910,Nb1C1,C-Nb,C50Nb50,F m -3 m,cubic,3.18634336,3.1863433599999995,3.1863433599999995,data/final/MP/cifs/C0.77Nb1-MP-mp-910-synth_doped.cif,data/source/MP/raw/cifs/mp-910.cif,mp-910,0.0,,2011-05-12 17:28:40,7.616098778357742,10.17188/1282001,"@misc{osti_1282001,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbC (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1282001"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686610'}},0.0408750508333302,7.39992982,520.0,-20.24633413,-10.123167065,"{'tags': ['Niobium carbide (1/1)', 'Niobium carbide (1/1) - RS-type']}",-20.24633413,-10.123167065,-0.4591241950000011,"['xas', 'elasticity', 'bandstructure']",True,"[618465, 77214, 187077, 618456, 181792, 618453, 94449, 618472, 183163, 237582, 618457, 159872, 618480, 618475, 618482, 618469, 155164, 618466, 44355, 618450, 618458, 618449, 44496, 618463, 618462, 618460, 618481, 618471, 618476, 181052, 601142, 618448, 189089, 618478, 26955, 618473, 618484, 618483]",True,2021-05-12 10:56:35.166000,NM,2,25,mp-910,,NbC,"{'functional': 'PBE', 'labels': ['Nb_pv', 'C'], 'pot_type': 'paw'}","{'Nb': 1.0, 'C': 1.0}",GGA,mp-910,"['mp-1000444', 'mp-1001333', 'mp-910', 'mp-1057158', 'mp-1057178', 'mp-1057130', 'mp-1057651', 'mp-1057669', 'mp-1057682', 'mp-1057771', 'mp-1057779', 'mp-1057802', 'mp-1060960', 'mp-1060978', 'mp-1061015', 'mp-1440938', 'mp-1686610', 'mp-1805660', 'mp-1007673', 'mp-1593845', 'mp-1596940', 'mp-1061007', 'mp-1057677', 'mp-1057792', 'mp-1057174']",3.33e-05,"{'Nb': 1.0, 'C': 1.0}",22.87508541625878,[],NM,False,225,0,"[0, 0]",1.4557322691495426e-06,3.33e-05,0,3.33e-05,MP,data/source/MP/cleaned/cifs/MP-mp-910.cif,True,,data/final/MP/graphs/C0.77Nb1-MP-mp-910-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
La1N0.98,2,0.0101010101010101,2.0,False,La2N1.96,La2N2,0.0,Other,True,La50.505N49.495,La-N,2,Supercon,La1N0.98,MP-mp-567290,La2N2,La-N,La50N50,P 63 m c,hexagonal,4.132863999720982,4.13286468,5.960067,data/final/MP/cifs/La1N0.98-MP-mp-567290-synth_doped.cif,data/source/MP/raw/cifs/mp-567290.cif,mp-567290,1.1489000000000005,,2013-09-22 15:00:24,5.76019316242597,10.17188/1273789,"@misc{osti_1273789,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaN (SG:186) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1273789"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1712385'}},0.0,6.32236946,520.0,-31.82808387,-7.9570209675,{'tags': ['Lanthanum nitride']},-31.82808387,-7.9570209675,-1.5012699525000004,"['piezo', 'bandstructure', 'diel', 'phonons', 'elasticity']",True,[162195],True,2021-05-12 10:56:22.739000,NM,4,10,mp-567290,,LaN,"{'functional': 'PBE', 'labels': ['La', 'N'], 'pot_type': 'paw'}","{'La': 1.0, 'N': 1.0}",GGA,mp-567290,"['mp-655510', 'mp-663539', 'mp-658377', 'mp-567290', 'mp-1141817', 'mp-1119521', 'mp-1434771', 'mp-1712385', 'mp-1801348', 'mp-1617444']",6e-06,"{'La': 2.0, 'N': 2.0}",88.16254069390989,[],NM,False,186,0,"[0, 0, 0, 0]",1.3611222981495748e-07,6e-06,0,1.2e-05,MP,data/source/MP/cleaned/cifs/MP-mp-567290.cif,True,,data/final/MP/graphs/La1N0.98-MP-mp-567290-synth_doped.json,0,True,6mm,0,5,0,0,0,0,0,1,0,0,0,1.0,False
Ge1.85La1,2,0.0350877192982456,2.0,False,Ge3.7La2,Ge4La2,2.17,Other,True,Ge64.912La35.088,Ge-La,2,Supercon,Ge1.85La1,MP-mp-19761,La2Ge4,Ge-La,Ge66.667La33.333,I 41/a m d,tetragonal,4.320984000934922,4.320984000934921,8.41484573,data/final/MP/cifs/Ge1.85La1-MP-mp-19761-synth_doped.cif,data/source/MP/raw/cifs/mp-19761.cif,mp-19761,0.0,,2014-02-21 13:34:05,6.447172399329149,10.17188/1194966,"@misc{osti_1194966,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaGe2 (SG:141) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1194966"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703381'}},0.0059020154166642,6.2456377,520.0,-32.49839164,-5.416398606666667,"{'tags': ['Lanthanum germanide (1/2)', 'Germanium lanthanum (2/1)']}",-32.49839164,-5.416398606666667,-0.6890443350000002,"['xas', 'elasticity', 'bandstructure']",True,"[636796, 636784, 57072]",True,2021-05-12 10:56:14.760000,NM,6,6,mp-19761,,LaGe2,"{'functional': 'PBE', 'labels': ['La', 'Ge_d'], 'pot_type': 'paw'}","{'La': 1.0, 'Ge': 2.0}",GGA,mp-19761,"['mp-19761', 'mp-20013', 'mp-1438339', 'mp-1703381', 'mp-1780058', 'mp-1596448']",0.0002277,"{'La': 2.0, 'Ge': 4.0}",146.3900903733194,[],NM,False,141,0,"[0, 0, 0, 0, 0, 0]",3.110866308222457e-06,0.0002277,0,0.0004554,MP,data/source/MP/cleaned/cifs/MP-mp-19761.cif,True,,data/final/MP/graphs/Ge1.85La1-MP-mp-19761-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ce1In5Ir0.978Pt0.022,2,0.0062857142857142,1.0,True,Ce1In5Ir0.978Pt0.022,Ce1In5Ir1,0.734,Heavy_fermion,True,Ce14.286In71.429Ir13.971Pt0.314,Ce-In-Ir-Pt,4,Supercon,Ce1Ir0.978Pt0.022In5,MP-mp-20975,Ce1In5Ir1,Ce-In-Ir,Ce14.286In71.429Ir14.286,P 4/m m m,tetragonal,4.724199,4.724199,7.575801,data/final/MP/cifs/Ce1In5Ir0.978Pt0.022-MP-mp-20975-synth_doped.cif,data/source/MP/raw/cifs/mp-20975.cif,mp-20975,0.0,,2014-02-21 16:15:16,8.902153726103897,10.17188/1196209,"@misc{osti_1196209,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeIn5Ir (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196209"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688300'}},0.0,8.1498488,520.0,-31.20695684,-4.458136691428572,{'tags': ['Cerium iridium indide (1/1/5)']},-31.20695684,-4.458136691428572,-0.3824312307142854,"['xas', 'bandstructure']",True,[150225],True,2021-05-12 10:56:57.051000,FM,7,8,mp-20975,,CeIn5Ir,"{'functional': 'PBE', 'labels': ['Ce', 'In_d', 'Ir'], 'pot_type': 'paw'}","{'Ce': 1.0, 'In': 5.0, 'Ir': 1.0}",GGA,mp-20975,"['mp-919528', 'mp-918523', 'mp-905302', 'mp-20975', 'mp-1300982', 'mp-1688300', 'mp-1832383', 'mp-1591628']",0.1040192,"{'Ce': 1.0, 'In': 5.0, 'Ir': 1.0}",169.077152414387,[],FM,True,123,1,"[0.1, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0006152173638757,0.1040192,1,0.1040192,MP,data/source/MP/cleaned/cifs/MP-mp-20975.cif,True,,data/final/MP/graphs/Ce1In5Ir0.978Pt0.022-MP-mp-20975-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Pt0.5W0.5,1,0.0,2.0,False,Pt1W1,Pt1W1,1.45,Other,True,Pt50W50,Pt-W,2,Supercon,Pt0.5W0.5,MP-mp-1219711,Pt1W1,Pt-W,Pt50W50,R -3 m,trigonal,2.8133717810556305,2.813371781055631,4.88791014,data/final/MP/cifs/Pt0.5W0.5-MP-mp-1219711.cif,data/source/MP/raw/cifs/mp-1219711.cif,mp-1219711,0.0,,2019-01-12 20:40:23.171000,19.91145394563403,,,{'GGA': {'task_id': 'mp-1674667'}},0.2065451150000008,7.59110784,520.0,-19.12008856,-9.56004428,{'tags': []},-19.12008856,-9.56004428,-0.0455271899999996,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,2,5,mp-1219711,,PtW,"{'functional': 'PBE', 'labels': ['Pt', 'W_pv'], 'pot_type': 'paw'}","{'Pt': 1.0, 'W': 1.0}",GGA,mp-1219711,"['mp-1219711', 'mp-1414335', 'mp-1674667', 'mp-1792593', 'mp-1609705']",1e-06,"{'Pt': 1.0, 'W': 1.0}",31.60081162281504,[],NM,False,166,0,"[0, 0]",3.164475684789132e-08,1e-06,0,1e-06,MP,data/source/MP/cleaned/cifs/MP-mp-1219711.cif,False,,data/final/MP/graphs/Pt0.5W0.5-MP-mp-1219711.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ba2Cu3Ho1O7,1,0.0,1.0,True,Ba2Cu3Ho1O7,Ba2Cu3Ho1O7,92.475,Cuprate,True,Ba15.385Cu23.077Ho7.692O53.84615384615385,Ba-Cu-Ho-O,4,Supercon,Ho1Ba2Cu3O7,MP-mp-6616,Ba2Ho1Cu3O7,Ba-Cu-Ho-O,Ba15.385Cu23.077Ho7.692O53.84615384615385,P m m m,orthorhombic,3.836729,3.919335,11.791186,data/final/MP/cifs/Ba2Cu3Ho1O7-MP-mp-6616.cif,data/source/MP/raw/cifs/mp-6616.cif,mp-6616,0.0,,2011-05-15 07:21:38,6.951037787400714,10.17188/1281393,"@misc{osti_1281393,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2HoCu3O7 (SG:47) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281393"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702487'}},0.0318518344551108,3.24845985,520.0,-79.03208407,-6.079391082307692,"{'tags': ['Holmium dibarium dicopper copper(III) oxide', 'Holmium dibarium tricopper heptaoxide']}",-79.03208407,-6.079391082307692,-2.1913374226923072,['bandstructure'],True,"[81174, 68044]",True,2021-05-12 10:58:51.532000,NM,13,8,mp-6616,oxide,Ba2HoCu3O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ho_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Ho': 1.0, 'Cu': 3.0, 'O': 7.0}",GGA,mp-6616,"['mp-922636', 'mp-923410', 'mp-908210', 'mp-6616', 'mp-1475744', 'mp-1702487', 'mp-1831544', 'mp-1602206']",0.000595,"{'Ba': 2.0, 'Ho': 1.0, 'Cu': 3.0, 'O': 7.0}",177.30908993652352,[],NM,False,47,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.3557219216059904e-06,0.000595,0,0.000595,MP,data/source/MP/cleaned/cifs/MP-mp-6616.cif,False,,data/final/MP/graphs/Ba2Cu3Ho1O7-MP-mp-6616.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ba0.635Bi1K0.365O3,2,0.0126666666666666,3.0,False,Ba1.905Bi3K1.095O9,Ba2Bi3K1O9,30.4,Oxide,True,Ba12.7Bi20K7.3O60,Ba-Bi-K-O,4,Supercon,Ba0.635K0.365Bi1O3,MP-mp-1223518,K1Ba2Bi3O9,Ba-Bi-K-O,Ba13.333Bi20K6.667O60,P -3 m 1,trigonal,6.18756400330999,6.187564340000001,7.581401,data/final/MP/cifs/Ba0.635Bi1K0.365O3-MP-mp-1223518-synth_doped.cif,data/source/MP/raw/cifs/mp-1223518.cif,mp-1223518,0.0,,2019-01-12 23:54:06.965000,7.16530091201999,,,{'GGA': {'task_id': 'mp-1729135'}},0.001551682833333,3.46143017,520.0,-85.22271396,-5.681514264,{'tags': []},-85.22271396,-5.681514264,-2.0170414252000004,[],False,[],True,2021-05-12 11:00:52.054000,NM,15,4,mp-1223518,oxide,KBa2(BiO3)3,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Bi', 'O'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 2.0, 'Bi': 3.0, 'O': 9.0}",GGA,mp-1223518,"['mp-1223518', 'mp-1391182', 'mp-1729135', 'mp-1775199']",4.99e-05,"{'K': 1.0, 'Ba': 2.0, 'Bi': 3.0, 'O': 9.0}",251.37352739849624,[],NM,False,164,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.9850936777799505e-07,4.99e-05,0,4.99e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1223518.cif,True,,data/final/MP/graphs/Ba0.635Bi1K0.365O3-MP-mp-1223518-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
As1Ce1F0.16Fe1O0.84,3,0.08,2.0,False,As2Ce2F0.32Fe2O1.68,As2Ce2Fe2O2,40.85,Ferrite,True,As25Ce25F4Fe25O21,As-Ce-F-Fe-O,5,Supercon,Ce1Fe1As1F0.16O0.84,MP-mp-605060,Ce2Fe2As2O2,As-Ce-Fe-O,As25Ce25Fe25O25,P 4 m m,tetragonal,3.992256,3.992256,9.041971,data/final/MP/cifs/As1Ce1F0.16Fe1O0.84-MP-mp-605060-synth_doped.cif,data/source/MP/raw/cifs/mp-605060.cif,mp-605060,0.0,,2014-02-14 20:12:08,6.611233843492404,10.17188/1277425,"@misc{osti_1277425,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeFeAsO (SG:99) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277425"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-1751604'}},0.2072581873958352,6.30288445,520.0,-55.74271596,-6.967839495,{'tags': []},-55.74271596,-6.967839495,-1.7010452412499992,['bandstructure'],True,[],True,2021-05-12 10:58:51.532000,FiM,8,10,mp-605060,oxide,CeFeAsO,"{'functional': 'PBE', 'labels': ['Ce', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-605060,"['mp-605060', 'mp-917114', 'mp-918266', 'mp-919274', 'mp-1443189', 'mp-1751604', 'mp-1770633', 'mp-1779614', 'mp-1873964', 'mp-1622328']",2.99945325,"{'Ce': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",144.11191005541338,[],FiM,True,99,3,"[-0.5, -0.5, 3.5, 3.5, 0.0, 0.0, 0.0, 0.0]",0.0416267225775671,2.99945325,4,5.9989065,MP,data/source/MP/cleaned/cifs/MP-mp-605060.cif,True,,data/final/MP/graphs/As1Ce1F0.16Fe1O0.84-MP-mp-605060-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
Gd1Ru2,1,0.0,2.0,False,Gd2Ru4,Gd2Ru4,0.0,Other,True,Gd33.333Ru66.667,Gd-Ru,2,Supercon,Gd1Ru2,MP-mp-646926,Gd2Ru4,Gd-Ru,Gd33.333Ru66.667,F d -3 m,cubic,5.369016529999999,5.369016529999999,5.369016529999999,data/final/MP/cifs/Gd1Ru2-MP-mp-646926.cif,data/source/MP/raw/cifs/mp-646926.cif,mp-646926,0.0,,2014-02-24 13:37:21,10.906260213896577,10.17188/1280660,"@misc{osti_1280660,
    author = ""Persson, Kristin"",
    title = ""Materials Data on GdRu2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1280660"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688626'}},0.0,5.66419249,520.0,-66.78972308,-11.131620513333331,{'tags': ['Gadolinium ruthenium (1/2)']},-66.78972308,-11.131620513333331,-0.2566533299999989,"['xas', 'bandstructure']",True,[106830],True,2021-05-12 10:57:32.679000,FiM,6,6,mp-646926,,GdRu2,"{'functional': 'PBE', 'labels': ['Gd', 'Ru_pv'], 'pot_type': 'paw'}","{'Gd': 1.0, 'Ru': 2.0}",GGA,mp-646926,"['mp-646926', 'mp-1300993', 'mp-1659202', 'mp-1688626', 'mp-1804665', 'mp-1589222']",6.62387805,"{'Gd': 2.0, 'Ru': 4.0}",109.43827186242363,[],FiM,True,166,2,"[7.0, 7.0, -0.2, -0.3, -0.3, -0.3]",0.1210523144650341,6.62387805,6,13.2477561,MP,data/source/MP/cleaned/cifs/MP-mp-646926.cif,False,,data/final/MP/graphs/Gd1Ru2-MP-mp-646926.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Hf2Ru3Si4,1,0.0,4.0,False,Hf8Ru12Si16,Hf8Ru12Si16,0.0,Other,True,Hf22.222Ru33.333Si44.444,Hf-Ru-Si,3,Supercon,Hf2Ru3Si4,MP-mp-31022,Hf8Si16Ru12,Hf-Ru-Si,Hf22.222Ru33.333Si44.444,C 1 2/c 1,monoclinic,5.357558000120939,9.87355966,10.974775086388505,data/final/MP/cifs/Hf2Ru3Si4-MP-mp-31022.cif,data/source/MP/raw/cifs/mp-31022.cif,mp-31022,0.0,,2014-02-21 05:16:21,9.550419923808406,10.17188/1205354,"@misc{osti_1205354,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Hf2Si4Ru3 (SG:15) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1205354"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1736740'}},0.0069152303240738,8.81056168,520.0,-308.04581159,-8.556828099722223,{'tags': ['Hafnium ruthenium silicide (2/3/4)']},-308.04581159,-8.556828099722223,-0.8098500169444441,"['xas', 'bandstructure']",True,[60071],True,2021-05-12 10:57:04.957000,NM,36,8,mp-31022,,Hf2Si4Ru3,"{'functional': 'PBE', 'labels': ['Hf_pv', 'Si', 'Ru_pv'], 'pot_type': 'paw'}","{'Hf': 2.0, 'Si': 4.0, 'Ru': 3.0}",GGA,mp-31022,"['mp-943288', 'mp-942231', 'mp-933023', 'mp-31022', 'mp-1144740', 'mp-1400101', 'mp-1736740', 'mp-1869729']",0.000201375,"{'Hf': 8.0, 'Si': 16.0, 'Ru': 12.0}",537.2829996723675,[],NM,False,15,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.4992099144979274e-06,0.000201375,0,0.0008055,MP,data/source/MP/cleaned/cifs/MP-mp-31022.cif,False,,data/final/MP/graphs/Hf2Ru3Si4-MP-mp-31022.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
Ce1Pt3Si1,1,0.0,1.0,True,Ce1Pt3Si1,Ce1Pt3Si1,0.669222222,Heavy_fermion,True,Ce20Pt60Si20,Ce-Pt-Si,3,Supercon,Ce1Pt3Si1,MP-mp-1207119,Ce1Si1Pt3,Ce-Pt-Si,Ce20Pt60Si20,P 4 m m,tetragonal,4.067884,4.067884,5.552623,data/final/MP/cifs/Ce1Pt3Si1-MP-mp-1207119.cif,data/source/MP/raw/cifs/mp-1207119.cif,mp-1207119,0.0,,2019-01-12 10:17:34.047000,13.616649050512317,,,,0.0,7.99187805,520.0,-34.84666915,-6.969333829999999,"{'tags': ['CePt3Si', 'CePt3B']}",-34.84666915,-6.969333829999999,-1.0409085689999995,[],False,[],True,2021-05-12 11:00:19.396000,NM,5,2,mp-1207119,,CeSiPt3,"{'functional': 'PBE', 'labels': ['Ce', 'Si', 'Pt'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Si': 1.0, 'Pt': 3.0}",GGA,mp-1207119,"['mp-1207119', 'mp-1923489']",0.0099182,"{'Ce': 1.0, 'Si': 1.0, 'Pt': 3.0}",91.88302988314366,[],NM,False,99,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",0.0001079437629844,0.0099182,0,0.0099182,MP,data/source/MP/cleaned/cifs/MP-mp-1207119.cif,False,,data/final/MP/graphs/Ce1Pt3Si1-MP-mp-1207119.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
Nd0.2Ru2Th0.8,3,0.1333333333333333,2.0,False,Nd0.4Ru4Th1.6,Ru4Th2,4.55,Other,True,Nd6.667Ru66.667Th26.667,Nd-Ru-Th,3,Supercon,Th0.8Nd0.2Ru2,MP-mp-574438,Th2Ru4,Ru-Th,Ru66.667Th33.333,F d -3 m,cubic,5.433971360000001,5.43397136,5.43397136,data/final/MP/cifs/Nd0.2Ru2Th0.8-MP-mp-574438-synth_doped.cif,data/source/MP/raw/cifs/mp-574438.cif,mp-574438,0.0,,2014-02-28 05:45:15,12.708957533514832,10.17188/1276579,"@misc{osti_1276579,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ThRu2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1276579"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-918592'}},0.0384871966666633,8.28589698,520.0,-53.8389712,-8.973161866666667,"{'tags': ['Ruthenium thorium (2/1)', 'Thorium ruthenium (1/2)']}",-53.8389712,-8.973161866666667,-0.3189493466666668,"['xas', 'elasticity', 'bandstructure']",True,"[650730, 150740, 106002, 650723, 650729, 650731, 106003]",True,2021-05-12 10:56:27.046000,NM,6,7,mp-574438,,ThRu2,"{'functional': 'PBE', 'labels': ['Th', 'Ru_pv'], 'pot_type': 'paw'}","{'Th': 1.0, 'Ru': 2.0}",GGA,mp-574438,"['mp-919588', 'mp-905408', 'mp-918592', 'mp-574438', 'mp-1439663', 'mp-1802924', 'mp-1592175']",0.00057545,"{'Th': 2.0, 'Ru': 4.0}",113.45850020968712,[],NM,False,166,0,"[0.0, 0.0, 0.0, 0.0, 0.0, -0.0]",1.0143797052428654e-05,0.00057545,0,0.0011509,MP,data/source/MP/cleaned/cifs/MP-mp-574438.cif,True,,data/final/MP/graphs/Nd0.2Ru2Th0.8-MP-mp-574438-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Cu1.2Rh1.8S4,3,0.0571428571428571,2.0,False,Cu2.4Rh3.6S8,Cu2Rh4S8,5.08,Other,True,Cu17.143Rh25.714S57.143,Cu-Rh-S,3,Supercon,Cu1.2Rh1.8S4,MP-mp-15613,Cu2Rh4S8,Cu-Rh-S,Cu14.286Rh28.571S57.143,F d -3 m,cubic,6.98743829,6.987438289999999,6.987438289999999,data/final/MP/cifs/Cu1.2Rh1.8S4-MP-mp-15613-synth_doped.cif,data/source/MP/raw/cifs/mp-15613.cif,mp-15613,0.0,,2011-06-05 06:28:04,5.474003596961352,10.17188/1191271,"@misc{osti_1191271,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Cu(RhS2)2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191271"",
    place = ""United States"",
    year = ""2015"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1676515'}},0.0,5.28884909,520.0,-76.75879515,-5.482771082142857,"{'tags': ['Copper rhodium sulfide (1/2/4)', 'Copper dirhodium sulfide', 'Cuprorhodsite']}",-76.75879515,-5.482771082142857,-0.716825099642857,"['xas', 'bandstructure']",True,"[628767, 41900]",True,2021-05-12 10:56:53.126000,NM,14,8,mp-15613,,Cu(RhS2)2,"{'functional': 'PBE', 'labels': ['Cu_pv', 'Rh_pv', 'S'], 'pot_type': 'paw'}","{'Cu': 1.0, 'Rh': 2.0, 'S': 4.0}",GGA,mp-15613,"['mp-920968', 'mp-942816', 'mp-942447', 'mp-15613', 'mp-1475540', 'mp-1676515', 'mp-1774816', 'mp-1603317']",0.0083359,"{'Cu': 2.0, 'Rh': 4.0, 'S': 8.0}",241.23424486268337,[],NM,False,227,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",6.91104200794129e-05,0.0083359,0,0.0166718,MP,data/source/MP/cleaned/cifs/MP-mp-15613.cif,True,,data/final/MP/graphs/Cu1.2Rh1.8S4-MP-mp-15613-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
H3.63Th1,3,0.0680345572354211,0.8262231404958678,True,H3Th0.826,H3Th1,8.35,Other,True,H78.402Th21.598,H-Th,2,Supercon,H3.63Th1,MP-mp-861653,Th1H3,H-Th,H75Th25,I 4/m m m,tetragonal,3.5264359957617013,3.5264359957617013,4.12816167,data/final/MP/cifs/H3.63Th1-MP-mp-861653-synth_doped.cif,data/source/MP/raw/cifs/mp-861653.cif,mp-861653,0.0,,2014-08-22 13:34:37,9.540442978654488,10.17188/1309247,"@misc{osti_1309247,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ThH3 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1309247"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1766008'}},0.0490822262500003,7.1224758,520.0,-19.2608447,-4.815211175,{'tags': []},-19.2608447,-4.815211175,-0.5514520787499997,"['bandstructure', 'elasticity']",True,[],True,2021-05-12 10:56:31.128000,NM,4,11,mp-861653,,ThH3,"{'functional': 'PBE', 'labels': ['Th', 'H'], 'pot_type': 'paw'}","{'Th': 1.0, 'H': 3.0}",GGA,mp-861653,"['mp-861653', 'mp-1002788', 'mp-1004363', 'mp-1049481', 'mp-1049496', 'mp-1417433', 'mp-1766008', 'mp-1790587', 'mp-1010066', 'mp-1611510', 'mp-1049488']",0.0013351,"{'Th': 1.0, 'H': 3.0}",40.91313534201221,[],NM,False,139,0,"[0, 0, 0, 0]",3.26325515959427e-05,0.0013351,0,0.0013351,MP,data/source/MP/cleaned/cifs/MP-mp-861653.cif,True,,data/final/MP/graphs/H3.63Th1-MP-mp-861653-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Gd0.064La0.936Sn3,2,0.0319999999999999,1.0,True,Gd0.064La0.936Sn3,La1Sn3,3.76,Other,True,Gd1.6La23.4Sn75,Gd-La-Sn,3,Supercon,La0.936Gd0.064Sn3,MP-mp-633,La1Sn3,La-Sn,La25Sn75,P m -3 m,cubic,4.820061,4.820061,4.820061,data/final/MP/cifs/Gd0.064La0.936Sn3-MP-mp-633-synth_doped.cif,data/source/MP/raw/cifs/mp-633.cif,mp-633,0.0,,2011-05-13 04:30:54,7.340536659909055,10.17188/1279358,"@misc{osti_1279358,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaSn3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1279358"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688008'}},0.0,8.68748013,520.0,-19.26482408,-4.81620602,"{'tags': ['Lanthanum stannide (1/3)', 'Lanthanum tin (1/3)']}",-19.26482408,-4.81620602,-0.5750253525,"['xas', 'bandstructure']",True,"[641991, 104721, 641986, 261870, 104720, 151359, 642000, 641998, 191074]",True,2021-05-12 10:57:30.779000,NM,4,12,mp-633,,LaSn3,"{'functional': 'PBE', 'labels': ['La', 'Sn_d'], 'pot_type': 'paw'}","{'La': 1.0, 'Sn': 3.0}",GGA,mp-633,"['mp-991111', 'mp-993073', 'mp-633', 'mp-1066557', 'mp-1066573', 'mp-1066594', 'mp-1442023', 'mp-1688008', 'mp-1787436', 'mp-994393', 'mp-1590336', 'mp-1066601']",0.0055557,"{'La': 1.0, 'Sn': 3.0}",111.98441958300587,[],NM,False,221,0,"[0, 0, 0, 0]",4.961136576577034e-05,0.0055557,0,0.0055557,MP,data/source/MP/cleaned/cifs/MP-mp-633.cif,True,,data/final/MP/graphs/Gd0.064La0.936Sn3-MP-mp-633-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ce0.95La0.05Ru2,2,0.0333333333333333,2.0,False,Ce1.9La0.1Ru4,Ce2Ru4,7.181,Heavy_fermion,True,Ce31.667La1.667Ru66.667,Ce-La-Ru,3,Supercon,La0.05Ce0.95Ru2,MP-mp-607,Ce2Ru4,Ce-Ru,Ce33.333Ru66.667,F d -3 m,cubic,5.35903077,5.35903077,5.35903077,data/final/MP/cifs/Ce0.95La0.05Ru2-MP-mp-607-synth_doped.cif,data/source/MP/raw/cifs/mp-607.cif,mp-607,0.0,,2011-05-13 22:34:26,10.444470046690055,10.17188/1277529,"@misc{osti_1277529,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeRu2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277529"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686879'}},0.0,8.61419203,520.0,-50.66413619,-8.444022698333333,"{'tags': ['Cerium ruthenium (1/2)', 'Cerium ruthenium hydride (1/2/4)']}",-50.66413619,-8.444022698333333,-0.2833998766666663,"['xas', 'elasticity', 'bandstructure']",True,"[621326, 656077, 621978, 621973, 621980, 621984, 102277, 621972, 621976, 621979, 604113, 621977, 621982, 621983, 102276, 656078]",True,2021-05-12 10:56:27.046000,NM,6,14,mp-607,,CeRu2,"{'functional': 'PBE', 'labels': ['Ce', 'Ru_pv'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Ru': 2.0}",GGA,mp-607,"['mp-928203', 'mp-912221', 'mp-928809', 'mp-607', 'mp-1071462', 'mp-1071593', 'mp-1071613', 'mp-1077792', 'mp-1440763', 'mp-1686879', 'mp-1803198', 'mp-1591928', 'mp-1591642', 'mp-1071635']",1.005e-05,"{'Ce': 2.0, 'Ru': 4.0}",108.82877852828122,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",1.846937939745105e-07,1.005e-05,0,2.01e-05,MP,data/source/MP/cleaned/cifs/MP-mp-607.cif,True,,data/final/MP/graphs/Ce0.95La0.05Ru2-MP-mp-607-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ba0.85K0.15Sb2Ti2O1,2,0.05,1.0,True,Ba0.85K0.15Sb2Ti2O1,Ba1Sb2Ti2O1,5.86,Oxide,True,Ba14.167K2.5Sb33.333Ti33.333O16.666666666666668,Ba-K-Sb-Ti-O,5,Supercon,Ba0.85K0.15Ti2Sb2O1,MP-mp-1070806,Ba1Ti2Sb2O1,Ba-Sb-Ti-O,Ba16.667Sb33.333Ti33.333O16.666666666666668,P 4/m m m,tetragonal,4.113474,4.113474,8.312382,data/final/MP/cifs/Ba0.85K0.15Sb2Ti2O1-MP-mp-1070806-synth_doped.cif,data/source/MP/raw/cifs/mp-1070806.cif,mp-1070806,0.0,,2018-03-22 04:02:04,5.8154485533321445,,,{'GGA': {'task_id': 'mp-1702174'}},0.0,5.89751533,520.0,-39.14932631,-6.524887718333333,{'tags': []},-39.14932631,-6.524887718333333,-1.5507346602777776,['bandstructure'],True,"[430061, 237789, 430060]",True,2021-05-12 10:58:14.654000,NM,6,16,mp-1070806,oxide,BaTi2Sb2O,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ti_pv', 'Sb', 'O'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Ti': 2.0, 'Sb': 2.0, 'O': 1.0}",GGA,mp-1070806,"['mp-1071055', 'mp-1071068', 'mp-1071083', 'mp-1071088', 'mp-1070806', 'mp-1071124', 'mp-1070846', 'mp-1070900', 'mp-1071137', 'mp-1423542', 'mp-1702174', 'mp-1785425', 'mp-1588663', 'mp-1070899', 'mp-1071129', 'mp-1071119']",0.001055,"{'Ba': 1.0, 'Ti': 2.0, 'Sb': 2.0, 'O': 1.0}",140.65105900950408,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0]",7.500832254158225e-06,0.001055,0,0.001055,MP,data/source/MP/cleaned/cifs/MP-mp-1070806.cif,True,,data/final/MP/graphs/Ba0.85K0.15Sb2Ti2O1-MP-mp-1070806-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B1.88C0.12Mg1,3,0.08,1.0,True,B1.88C0.12Mg1,B2Mg1,32.9,Other,True,B62.667C4Mg33.333,B-C-Mg,3,Supercon,Mg1B1.88C0.12,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B1.88C0.12Mg1-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B1.88C0.12Mg1-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
B4Nd1Ru4,1,0.0,4.0,False,B16Nd4Ru16,B16Nd4Ru16,0.0,Other,True,B44.444Nd11.111Ru44.444,B-Nd-Ru,3,Supercon,Nd1Ru4B4,MP-mp-1198170,Nd4B16Ru16,B-Nd-Ru,B44.444Nd11.111Ru44.444,I 41/a c d,tetragonal,7.566699998326388,7.566699998326388,9.26627357,data/final/MP/cifs/B4Nd1Ru4-MP-mp-1198170.cif,data/source/MP/raw/cifs/mp-1198170.cif,mp-1198170,0.0,,2019-01-12 03:00:19.181000,9.074236535186383,,,{'GGA': {'task_id': 'mp-1751362'}},0.0,6.90611035,520.0,-290.583836,-8.071773222222223,{'tags': ['Neodymium ruthenium boride (1/4/4)']},-290.583836,-8.071773222222223,-0.4514100096296292,['bandstructure'],True,"[614967, 421310]",True,2021-05-12 10:58:37.524000,NM,36,6,mp-1198170,,Nd(BRu)4,"{'functional': 'PBE', 'labels': ['Nd_3', 'B', 'Ru_pv'], 'pot_type': 'paw'}","{'Nd': 1.0, 'B': 4.0, 'Ru': 4.0}",GGA,mp-1198170,"['mp-1198170', 'mp-1198952', 'mp-1444137', 'mp-1751362', 'mp-1820483', 'mp-1622934']",0.001265525,"{'Nd': 4.0, 'B': 16.0, 'Ru': 16.0}",433.1606554337772,[],NM,False,142,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.1686426125038284e-05,0.001265525,0,0.0050621,MP,data/source/MP/cleaned/cifs/MP-mp-1198170.cif,False,,data/final/MP/graphs/B4Nd1Ru4-MP-mp-1198170.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Li1.1Ti1.9O4,2,0.0285714285714286,2.0,False,Li2.2Ti3.8O8,Li2Ti4O8,10.05,Oxide,True,Li15.714Ti27.143O57.142857142857146,Li-Ti-O,3,Supercon,Li1.1Ti1.9O4,MP-mp-5670,Li2Ti4O8,Li-Ti-O,Li14.286Ti28.571O57.142857142857146,F d -3 m,cubic,5.986032260000001,5.98603226,5.98603226,data/final/MP/cifs/Li1.1Ti1.9O4-MP-mp-5670-synth_doped.cif,data/source/MP/raw/cifs/mp-5670.cif,mp-5670,0.0,,2011-05-14 11:10:22,3.649565337909552,10.17188/1273637,"@misc{osti_1273637,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LiTi2O4 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1273637"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699404'}},0.0,5.03116805,520.0,-114.93444733,-8.209603380714286,"{'tags': ['Lithium titanium oxide (1/2/4)', 'Lithium titanium(III) titanium(IV) oxide', 'Lithium titanium(III) titanium oxide', 'Lithium titanium titanium(III) oxide', 'Lithium titano(III)titanate', 'Spinel-(Li,Ti)']}",-114.93444733,-8.209603380714286,-3.2462103921428564,"['bandstructure', 'elasticity']",True,"[72859, 78482, 154982, 81329, 15789, 48127]",True,2021-05-12 10:56:22.739000,NM,14,7,mp-5670,oxide,LiTi2O4,"{'functional': 'PBE', 'labels': ['Li_sv', 'Ti_pv', 'O'], 'pot_type': 'paw'}","{'Li': 1.0, 'Ti': 2.0, 'O': 4.0}",GGA,mp-5670,"['mp-923613', 'mp-922835', 'mp-908534', 'mp-5670', 'mp-1418091', 'mp-1699404', 'mp-1787951']",0.0521081,"{'Li': 2.0, 'Ti': 4.0, 'O': 8.0}",151.67086379131675,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0006871207652868,0.0521081,0,0.1042162,MP,data/source/MP/cleaned/cifs/MP-mp-5670.cif,True,,data/final/MP/graphs/Li1.1Ti1.9O4-MP-mp-5670-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
C1Pb1Ti2,1,0.0,2.0,False,C2Pb2Ti4,C2Pb2Ti4,0.0,Other,True,C25Pb25Ti50,C-Pb-Ti,3,Supercon,C1Pb1Ti2,MP-mp-20661,Ti4Pb2C2,C-Pb-Ti,C25Pb25Ti50,P 63/m m c,hexagonal,3.2266020037878698,3.22660261,14.060364,data/final/MP/cifs/C1Pb1Ti2-MP-mp-20661.cif,data/source/MP/raw/cifs/mp-20661.cif,mp-20661,0.0,,2014-12-22 15:50:36,8.250785478914805,10.17188/1195790,"@misc{osti_1195790,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ti2PbC (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195790"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701863'}},0.0,8.06697326,520.0,-62.00961095,-7.75120136875,{'tags': ['Titanium lead carbide (2/1/1)']},-62.00961095,-7.75120136875,-0.5685984179166672,"['xas', 'elasticity', 'bandstructure']",True,[42926],True,2021-05-12 10:56:14.760000,NM,8,8,mp-20661,,Ti2PbC,"{'functional': 'PBE', 'labels': ['Ti_pv', 'Pb_d', 'C'], 'pot_type': 'paw'}","{'Ti': 2.0, 'Pb': 1.0, 'C': 1.0}",GGA,mp-20661,"['mp-909903', 'mp-925463', 'mp-20661', 'mp-1422083', 'mp-1701863', 'mp-1790408', 'mp-925873', 'mp-1587924']",0.0027073,"{'Ti': 4.0, 'Pb': 2.0, 'C': 2.0}",126.77047040069264,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",4.271183961758351e-05,0.0027073,0,0.0054146,MP,data/source/MP/cleaned/cifs/MP-mp-20661.cif,False,,data/final/MP/graphs/C1Pb1Ti2-MP-mp-20661.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Pb0.986Te1Tl0.014,2,0.014,1.0,True,Pb0.986Te1Tl0.014,Pb1Te1,1.38,Other,True,Pb49.3Te50Tl0.7,Pb-Te-Tl,3,Supercon,Pb0.986Tl0.014Te1,MP-mp-19717,Te1Pb1,Pb-Te,Pb50Te50,F m -3 m,cubic,4.64263261,4.64263261,4.64263261,data/final/MP/cifs/Pb0.986Te1Tl0.014-MP-mp-19717-synth_doped.cif,data/source/MP/raw/cifs/mp-19717.cif,mp-19717,1.0581999999999994,,2013-09-21 09:56:54,7.856997090559908,10.17188/1194927,"@misc{osti_1194927,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TePb (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1194927"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686920'}},0.0,4.9735213,520.0,-7.66743933,-3.833719665,"{'tags': ['Altaite', 'Lead telluride (1/1)', 'High pressure experimental phase', 'Lead telluride']}",-7.66743933,-3.833719665,-0.6167456649999998,"['eos', 'xas', 'bandstructure', 'diel', 'phonons', 'elasticity']",True,"[194220, 648583, 648588, 648607, 63099, 648584, 648590, 604178, 648595, 96500, 648608, 648596, 648597, 182660, 648599, 648593, 648603, 96504, 648591, 648586, 96506, 600843, 600522, 648614, 182662, 648606, 186788, 96505, 153711, 648581, 648605, 648587, 248494, 648585, 190437, 648600, 648617, 602956, 38295, 648589, 648615, 63098, 648592, 290707, 648612, 648594, 182661, 648616, 248495, 648613]",True,2021-05-12 10:56:14.760000,NM,2,34,mp-19717,,TePb,"{'functional': 'PBE', 'labels': ['Te', 'Pb_d'], 'pot_type': 'paw'}","{'Te': 1.0, 'Pb': 1.0}",GGA,mp-19717,"['mp-658057', 'mp-655294', 'mp-656827', 'mp-19717', 'mp-1056883', 'mp-1056867', 'mp-1056875', 'mp-1059285', 'mp-1059296', 'mp-1059300', 'mp-1059866', 'mp-1059872', 'mp-1059851', 'mp-1060231', 'mp-1060244', 'mp-1060254', 'mp-1061267', 'mp-1061381', 'mp-1061396', 'mp-1061412', 'mp-1061239', 'mp-1061250', 'mp-1142129', 'mp-1440755', 'mp-1686920', 'mp-1801248', 'mp-1594316', 'mp-1595339', 'mp-1059310', 'mp-1060260', 'mp-1061273', 'mp-1061416', 'mp-1056891', 'mp-1059878']",0.0014838,"{'Te': 1.0, 'Pb': 1.0}",70.75839192630549,[],NM,False,225,0,"[0, 0]",2.096995083700277e-05,0.0014838,0,0.0014838,MP,data/source/MP/cleaned/cifs/MP-mp-19717.cif,True,,data/final/MP/graphs/Pb0.986Te1Tl0.014-MP-mp-19717-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ir0.8Rh0.2,3,0.1,4.0,False,Ir3.2Rh0.8,Ir3Rh1,0.03,Other,True,Ir80Rh20,Ir-Rh,2,Supercon,Ir0.8Rh0.2,MP-mp-1184771,Ir3Rh1,Ir-Rh,Ir75Rh25,P m -3 m,cubic,3.869173,3.869173,3.869173,data/final/MP/cifs/Ir0.8Rh0.2-MP-mp-1184771-synth_doped.cif,data/source/MP/raw/cifs/mp-1184771.cif,mp-1184771,0.0,,2019-01-11 13:02:54.339000,19.48140265952555,,,{'GGA': {'task_id': 'mp-1733856'}},0.0094591199999989,9.11965125,520.0,-33.92588706,-8.481471765,{'tags': []},-33.92588706,-8.481471765,-0.0115719825000013,['bandstructure'],True,[],True,2021-05-12 10:58:27.755000,NM,4,5,mp-1184771,,Ir3Rh,"{'functional': 'PBE', 'labels': ['Ir', 'Rh_pv'], 'pot_type': 'paw'}","{'Ir': 3.0, 'Rh': 1.0}",GGA,mp-1184771,"['mp-1184771', 'mp-1415898', 'mp-1733856', 'mp-1795000', 'mp-1618109']",0.0007013,"{'Ir': 3.0, 'Rh': 1.0}",57.92345325095008,[],NM,False,221,0,"[0, 0, 0, 0]",1.2107358257140806e-05,0.0007013,0,0.0007013,MP,data/source/MP/cleaned/cifs/MP-mp-1184771.cif,True,,data/final/MP/graphs/Ir0.8Rh0.2-MP-mp-1184771-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ge3Pt1Sr1,1,0.0,1.0,True,Ge3Pt1Sr1,Ge3Pt1Sr1,1.0,Other,True,Ge60Pt20Sr20,Ge-Pt-Sr,3,Supercon,Sr1Pt1Ge3,MP-mp-1068239,Sr1Ge3Pt1,Ge-Pt-Sr,Ge60Pt20Sr20,I 4 m m,tetragonal,4.526790001572093,4.526790001572093,6.089296869999999,data/final/MP/cifs/Ge3Pt1Sr1-MP-mp-1068239.cif,data/source/MP/raw/cifs/mp-1068239.cif,mp-1068239,0.0,,2018-03-21 22:42:23,7.831418179512769,,,{'GGA': {'task_id': 'mp-1704974'}},0.0,4.36569,520.0,-24.73633146,-4.947266292,{'tags': ['Strontium platinum germanide (1/1/3)']},-24.73633146,-4.947266292,-0.6213693463333329,['bandstructure'],True,[168863],True,2021-05-12 10:58:14.654000,NM,5,8,mp-1068239,,SrGe3Pt,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ge_d', 'Pt'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Ge': 3.0, 'Pt': 1.0}",GGA,mp-1068239,"['mp-1068355', 'mp-1068239', 'mp-1068295', 'mp-1428559', 'mp-1704974', 'mp-1924808', 'mp-1587710', 'mp-1068345']",0.0001186,"{'Sr': 1.0, 'Ge': 3.0, 'Pt': 1.0}",106.1500855429071,[],NM,False,107,0,"[0, 0, 0, 0, 0]",1.1172859578343017e-06,0.0001186,0,0.0001186,MP,data/source/MP/cleaned/cifs/MP-mp-1068239.cif,False,,data/final/MP/graphs/Ge3Pt1Sr1-MP-mp-1068239.json,0,True,4mm,0,0,0,0,5,0,0,0,0,1,0,1.0,False
B4Lu0.75Rh4Th0.25,3,0.0555555555555555,2.0,False,B8Lu1.5Rh8Th0.5,B8Lu2Rh8,11.93,Other,True,B44.444Lu8.333Rh44.444Th2.778,B-Lu-Rh-Th,4,Supercon,Lu0.75Th0.25Rh4B4,MP-mp-1188110,Lu2B8Rh8,B-Lu-Rh,B44.444Lu11.111Rh44.444,P 42/n m c,tetragonal,5.325657,5.325657,7.420215,data/final/MP/cifs/B4Lu0.75Rh4Th0.25-MP-mp-1188110-synth_doped.cif,data/source/MP/raw/cifs/mp-1188110.cif,mp-1188110,0.0,,2019-01-11 19:11:41.748000,9.938975758699431,,,{'GGA': {'task_id': 'mp-1669462'}},0.0224321258888915,6.83221668,520.0,-131.70499157,-7.316943976111111,{'tags': ['Lutetium rhodium boride (1/4/4)']},-131.70499157,-7.316943976111111,-0.5729718557407403,['bandstructure'],True,"[601519, 614706]",True,2021-05-12 10:58:31.620000,NM,18,6,mp-1188110,,Lu(BRh)4,"{'functional': 'PBE', 'labels': ['Lu_3', 'B', 'Rh_pv'], 'pot_type': 'paw'}","{'Lu': 1.0, 'B': 4.0, 'Rh': 4.0}",GGA,mp-1188110,"['mp-1188110', 'mp-1188735', 'mp-1504954', 'mp-1669462', 'mp-1830476', 'mp-1597780']",0.00082675,"{'Lu': 2.0, 'B': 8.0, 'Rh': 8.0}",210.45675677766909,[],NM,False,137,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",7.856720902274437e-06,0.00082675,0,0.0016535,MP,data/source/MP/cleaned/cifs/MP-mp-1188110.cif,True,,data/final/MP/graphs/B4Lu0.75Rh4Th0.25-MP-mp-1188110-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
N0.97Sc1,2,0.0152284263959391,1.0,True,N0.97Sc1,N1Sc1,0.0,Other,True,N49.239Sc50.761,N-Sc,2,Supercon,N0.97Sc1,MP-mp-2857,Sc1N1,N-Sc,N50Sc50,F m -3 m,cubic,3.1949276400000004,3.1949276399999995,3.19492764,data/final/MP/cifs/N0.97Sc1-MP-mp-2857-synth_doped.cif,data/source/MP/raw/cifs/mp-2857.cif,mp-2857,0.3250000000000002,,2011-05-12 17:49:06,4.245782373273551,10.17188/1202670,"@misc{osti_1202670,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ScN (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1202670"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688369'}},0.0,5.46410467,520.0,-18.49445398,-9.24722699,"{'tags': ['Scandium nitride', 'Scandium nitride - B1 (LP)', 'Scandium nitride - B1(NP)', 'Scandium nitride (1/1)']}",-18.49445398,-9.24722699,-2.093244975,"['xas', 'elasticity', 'bandstructure']",True,"[290470, 236800, 236799, 290709, 644668, 180829, 155049, 644666, 26948, 644667, 157501]",True,2021-05-12 10:56:18.721000,NM,2,25,mp-2857,,ScN,"{'functional': 'PBE', 'labels': ['Sc_sv', 'N'], 'pot_type': 'paw'}","{'Sc': 1.0, 'N': 1.0}",GGA,mp-2857,"['mp-905831', 'mp-918802', 'mp-919788', 'mp-2857', 'mp-1057143', 'mp-1057113', 'mp-1057124', 'mp-1057375', 'mp-1057403', 'mp-1057387', 'mp-1057969', 'mp-1057923', 'mp-1057941', 'mp-1058953', 'mp-1058990', 'mp-1058937', 'mp-1440773', 'mp-1688369', 'mp-1793214', 'mp-1595747', 'mp-1587388', 'mp-1058981', 'mp-1057960', 'mp-1057406', 'mp-1057140']",9.98e-05,"{'Sc': 1.0, 'N': 1.0}",23.06046614897229,[],NM,False,225,0,"[0, 0]",4.327752932455256e-06,9.98e-05,0,9.98e-05,MP,data/source/MP/cleaned/cifs/MP-mp-2857.cif,True,,data/final/MP/graphs/N0.97Sc1-MP-mp-2857-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Bi1Er1Pd1,1,0.0,1.0,True,Bi1Er1Pd1,Bi1Er1Pd1,1.24,Other,True,Bi33.333Er33.333Pd33.333,Bi-Er-Pd,3,Supercon,Er1Pd1Bi1,MP-mp-1206953,Er1Bi1Pd1,Bi-Er-Pd,Bi33.333Er33.333Pd33.333,F -4 3 m,cubic,4.73363159,4.73363159,4.73363159,data/final/MP/cifs/Bi1Er1Pd1-MP-mp-1206953.cif,data/source/MP/raw/cifs/mp-1206953.cif,mp-1206953,0.0,,2019-01-12 10:09:37.533000,10.686155735661574,,,{'GGA': {'task_id': 'mp-1765996'}},0.0,5.47326406,520.0,-16.41008168,-5.470027226666667,"{'tags': ['MgAgAs', 'ErPdBi']}",-16.41008168,-5.470027226666667,-0.9241489166666668,['bandstructure'],True,[],True,2021-05-12 10:58:39.488000,NM,3,5,mp-1206953,,ErBiPd,"{'functional': 'PBE', 'labels': ['Er_3', 'Bi', 'Pd'], 'pot_type': 'paw'}","{'Er': 1.0, 'Bi': 1.0, 'Pd': 1.0}",GGA,mp-1206953,"['mp-1206953', 'mp-1418391', 'mp-1765996', 'mp-1801263', 'mp-1611095']",0.0009062,"{'Er': 1.0, 'Bi': 1.0, 'Pd': 1.0}",75.00122676362035,[],NM,False,216,0,"[0, 0, 0]",1.2082469035553908e-05,0.0009062,0,0.0009062,MP,data/source/MP/cleaned/cifs/MP-mp-1206953.cif,False,,data/final/MP/graphs/Bi1Er1Pd1-MP-mp-1206953.json,0,True,-43m,5,0,0,0,0,0,0,0,0,0,1,1.0,False
Ge0.5Rh0.5,1,0.0,8.0,False,Ge4Rh4,Ge4Rh4,0.24,Other,True,Ge50Rh50,Ge-Rh,2,Supercon,Ge0.5Rh0.5,MP-mp-22239,Ge4Rh4,Ge-Rh,Ge50Rh50,P n m a,orthorhombic,3.282371,5.749233,6.567262,data/final/MP/cifs/Ge0.5Rh0.5-MP-mp-22239.cif,data/source/MP/raw/cifs/mp-22239.cif,mp-22239,0.0,,2014-02-22 13:55:04,9.4084237695182,10.17188/1197455,"@misc{osti_1197455,
    author = ""Persson, Kristin"",
    title = ""Materials Data on GeRh (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197455"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698150'}},0.0,5.55277578,520.0,-52.3103764,-6.53879705,"{'tags': ['Rhodium(VI) germanide', 'Germanium rhodium (1/1)']}",-52.3103764,-6.53879705,-0.5451291874999997,"['xas', 'bandstructure']",True,"[44861, 637675]",True,2021-05-12 10:56:59.077000,NM,8,8,mp-22239,,GeRh,"{'functional': 'PBE', 'labels': ['Ge_d', 'Rh_pv'], 'pot_type': 'paw'}","{'Ge': 1.0, 'Rh': 1.0}",GGA,mp-22239,"['mp-921160', 'mp-942968', 'mp-942589', 'mp-22239', 'mp-1421767', 'mp-1698150', 'mp-1881991', 'mp-1595988']",0.000485,"{'Ge': 4.0, 'Rh': 4.0}",123.93156084667211,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.5653801071707345e-05,0.000485,0,0.00194,MP,data/source/MP/cleaned/cifs/MP-mp-22239.cif,False,,data/final/MP/graphs/Ge0.5Rh0.5-MP-mp-22239.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Be13Th0.009U0.991,2,0.0012857142857142,2.0,False,Be26Th0.018U1.982,Be26U2,0.66,Heavy_fermion,True,Be92.857Th0.064U7.079,Be-Th-U,3,Supercon,U0.9911Th0.0089Be13,MP-mp-1163,U2Be26,Be-U,Be92.857U7.143,F m -3 c,cubic,7.174675929999999,7.174675929999999,7.174675929999999,data/final/MP/cifs/Be13Th0.009U0.991-MP-mp-1163-synth_doped.cif,data/source/MP/raw/cifs/mp-1163.cif,mp-1163,0.0,,2011-05-15 13:39:09,4.516943134220159,10.17188/1188115,"@misc{osti_1188115,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UBe13 (SG:226) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188115"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1676276'}},0.0,5.60901004,520.0,-121.44122023,-4.337186436785714,"{'tags': ['Uranium beryllium (1/13)', 'Beryllium uranium (13/1)']}",-121.44122023,-4.337186436785714,-0.0583452042857146,"['xas', 'bandstructure']",True,"[616470, 58748, 616481, 58747, 58749, 659562, 107528, 600563, 58750, 616488, 58751]",True,2021-05-12 10:56:51.169000,NM,28,8,mp-1163,,UBe13,"{'functional': 'PBE', 'labels': ['U', 'Be_sv'], 'pot_type': 'paw'}","{'U': 1.0, 'Be': 13.0}",GGA,mp-1163,"['mp-1163', 'mp-906858', 'mp-920459', 'mp-921486', 'mp-1381018', 'mp-1676276', 'mp-1775695', 'mp-1603627']",0.0460573,"{'U': 2.0, 'Be': 26.0}",261.15110606061,[],NM,False,226,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0003527252914587,0.0460573,0,0.0921146,MP,data/source/MP/cleaned/cifs/MP-mp-1163.cif,True,,data/final/MP/graphs/Be13Th0.009U0.991-MP-mp-1163-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Re0.7W0.3,3,0.1,8.0,False,Re5.6W2.4,Re6W2,4.9,Other,True,Re70W30,Re-W,2,Supercon,Re0.7W0.3,MP-mp-974408,Re6W2,Re-W,Re75W25,P 63/m m c,hexagonal,4.551902,5.592164004382465,5.59216393,data/final/MP/cifs/Re0.7W0.3-MP-mp-974408-synth_doped.cif,data/source/MP/raw/cifs/mp-974408.cif,mp-974408,0.0,,2015-09-16 23:30:04,20.00181531858272,10.17188/1314483,"@misc{osti_1314483,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Re3W (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1314483"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1753563'}},0.130423158750002,7.03427154,520.0,-99.54003078,-12.4425038475,{'tags': []},-99.54003078,-12.4425038475,0.130423158750002,"['xas', 'bandstructure']",True,[],True,2021-05-12 10:57:55.580000,NM,8,8,mp-974408,,Re3W,"{'functional': 'PBE', 'labels': ['Re_pv', 'W_pv'], 'pot_type': 'paw'}","{'Re': 3.0, 'W': 1.0}",GGA,mp-974408,"['mp-974449', 'mp-974408', 'mp-974489', 'mp-1404689', 'mp-1753563', 'mp-1789838', 'mp-974542', 'mp-1618978']",0.0001131,"{'Re': 6.0, 'W': 2.0}",123.2773602085495,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.834886792005728e-06,0.0001131,0,0.0002262,MP,data/source/MP/cleaned/cifs/MP-mp-974408.cif,True,,data/final/MP/graphs/Re0.7W0.3-MP-mp-974408-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
B2Co2La1,1,0.0,1.0,True,B2Co2La1,B2Co2La1,0.0,Other,True,B40Co40La20,B-Co-La,3,Supercon,La1Co2B2,MP-mp-2967,La1Co2B2,B-Co-La,B40Co40La20,I 4/m m m,tetragonal,3.601524002219649,3.601524002219649,5.71960196,data/final/MP/cifs/B2Co2La1-MP-mp-2967.cif,data/source/MP/raw/cifs/mp-2967.cif,mp-2967,0.0,,2011-05-12 22:17:57,6.959059731671892,10.17188/1204151,"@misc{osti_1204151,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La(CoB)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1204151"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672975'}},0.0,7.48878685,520.0,-34.90607271,-6.981214541999999,"{'tags': ['Lanthanum cobalt boride (1/2/2)', 'Cobalt lanthanum boride (2/1/2)']}",-34.90607271,-6.981214541999999,-0.4789292946666663,"['xas', 'elasticity', 'bandstructure']",True,"[55297, 181184, 182572, 181185, 423045, 41787, 613135, 182573]",True,2021-05-12 10:56:18.721000,NM,5,8,mp-2967,,La(CoB)2,"{'functional': 'PBE', 'labels': ['La', 'Co', 'B'], 'pot_type': 'paw'}","{'La': 1.0, 'Co': 2.0, 'B': 2.0}",GGA,mp-2967,"['mp-1007012', 'mp-1000544', 'mp-2967', 'mp-1442119', 'mp-1672975', 'mp-1782552', 'mp-1011750', 'mp-1589504']",0.0036472,"{'La': 1.0, 'Co': 2.0, 'B': 2.0}",66.42907206668119,[],NM,False,139,0,"[0.0, -0.0, -0.0, 0.0, 0.0]",5.4903672240656295e-05,0.0036472,0,0.0036472,MP,data/source/MP/cleaned/cifs/MP-mp-2967.cif,False,,data/final/MP/graphs/B2Co2La1-MP-mp-2967.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ga0.6Si0.4V3,2,0.0499999999999999,2.0,False,Ga1.2Si0.8V6,Ga1Si1V6,9.5,Other,True,Ga15Si10V75,Ga-Si-V,3,Supercon,V3Ga0.6Si0.4,MP-mp-1216440,V6Ga1Si1,Ga-Si-V,Ga12.5Si12.5V75,P m -3,cubic,4.747019,4.747019,4.747019,data/final/MP/cifs/Ga0.6Si0.4V3-MP-mp-1216440-synth_doped.cif,data/source/MP/raw/cifs/mp-1216440.cif,mp-1216440,0.0,,2019-01-12 17:56:57.356000,6.263022625398905,,,{'GGA': {'task_id': 'mp-1752355'}},0.0012115512499999,6.46444818,520.0,-65.49539593,-8.18692449125,{'tags': []},-65.49539593,-8.18692449125,-0.3084436834374999,['bandstructure'],True,[],True,2021-05-12 10:58:39.488000,FM,8,5,mp-1216440,,V6GaSi,"{'functional': 'PBE', 'labels': ['V_pv', 'Ga_d', 'Si'], 'pot_type': 'paw'}","{'V': 6.0, 'Ga': 1.0, 'Si': 1.0}",GGA,mp-1216440,"['mp-1216440', 'mp-1444194', 'mp-1752355', 'mp-1875781', 'mp-1620045']",2.0268443,"{'V': 6.0, 'Ga': 1.0, 'Si': 1.0}",106.970225166654,[],FM,True,47,1,"[0.2, 0.3, 0.3, 0.2, 0.3, 0.3, 0.0, 0.0]",0.0189477426717788,2.0268443,6,2.0268443,MP,data/source/MP/cleaned/cifs/MP-mp-1216440.cif,True,,data/final/MP/graphs/Ga0.6Si0.4V3-MP-mp-1216440-synth_doped.json,0,True,m-3,2,0,0,0,0,0,0,1,0,0,0,1.0,False
B4Ru4Yb1,1,0.0,4.0,False,B16Ru16Yb4,B16Ru16Yb4,0.0,Heavy_fermion,True,B44.444Ru44.444Yb11.111,B-Ru-Yb,3,Supercon,Yb1Ru4B4,MP-mp-1200533,Yb4B16Ru16,B-Ru-Yb,B44.444Ru44.444Yb11.111,I 41/a c d,tetragonal,7.410006003054104,7.410006003054104,9.23402406,data/final/MP/cifs/B4Ru4Yb1-MP-mp-1200533.cif,data/source/MP/raw/cifs/mp-1200533.cif,mp-1200533,0.0,,2019-01-12 04:55:21.446000,9.872914974024315,,,{'GGA': {'task_id': 'mp-1735025'}},0.0,6.55318252,520.0,-276.6635182,-7.685097727777777,{'tags': ['Ytterbium ruthenium boride (1/4/4)']},-276.6635182,-7.685097727777777,-0.4234606185185186,['bandstructure'],True,[615409],True,2021-05-12 10:58:37.524000,NM,36,5,mp-1200533,,Yb(BRu)4,"{'functional': 'PBE', 'labels': ['Yb_2', 'B', 'Ru_pv'], 'pot_type': 'paw'}","{'Yb': 1.0, 'B': 4.0, 'Ru': 4.0}",GGA,mp-1200533,"['mp-1200533', 'mp-1404069', 'mp-1735025', 'mp-1815213', 'mp-1622918']",0.00025565,"{'Yb': 4.0, 'B': 16.0, 'Ru': 16.0}",417.49403009617134,[],NM,False,142,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.449376341416044e-06,0.00025565,0,0.0010226,MP,data/source/MP/cleaned/cifs/MP-mp-1200533.cif,False,,data/final/MP/graphs/B4Ru4Yb1-MP-mp-1200533.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
S1Ti1,1,0.0,1.0,True,S1Ti1,S1Ti1,0.0,Other,True,S50Ti50,S-Ti,2,Supercon,S1Ti1,MP-mp-1018028,Ti1S1,S-Ti,S50Ti50,P -6 m 2,hexagonal,3.219077,3.2738819996521986,3.27388115,data/final/MP/cifs/S1Ti1-MP-mp-1018028.cif,data/source/MP/raw/cifs/mp-1018028.cif,mp-1018028,0.0,,2017-04-06 22:57:05,4.442034081440435,10.17188/1350110,"@article{osti_1350110,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TiS (SG:187) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1350110"",
    place = ""United States"",
    year = ""2017"",
    month = ""4""
}
",{'GGA': {'task_id': 'mp-1671827'}},0.0,8.30958923,520.0,-14.96860823,-7.484304115,{'tags': ['Titanium(II) sulfide']},-14.96860823,-7.484304115,-1.7198331732291663,"['bandstructure', 'elasticity']",True,[52193],True,2021-05-12 10:56:08.727000,NM,2,13,mp-1018028,,TiS,"{'functional': 'PBE', 'labels': ['Ti_pv', 'S'], 'pot_type': 'paw'}","{'Ti': 1.0, 'S': 1.0}",GGA,mp-1018028,"['mp-1018185', 'mp-1018322', 'mp-1018445', 'mp-1018028', 'mp-1058248', 'mp-1058222', 'mp-1058274', 'mp-1115474', 'mp-1439018', 'mp-1671827', 'mp-1781459', 'mp-1589995', 'mp-1058264']",0.0003947,"{'Ti': 1.0, 'S': 1.0}",29.88050209385837,[],NM,False,187,0,"[0, 0]",1.3209282720892646e-05,0.0003947,0,0.0003947,MP,data/source/MP/cleaned/cifs/MP-mp-1018028.cif,False,,data/final/MP/graphs/S1Ti1-MP-mp-1018028.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Ca0.113Cu1La1.887O4,2,0.0322857142857142,1.0,True,Ca0.113Cu1La1.887O4,Cu1La2O4,20.1,Cuprate,True,Ca1.614Cu14.286La26.957O57.142857142857146,Ca-Cu-La-O,4,Supercon,La1.887Ca0.1125Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ca0.113Cu1La1.887O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ca0.113Cu1La1.887O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B2C1Cu0.1Ni1.9Y1,2,0.0333333333333333,1.0,True,B2C1Cu0.1Ni1.9Y1,B2C1Ni2Y1,13.75,Other,True,B33.333C16.667Cu1.667Ni31.667Y16.667,B-C-Cu-Ni-Y,5,Supercon,Y1Ni1.9Cu0.1B2C1,MP-mp-6576,Y1Ni2B2C1,B-C-Ni-Y,B33.333C16.667Ni33.333Y16.667,I 4/m m m,tetragonal,3.548790000501972,3.548790000501972,5.76144136,data/final/MP/cifs/B2C1Cu0.1Ni1.9Y1-MP-mp-6576-synth_doped.cif,data/source/MP/raw/cifs/mp-6576.cif,mp-6576,0.0,,2011-05-13 05:21:43,6.099730998852292,10.17188/1281366,"@misc{osti_1281366,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281366"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688230'}},0.0,6.81083016,520.0,-43.677878,-7.279646333333333,{'tags': []},-43.677878,-7.279646333333333,-0.5109282141666659,"['xas', 'bandstructure']",True,"[75816, 89142, 83231, 79574, 41549]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6576,,YNi2B2C,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6576,"['mp-6576', 'mp-1007054', 'mp-1000583', 'mp-1439516', 'mp-1688230', 'mp-1794280', 'mp-1011792', 'mp-1597064']",0.0006603,"{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.3152437079014,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",1.010943177297096e-05,0.0006603,0,0.0006603,MP,data/source/MP/cleaned/cifs/MP-mp-6576.cif,True,,data/final/MP/graphs/B2C1Cu0.1Ni1.9Y1-MP-mp-6576-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B2Mg0.99Ti0.01,2,0.0066666666666666,1.0,True,B2Mg0.99Ti0.01,B2Mg1,38.6,Other,True,B66.667Mg33Ti0.333,B-Mg-Ti,3,Supercon,Mg0.99Ti0.01B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B2Mg0.99Ti0.01-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B2Mg0.99Ti0.01-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Cu1La2O4.022,2,0.0026854376042641,0.994676694845019,True,Cu0.995La1.989O4,Cu1La2O4,42.0,Cuprate,True,Cu14.241La28.482O57.27712902307035,Cu-La-O,3,Supercon,La2Cu1O4.022,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La2O4.022-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La2O4.022-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Al0.15B2Mg0.85,3,0.1,1.0,True,Al0.15B2Mg0.85,B2Mg1,31.5,Other,True,Al5B66.667Mg28.333,Al-B-Mg,3,Supercon,Mg0.85Al0.15B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/Al0.15B2Mg0.85-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/Al0.15B2Mg0.85-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ba1Pb0.75Sb0.25O3,3,0.1,2.0,False,Ba2Pb1.5Sb0.5O6,Ba2Pb2O6,3.5,Oxide,True,Ba20Pb15Sb5O60,Ba-Pb-Sb-O,4,Supercon,Ba1Pb0.75Sb0.25O3,MP-mp-22230,Ba2Pb2O6,Ba-Pb-O,Ba20Pb20O60,I m m a,orthorhombic,6.133862002250079,6.155866510000001,6.155866509646406,data/final/MP/cifs/Ba1Pb0.75Sb0.25O3-MP-mp-22230-synth_doped.cif,data/source/MP/raw/cifs/mp-22230.cif,mp-22230,0.2093999999999996,,2014-02-21 02:34:22,7.878976238337828,10.17188/1197446,"@misc{osti_1197446,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BaPbO3 (SG:74) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197446"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677620'}},0.0,2.99294363,520.0,-57.91751158,-5.791751158,"{'tags': ['Barium plumbate(IV)', 'Barium lead oxide', 'Barium plumbate', 'Barium lead(IV) oxide']}",-57.91751158,-5.791751158,-2.1088509750000006,"['xas', 'bandstructure']",True,"[252031, 94313, 154038, 245600, 51657, 94312, 245601, 78681, 154039, 15933, 67811, 245602]",True,2021-05-12 10:56:59.077000,NM,10,7,mp-22230,oxide,BaPbO3,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Pb_d', 'O'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Pb': 1.0, 'O': 3.0}",GGA,mp-22230,"['mp-547522', 'mp-22230', 'mp-1078282', 'mp-1437547', 'mp-1677620', 'mp-1828697', 'mp-1589590']",5.66e-05,"{'Ba': 2.0, 'Pb': 2.0, 'O': 6.0}",165.45383803885784,[],NM,False,74,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.841787494431788e-07,5.66e-05,0,0.0001132,MP,data/source/MP/cleaned/cifs/MP-mp-22230.cif,True,,data/final/MP/graphs/Ba1Pb0.75Sb0.25O3-MP-mp-22230-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,0,1,0,0.5,False
Ce1Ge0.06Pt3Si0.94,2,0.024,1.0,True,Ce1Ge0.06Pt3Si0.94,Ce1Pt3Si1,0.50525,Heavy_fermion,True,Ce20Ge1.2Pt60Si18.8,Ce-Ge-Pt-Si,4,Supercon,Ce1Pt3Si0.94Ge0.06,MP-mp-1207119,Ce1Si1Pt3,Ce-Pt-Si,Ce20Pt60Si20,P 4 m m,tetragonal,4.067884,4.067884,5.552623,data/final/MP/cifs/Ce1Ge0.06Pt3Si0.94-MP-mp-1207119-synth_doped.cif,data/source/MP/raw/cifs/mp-1207119.cif,mp-1207119,0.0,,2019-01-12 10:17:34.047000,13.616649050512317,,,,0.0,7.99187805,520.0,-34.84666915,-6.969333829999999,"{'tags': ['CePt3Si', 'CePt3B']}",-34.84666915,-6.969333829999999,-1.0409085689999995,[],False,[],True,2021-05-12 11:00:19.396000,NM,5,2,mp-1207119,,CeSiPt3,"{'functional': 'PBE', 'labels': ['Ce', 'Si', 'Pt'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Si': 1.0, 'Pt': 3.0}",GGA,mp-1207119,"['mp-1207119', 'mp-1923489']",0.0099182,"{'Ce': 1.0, 'Si': 1.0, 'Pt': 3.0}",91.88302988314366,[],NM,False,99,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",0.0001079437629844,0.0099182,0,0.0099182,MP,data/source/MP/cleaned/cifs/MP-mp-1207119.cif,True,,data/final/MP/graphs/Ce1Ge0.06Pt3Si0.94-MP-mp-1207119-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
Bi2Ca0.7Cu2I1Sr2Y0.3O8,3,0.0375,2.0,False,Bi4Ca1.4Cu4I2Sr4Y0.6O16,Bi4Ca2Cu4I2Sr4O16,79.0,Cuprate,True,Bi12.5Ca4.375Cu12.5I6.25Sr12.5Y1.875O50,Bi-Ca-Cu-I-Sr-Y-O,7,Supercon,Bi2Sr2Ca0.7Y0.3Cu2I1O8,MP-mp-1209124,Sr4Ca2Cu4Bi4I2O16,Bi-Ca-Cu-I-Sr-O,Bi12.5Ca6.25Cu12.5I6.25Sr12.5O50,P m n a,orthorhombic,5.21493,5.481615,19.120353,data/final/MP/cifs/Bi2Ca0.7Cu2I1Sr2Y0.3O8-MP-mp-1209124-synth_doped.cif,data/source/MP/raw/cifs/mp-1209124.cif,mp-1209124,0.0,,2019-01-12 11:54:40.777000,6.168902819730907,,,,0.092595106494147,3.5592228,520.0,-175.92812723,-5.4977539759375,{'tags': ['Sr2CaCu2Bi2IO8']},-175.92812723,-5.4977539759375,-1.9605183883333333,[],False,[],True,2021-05-12 11:00:21.818000,NM,32,3,mp-1209124,oxide,Sr2CaCu2Bi2IO8,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Cu_pv', 'Bi', 'I', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'I': 1.0, 'O': 8.0}",GGA,mp-1209124,"['mp-1209124', 'mp-1361882', 'mp-1929533']",0.31195235,"{'Sr': 4.0, 'Ca': 2.0, 'Cu': 4.0, 'Bi': 4.0, 'I': 2.0, 'O': 16.0}",546.5789712906787,[],NM,False,53,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0011414721984761,0.31195235,0,0.6239047,MP,data/source/MP/cleaned/cifs/MP-mp-1209124.cif,True,,data/final/MP/graphs/Bi2Ca0.7Cu2I1Sr2Y0.3O8-MP-mp-1209124-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Pt1Th1,1,0.0,2.0,False,Pt2Th2,Pt2Th2,0.44,Other,True,Pt50Th50,Pt-Th,2,Supercon,Pt1Th1,MP-mp-12754,Th2Pt2,Pt-Th,Pt50Th50,C m c m,orthorhombic,3.933813999155829,4.483058,5.9734762,data/final/MP/cifs/Pt1Th1-MP-mp-12754.cif,data/source/MP/raw/cifs/mp-12754.cif,mp-12754,0.0,,2011-05-28 02:33:37,14.260536394282916,10.17188/1189166,"@misc{osti_1189166,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ThPt (SG:63) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189166"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698852'}},0.0,7.57725941,520.0,-31.82949027,-7.9573725675,"{'tags': ['Thorium platinum (1/1)', 'Platinum thorium (1/1)']}",-31.82949027,-7.9573725675,-1.2149895875,"['xas', 'bandstructure']",True,"[649759, 150541]",True,2021-05-12 10:56:53.126000,NM,4,8,mp-12754,,ThPt,"{'functional': 'PBE', 'labels': ['Th', 'Pt'], 'pot_type': 'paw'}","{'Th': 1.0, 'Pt': 1.0}",GGA,mp-12754,"['mp-919551', 'mp-905349', 'mp-918556', 'mp-12754', 'mp-1441702', 'mp-1698852', 'mp-1795835', 'mp-1591220']",0.00024845,"{'Th': 2.0, 'Pt': 2.0}",99.470713755341,[],NM,False,63,0,"[0, 0, 0, 0]",4.995440177720845e-06,0.00024845,0,0.0004969,MP,data/source/MP/cleaned/cifs/MP-mp-12754.cif,False,,data/final/MP/graphs/Pt1Th1-MP-mp-12754.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Cu2Gd1Ir0.05Ru0.95Sr2O8,2,0.0071428571428571,2.0,False,Cu4Gd2Ir0.1Ru1.9Sr4O16,Cu4Gd2Ru2Sr4O16,32.5,Cuprate,True,Cu14.286Gd7.143Ir0.357Ru6.786Sr14.286O57.142857142857146,Cu-Gd-Ir-Ru-Sr-O,6,Supercon,Ru0.95Ir0.05Sr2Gd1Cu2O8,MP-mp-1194240,Sr4Gd2Cu4Ru2O16,Cu-Gd-Ru-Sr-O,Cu14.286Gd7.143Ru7.143Sr14.286O57.142857142857146,P 4/m b m,tetragonal,5.472451,5.472451,11.740702,data/final/MP/cifs/Cu2Gd1Ir0.05Ru0.95Sr2O8-MP-mp-1194240-synth_doped.cif,data/source/MP/raw/cifs/mp-1194240.cif,mp-1194240,0.0,,2019-01-11 23:51:58.932000,6.504561898971391,,,{'GGA': {'task_id': 'mp-1765260'}},0.0213449239285443,3.93502801,520.0,-201.55352223,-7.198340079642857,"{'tags': ['Sr2Cu2GdRuO8 orth', 'Sr2Cu2GdRuO8', 'Ruthenium distrontium gadolinium dicopper octaoxide']}",-201.55352223,-7.198340079642857,-2.268654352380952,['bandstructure'],True,[245741],True,2021-05-12 10:58:35.561000,FiM,28,6,mp-1194240,oxide,Sr2GdCu2RuO8,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Gd', 'Cu_pv', 'Ru_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Gd': 1.0, 'Cu': 2.0, 'Ru': 1.0, 'O': 8.0}",GGA,mp-1194240,"['mp-1194240', 'mp-1396976', 'mp-1659973', 'mp-1765260', 'mp-1841948', 'mp-1638264']",4.23696715,"{'Sr': 4.0, 'Gd': 2.0, 'Cu': 4.0, 'Ru': 2.0, 'O': 16.0}",351.6072554818909,[],FiM,True,127,2,"[-0.0, -0.0, -0.0, -0.0, 6.9, 6.9, 0.0, 0.0, 0.0, 0.0, -1.8, -1.8, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0241005672319991,4.23696715,4,8.4739343,MP,data/source/MP/cleaned/cifs/MP-mp-1194240.cif,True,,data/final/MP/graphs/Cu2Gd1Ir0.05Ru0.95Sr2O8-MP-mp-1194240-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
C1Mo0.95Nb0.05,2,0.05,1.0,True,C1Mo0.95Nb0.05,C1Mo1,13.5,Other,True,C50Mo47.5Nb2.5,C-Mo-Nb,3,Supercon,Nb0.05Mo0.95C1,MP-mp-2305,Mo1C1,C-Mo,C50Mo50,P -6 m 2,hexagonal,2.835086,2.92410600478411,2.92410507,data/final/MP/cifs/C1Mo0.95Nb0.05-MP-mp-2305-synth_doped.cif,data/source/MP/raw/cifs/mp-2305.cif,mp-2305,0.0,,2011-05-12 17:49:42,8.538697979393088,10.17188/1199194,"@misc{osti_1199194,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MoC (SG:187) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199194"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668222'}},0.0010243049999996,8.62658168,520.0,-20.24014809,-10.120074045,{'tags': ['Molybdenum carbide (1/1)']},-20.24014809,-10.120074045,-0.0838621800000005,"['xas', 'elasticity', 'bandstructure']",True,"[77156, 618300]",True,2021-05-12 10:56:16.728000,NM,2,9,mp-2305,,MoC,"{'functional': 'PBE', 'labels': ['Mo_pv', 'C'], 'pot_type': 'paw'}","{'Mo': 1.0, 'C': 1.0}",GGA,mp-2305,"['mp-927633', 'mp-927239', 'mp-911174', 'mp-2305', 'mp-1116092', 'mp-1440368', 'mp-1668222', 'mp-1791400', 'mp-1638434']",0.0001977,"{'Mo': 1.0, 'C': 1.0}",20.99340614335182,[],NM,False,187,0,"[0, 0]",9.417242664197564e-06,0.0001977,0,0.0001977,MP,data/source/MP/cleaned/cifs/MP-mp-2305.cif,True,,data/final/MP/graphs/C1Mo0.95Nb0.05-MP-mp-2305-synth_doped.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
As2Ba0.85Fe2Na0.15,3,0.0733333333333333,3.0,False,As6Ba2.55Fe6Na0.45,As6Ba2Fe6Na1,5.3,Ferrite,True,As40Ba17Fe40Na3,As-Ba-Fe-Na,4,Supercon,Ba0.85Na0.15Fe2As2,MP-mp-1228583,Ba2Na1Fe6As6,As-Ba-Fe-Na,As40Ba13.333Fe40Na6.667,C 1 2/m 1,monoclinic,5.502160002138175,6.99761027,8.802836470000003,data/final/MP/cifs/As2Ba0.85Fe2Na0.15-MP-mp-1228583-synth_doped.cif,data/source/MP/raw/cifs/mp-1228583.cif,mp-1228583,0.0,,2019-01-13 04:16:43.045000,6.084135795710686,,,,0.0238926390000022,4.38666976,520.0,-90.45798907,-6.030532604666666,{'tags': []},-90.45798907,-6.030532604666666,-0.4348507324367821,[],False,[],True,2021-05-12 11:00:59.151000,FM,15,3,mp-1228583,,Ba2Na(FeAs)6,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Na_pv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Na': 1.0, 'Fe': 6.0, 'As': 6.0}",GGA,mp-1228583,"['mp-1228583', 'mp-1329033', 'mp-1656554']",1.3754397,"{'Ba': 2.0, 'Na': 1.0, 'Fe': 6.0, 'As': 6.0}",295.37595060340544,[],FM,True,12,2,"[0.0, 0.0, 0.0, 0.3, 0.2, 0.2, 0.2, 0.2, 0.3, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0046565730797994,1.3754397,6,1.3754397,MP,data/source/MP/cleaned/cifs/MP-mp-1228583.cif,True,,data/final/MP/graphs/As2Ba0.85Fe2Na0.15-MP-mp-1228583-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
Ge2.2La1Pt1.8,3,0.08,1.0,True,Ge2.2La1Pt1.8,Ge2La1Pt2,1.95,Other,True,Ge44La20Pt36,Ge-La-Pt,3,Supercon,La1Pt1.8Ge2.2,MP-mp-21057,La1Ge2Pt2,Ge-La-Pt,Ge40La20Pt40,I 4/m m m,tetragonal,4.458128002603763,4.458128002603763,5.96043246,data/final/MP/cifs/Ge2.2La1Pt1.8-MP-mp-21057-synth_doped.cif,data/source/MP/raw/cifs/mp-21057.cif,mp-21057,0.0,,2014-02-21 09:25:11,11.137876633950224,10.17188/1196317,"@misc{osti_1196317,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La(GePt)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196317"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704515'}},0.0973405535000013,6.85937735,520.0,-30.67754438,-6.135508876,{'tags': ['Lanthanum platinum germanide (1/2/2)']},-30.67754438,-6.135508876,-0.8707332289999996,"['xas', 'bandstructure']",True,[53665],True,2021-05-12 10:56:57.051000,NM,5,8,mp-21057,,La(GePt)2,"{'functional': 'PBE', 'labels': ['La', 'Ge_d', 'Pt'], 'pot_type': 'paw'}","{'La': 1.0, 'Ge': 2.0, 'Pt': 2.0}",GGA,mp-21057,"['mp-993642', 'mp-991893', 'mp-21057', 'mp-1429115', 'mp-1704515', 'mp-1783057', 'mp-994947', 'mp-1591906']",0.003651,"{'La': 1.0, 'Ge': 2.0, 'Pt': 2.0}",100.53893739664449,[],NM,False,139,0,"[0, 0, 0, 0, 0]",3.631428871777447e-05,0.003651,0,0.003651,MP,data/source/MP/cleaned/cifs/MP-mp-21057.cif,True,,data/final/MP/graphs/Ge2.2La1Pt1.8-MP-mp-21057-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Bi2Pd1,1,0.0,2.0,False,Bi4Pd2,Bi4Pd2,3.823333333,Other,True,Bi66.667Pd33.333,Bi-Pd,2,Supercon,Bi2Pd1,MP-mp-568746,Bi4Pd2,Bi-Pd,Bi66.667Pd33.333,C 1 2/m 1,monoclinic,4.340166002767466,5.72834425,6.82332789,data/final/MP/cifs/Bi2Pd1-MP-mp-568746.cif,data/source/MP/raw/cifs/mp-568746.cif,mp-568746,0.0,,2014-02-16 12:26:53,11.096921577831472,10.17188/1274673,"@misc{osti_1274673,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Bi2Pd (SG:12) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1274673"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1705121'}},0.0,6.17904648,520.0,-27.35800583,-4.559667638333333,"{'tags': ['Froodite', 'Bismuth palladium (2/1)', 'Palladium bismuthide (1/2)']}",-27.35800583,-4.559667638333333,-0.2396841616666668,"['xas', 'elasticity', 'bandstructure']",True,"[42565, 616946]",True,2021-05-12 10:56:22.739000,NM,6,9,mp-568746,,Bi2Pd,"{'functional': 'PBE', 'labels': ['Bi', 'Pd'], 'pot_type': 'paw'}","{'Bi': 2.0, 'Pd': 1.0}",GGA,mp-568746,"['mp-924877', 'mp-925451', 'mp-909850', 'mp-568746', 'mp-1077114', 'mp-1415370', 'mp-1705121', 'mp-1779403', 'mp-1588082']",0.00037255,"{'Bi': 4.0, 'Pd': 2.0}",156.93628148449466,[],NM,False,12,0,"[0, 0, 0, 0, 0, 0]",4.7477867638505e-06,0.00037255,0,0.0007451,MP,data/source/MP/cleaned/cifs/MP-mp-568746.cif,False,,data/final/MP/graphs/Bi2Pd1-MP-mp-568746.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
Ir2Lu1,1,0.0,2.0,False,Ir4Lu2,Ir4Lu2,2.47,Other,True,Ir66.667Lu33.333,Ir-Lu,2,Supercon,Ir2Lu1,MP-mp-1761,Lu2Ir4,Ir-Lu,Ir66.667Lu33.333,F d -3 m,cubic,5.31576008,5.31576008,5.31576008,data/final/MP/cifs/Ir2Lu1-MP-mp-1761.cif,data/source/MP/raw/cifs/mp-1761.cif,mp-1761,0.0,,2011-05-13 05:05:15,17.491264819216028,10.17188/1192590,"@misc{osti_1192590,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LuIr2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1192590"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702250'}},0.0,6.82956036,520.0,-49.45978205,-8.243297008333334,{'tags': ['Iridium lutetium (2/1)']},-49.45978205,-8.243297008333334,-0.8440265550000005,"['xas', 'elasticity', 'bandstructure']",True,"[104491, 640781, 640782, 104492]",True,2021-05-12 10:56:14.760000,NM,6,7,mp-1761,,LuIr2,"{'functional': 'PBE', 'labels': ['Lu_3', 'Ir'], 'pot_type': 'paw'}","{'Lu': 1.0, 'Ir': 2.0}",GGA,mp-1761,"['mp-930555', 'mp-913757', 'mp-930053', 'mp-1761', 'mp-1441292', 'mp-1702250', 'mp-1597027']",0.0132729,"{'Lu': 2.0, 'Ir': 4.0}",106.21384147984568,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",0.000249927877856,0.0132729,0,0.0265458,MP,data/source/MP/cleaned/cifs/MP-mp-1761.cif,False,,data/final/MP/graphs/Ir2Lu1-MP-mp-1761.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
B2C1Rh2Th1,1,0.0,1.0,True,B2C1Rh2Th1,B2C1Rh2Th1,0.0,Other,True,B33.333C16.667Rh33.333Th16.667,B-C-Rh-Th,4,Supercon,Th1Rh2B2C1,MP-mp-1080399,Th1B2Rh2C1,B-C-Rh-Th,B33.333C16.667Rh33.333Th16.667,I 4/m m m,tetragonal,3.893553998296052,3.893553998296052,5.80768857,data/final/MP/cifs/B2C1Rh2Th1-MP-mp-1080399.cif,data/source/MP/raw/cifs/mp-1080399.cif,mp-1080399,0.0,,2018-04-23 16:41:56,10.09929396810401,,,{'GGA': {'task_id': 'mp-1688256'}},0.0,7.68859668,520.0,-48.75437186,-8.125728643333334,"{'tags': ['Thorium rhodium boride carbide (1/2/2/1)', 'LuNi2B2C', 'ThRh2B2C']}",-48.75437186,-8.125728643333334,-0.6710556047222221,['bandstructure'],True,[659010],True,2021-05-12 10:58:16.596000,NM,6,5,mp-1080399,,ThB2Rh2C,"{'functional': 'PBE', 'labels': ['Th', 'B', 'Rh_pv', 'C'], 'pot_type': 'paw'}","{'Th': 1.0, 'B': 2.0, 'Rh': 2.0, 'C': 1.0}",GGA,mp-1080399,"['mp-1080399', 'mp-1300113', 'mp-1688256', 'mp-1799448', 'mp-1594399']",1.17e-05,"{'Th': 1.0, 'B': 2.0, 'Rh': 2.0, 'C': 1.0}",77.52164499240786,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",1.5092558989358196e-07,1.17e-05,0,1.17e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1080399.cif,False,,data/final/MP/graphs/B2C1Rh2Th1-MP-mp-1080399.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B0.08C0.92Cu1Sr2O5,2,0.0177777777777777,4.0,False,B0.32C3.68Cu4Sr8O20,C4Cu4Sr8O20,25.0,Cuprate,True,B0.889C10.222Cu11.111Sr22.222O55.55555555555556,B-C-Cu-Sr-O,5,Supercon,Sr2Cu1C0.92B0.08O5,MP-mp-1198030,Sr8Cu4C4O20,C-Cu-Sr-O,C11.111Cu11.111Sr22.222O55.55555555555556,I -4,tetragonal,7.877744002100394,7.877744002100395,9.46755054,data/final/MP/cifs/B0.08C0.92Cu1Sr2O5-MP-mp-1198030-synth_doped.cif,data/source/MP/raw/cifs/mp-1198030.cif,mp-1198030,0.0,,2019-01-12 02:53:33.853000,4.624821022244182,,,{'GGA': {'task_id': 'mp-1742814'}},0.0386187874999981,3.47889523,520.0,-237.90163358,-6.608378710555556,"{'tags': ['Distrontium copper dioxide carbonate - LT', 'Distrontium copper dioxide carbonate']}",-237.90163358,-6.608378710555556,-2.385069899259259,['bandstructure'],True,"[78650, 83095]",True,2021-05-12 10:58:37.524000,NM,36,6,mp-1198030,oxide,Sr2CuCO5,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Cu_pv', 'C', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Cu': 1.0, 'C': 1.0, 'O': 5.0}",GGA,mp-1198030,"['mp-1198030', 'mp-1200477', 'mp-1399692', 'mp-1742814', 'mp-1929945', 'mp-1655225']",0.000743875,"{'Sr': 8.0, 'Cu': 4.0, 'C': 4.0, 'O': 20.0}",475.08507610840775,[],NM,False,82,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.263088759540475e-06,0.000743875,0,0.0029755,MP,data/source/MP/cleaned/cifs/MP-mp-1198030.cif,True,,data/final/MP/graphs/B0.08C0.92Cu1Sr2O5-MP-mp-1198030-synth_doped.json,0,True,-4,0,0,0,0,2,0,0,0,0,1,0,1.0,False
Cr1Cu4Sr8Tl3O20,1,0.0,1.0,True,Cr1Cu4Sr8Tl3O20,Cr1Cu4Sr8Tl3O20,25.0,Cuprate,True,Cr2.778Cu11.111Sr22.222Tl8.333O55.55555555555556,Cr-Cu-Sr-Tl-O,5,Supercon,Tl3Cr1Sr8Cu4O20,MP-mp-559339,Sr8Tl3Cr1Cu4O20,Cr-Cu-Sr-Tl-O,Cr2.778Cu11.111Sr22.222Tl8.333O55.55555555555556,C m m m,orthorhombic,3.702758,11.79078411,11.79078411,data/final/MP/cifs/Cr1Cu4Sr8Tl3O20-MP-mp-559339.cif,data/source/MP/raw/cifs/mp-559339.cif,mp-559339,0.0,,2014-03-04 11:49:15,6.344913837867284,,,{'GGA+U': {'task_id': 'mp-1742799'}},0.0626205086111149,3.36082275,520.0,-203.711973,-5.658665916666667,{'tags': ['Thallium chromate strontium coppper oxide (3/1/8/4/16)']},-203.711973,-5.658665916666667,-2.051055602314815,['xas'],False,[81375],True,2021-05-12 10:57:23.123000,FM,36,5,mp-559339,oxide,Sr8Tl3Cr(CuO5)4,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Tl_d', 'Cr_pv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 8.0, 'Tl': 3.0, 'Cr': 1.0, 'Cu': 4.0, 'O': 20.0}",GGA+U,mp-559339,"['mp-565938', 'mp-559339', 'mp-1446056', 'mp-1742799', 'mp-1825288']",1.0476415,"{'Sr': 8.0, 'Tl': 3.0, 'Cr': 1.0, 'Cu': 4.0, 'O': 20.0}",507.7937228770146,[],FM,True,65,1,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 1.8, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0020631241640096,1.0476415,1,1.0476415,MP,data/source/MP/cleaned/cifs/MP-mp-559339.cif,False,,data/final/MP/graphs/Cr1Cu4Sr8Tl3O20-MP-mp-559339.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ir0.32Ru0.68,3,0.1399999999999999,8.0,False,Ir2.56Ru5.44,Ir2Ru6,0.18,Other,True,Ir32Ru68,Ir-Ru,2,Supercon,Ir0.32Ru0.68,MP-mp-862620,Ir2Ru6,Ir-Ru,Ir25Ru75,P 63/m m c,hexagonal,4.324858,5.479349996743059,5.47934974,data/final/MP/cifs/Ir0.32Ru0.68-MP-mp-862620-synth_doped.cif,data/source/MP/raw/cifs/mp-862620.cif,mp-862620,0.0,,2014-08-23 01:08:58,14.63181570566001,10.17188/1309490,"@misc{osti_1309490,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ru3Ir (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1309490"",
    place = ""United States"",
    year = ""2016"",
    month = ""8"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1754749'}},0.0,8.78966032,520.0,-73.74476093,-9.21809511625,{'tags': []},-73.74476093,-9.21809511625,-0.0526952699999991,"['xas', 'elasticity', 'bandstructure']",True,[],True,2021-05-12 10:56:31.128000,NM,8,11,mp-862620,,IrRu3,"{'functional': 'PBE', 'labels': ['Ir', 'Ru_pv'], 'pot_type': 'paw'}","{'Ir': 1.0, 'Ru': 3.0}",GGA,mp-862620,"['mp-862620', 'mp-1002464', 'mp-1004058', 'mp-1050147', 'mp-1050219', 'mp-1385810', 'mp-1754749', 'mp-1804901', 'mp-1009375', 'mp-1619818', 'mp-1050210']",0.00075935,"{'Ir': 2.0, 'Ru': 6.0}",112.45028022464815,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.3505524370112808e-05,0.00075935,0,0.0015187,MP,data/source/MP/cleaned/cifs/MP-mp-862620.cif,True,,data/final/MP/graphs/Ir0.32Ru0.68-MP-mp-862620-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ca0.16Cu1La1.84O4,3,0.0457142857142857,1.0,True,Ca0.16Cu1La1.84O4,Cu1La2O4,34.0,Cuprate,True,Ca2.286Cu14.286La26.286O57.142857142857146,Ca-Cu-La-O,4,Supercon,La1.84Ca0.16Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ca0.16Cu1La1.84O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ca0.16Cu1La1.84O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B2C1Dy0.2Ho0.8Ni2,3,0.0666666666666666,1.0,True,B2C1Dy0.2Ho0.8Ni2,B2C1Ho1Ni2,6.61,Other,True,B33.333C16.667Dy3.333Ho13.333Ni33.333,B-C-Dy-Ho-Ni,5,Supercon,Ho0.8Dy0.2Ni2B2C1,MP-mp-6646,Ho1Ni2B2C1,B-C-Ho-Ni,B33.333C16.667Ho16.667Ni33.333,I 4/m m m,tetragonal,3.529863997734658,3.529863997734658,5.76032203,data/final/MP/cifs/B2C1Dy0.2Ho0.8Ni2-MP-mp-6646-synth_doped.cif,data/source/MP/raw/cifs/mp-6646.cif,mp-6646,0.0,,2011-05-13 04:24:09,8.11075125231065,10.17188/1281460,"@misc{osti_1281460,
    author = ""Persson, Kristin"",
    title = ""Materials Data on HoNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281460"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1670774'}},0.0,6.70981387,520.0,-41.84364575,-6.973940958333333,{'tags': ['Holmium dinickel diboride carbide']},-41.84364575,-6.973940958333333,-0.5192332130555558,"['xas', 'elasticity', 'bandstructure']",True,"[79064, 56650, 79065, 79062, 79063, 79575]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-6646,,HoNi2B2C,"{'functional': 'PBE', 'labels': ['Ho_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Ho': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6646,"['mp-1007146', 'mp-6646', 'mp-1000682', 'mp-1439301', 'mp-1670774', 'mp-1782657', 'mp-1011887', 'mp-1589032']",0.0032459,"{'Ho': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",64.68537905730652,[],NM,False,139,0,"[0.0, -0.0, -0.0, 0.0, 0.0, 0.0]",5.017980952271099e-05,0.0032459,0,0.0032459,MP,data/source/MP/cleaned/cifs/MP-mp-6646.cif,True,,data/final/MP/graphs/B2C1Dy0.2Ho0.8Ni2-MP-mp-6646-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As2Ba0.84Fe2K0.16,3,0.0693333333333333,3.0,False,As6Ba2.52Fe6K0.48,As6Ba2Fe6K1,6.42,Ferrite,True,As40Ba16.8Fe40K3.2,As-Ba-Fe-K,4,Supercon,Ba0.84K0.16Fe2As2,MP-mp-1223567,K1Ba2Fe6As6,As-Ba-Fe-K,As40Ba13.333Fe40K6.667,C 1 2/m 1,monoclinic,5.48060788,7.102799640000001,8.784942288492543,data/final/MP/cifs/As2Ba0.84Fe2K0.16-MP-mp-1223567-synth_doped.cif,data/source/MP/raw/cifs/mp-1223567.cif,mp-1223567,0.0,,2019-01-12 23:56:38.667000,6.101417464045543,,,,0.0186882046666676,4.38014394,520.0,-90.51509253,-6.034339502,{'tags': []},-90.51509253,-6.034339502,-0.4527993862000007,[],False,[],True,2021-05-12 11:00:52.054000,FM,15,4,mp-1223567,,KBa2(FeAs)6,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 2.0, 'Fe': 6.0, 'As': 6.0}",GGA,mp-1223567,"['mp-1223567', 'mp-1374097', 'mp-1656306', 'mp-1808539']",1.3326448,"{'K': 1.0, 'Ba': 2.0, 'Fe': 6.0, 'As': 6.0}",298.92336486922324,[],FM,True,12,2,"[0.0, 0.0, 0.0, 0.3, 0.3, 0.1, 0.3, 0.1, 0.3, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0044581486649028,1.3326448,6,1.3326448,MP,data/source/MP/cleaned/cifs/MP-mp-1223567.cif,True,,data/final/MP/graphs/As2Ba0.84Fe2K0.16-MP-mp-1223567-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
B2C1Ni2Pr0.05Y0.95,2,0.0166666666666666,1.0,True,B2C1Ni2Pr0.05Y0.95,B2C1Ni2Y1,14.05,Other,True,B33.333C16.667Ni33.333Pr0.833Y15.833,B-C-Ni-Pr-Y,5,Supercon,Y0.95Pr0.05Ni2B2C1,MP-mp-6576,Y1Ni2B2C1,B-C-Ni-Y,B33.333C16.667Ni33.333Y16.667,I 4/m m m,tetragonal,3.548790000501972,3.548790000501972,5.76144136,data/final/MP/cifs/B2C1Ni2Pr0.05Y0.95-MP-mp-6576-synth_doped.cif,data/source/MP/raw/cifs/mp-6576.cif,mp-6576,0.0,,2011-05-13 05:21:43,6.099730998852292,10.17188/1281366,"@misc{osti_1281366,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281366"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688230'}},0.0,6.81083016,520.0,-43.677878,-7.279646333333333,{'tags': []},-43.677878,-7.279646333333333,-0.5109282141666659,"['xas', 'bandstructure']",True,"[75816, 89142, 83231, 79574, 41549]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6576,,YNi2B2C,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6576,"['mp-6576', 'mp-1007054', 'mp-1000583', 'mp-1439516', 'mp-1688230', 'mp-1794280', 'mp-1011792', 'mp-1597064']",0.0006603,"{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.3152437079014,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",1.010943177297096e-05,0.0006603,0,0.0006603,MP,data/source/MP/cleaned/cifs/MP-mp-6576.cif,True,,data/final/MP/graphs/B2C1Ni2Pr0.05Y0.95-MP-mp-6576-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Re3W1,1,0.0,1.0,True,Re3W1,Re3W1,8.733333333,Other,True,Re75W25,Re-W,2,Supercon,Re3W1,MP-mp-974416,Re3W1,Re-W,Re75W25,I 4/m m m,tetragonal,3.957485999234904,3.9574859992349047,4.83194366,data/final/MP/cifs/Re3W1-MP-mp-974416.cif,data/source/MP/raw/cifs/mp-974416.cif,mp-974416,0.0,,2015-09-16 23:33:34,19.9840009918906,10.17188/1314486,"@misc{osti_1314486,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Re3W (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1314486"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1765313'}},0.1275012837500018,7.23179888,520.0,-49.78170289,-12.4454257225,{'tags': []},-49.78170289,-12.4454257225,0.1275012837500018,"['xas', 'elasticity', 'bandstructure']",True,[],True,2021-05-12 10:56:35.166000,NM,4,8,mp-974416,,Re3W,"{'functional': 'PBE', 'labels': ['Re_pv', 'W_pv'], 'pot_type': 'paw'}","{'Re': 3.0, 'W': 1.0}",GGA,mp-974416,"['mp-974416', 'mp-974475', 'mp-974524', 'mp-1417436', 'mp-1765313', 'mp-1783614', 'mp-974552', 'mp-1613935']",0.0032856,"{'Re': 3.0, 'W': 1.0}",61.69362663798911,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0]",5.325671676394568e-05,0.0032856,0,0.0032856,MP,data/source/MP/cleaned/cifs/MP-mp-974416.cif,False,,data/final/MP/graphs/Re3W1-MP-mp-974416.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Gd0.08Ru2Y0.92,3,0.0533333333333333,4.0,False,Gd0.32Ru8Y3.68,Ru8Y4,2.2,Other,True,Gd2.667Ru66.667Y30.667,Gd-Ru-Y,3,Supercon,Y0.92Gd0.08Ru2,MP-mp-568186,Y4Ru8,Ru-Y,Ru66.667Y33.333,P 63/m m c,hexagonal,5.276516003067581,5.27651609,8.969022,data/final/MP/cifs/Gd0.08Ru2Y0.92-MP-mp-568186-synth_doped.cif,data/source/MP/raw/cifs/mp-568186.cif,mp-568186,0.0,,2014-02-24 13:08:31,8.939232862246756,10.17188/1272553,"@misc{osti_1272553,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YRu2 (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1272553"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697189'}},0.0,5.96303687,520.0,-103.83404772,-8.65283731,"{'tags': ['Yttrium ruthenium (1/2)', 'Ruthenium yttrium (2/1)']}",-103.83404772,-8.65283731,-0.3144205022222219,"['xas', 'elasticity', 'bandstructure']",True,"[150516, 650775, 650778]",True,2021-05-12 10:56:22.739000,NM,12,10,mp-568186,,YRu2,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ru_pv'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ru': 2.0}",GGA,mp-568186,"['mp-1001392', 'mp-914500', 'mp-568186', 'mp-1102880', 'mp-1103240', 'mp-1432386', 'mp-1697189', 'mp-1829069', 'mp-1007832', 'mp-1599952']",0.006526575,"{'Y': 4.0, 'Ru': 8.0}",216.25703750839943,[],NM,False,194,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001207188459658,0.006526575,0,0.0261063,MP,data/source/MP/cleaned/cifs/MP-mp-568186.cif,True,,data/final/MP/graphs/Gd0.08Ru2Y0.92-MP-mp-568186-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Cu3La0.8Pr0.2O7,3,0.0307692307692307,1.0,True,Ba2Cu3La0.8Pr0.2O7,Ba2Cu3La1O7,59.8,Cuprate,True,Ba15.385Cu23.077La6.154Pr1.538O53.84615384615385,Ba-Cu-La-Pr-O,5,Supercon,La0.8Pr0.2Ba2Cu3O7,MP-mp-622210,Ba2La1Cu3O7,Ba-Cu-La-O,Ba15.385Cu23.077La7.692O53.84615384615385,P m m m,orthorhombic,3.912033,3.978575,11.900925,data/final/MP/cifs/Ba2Cu3La0.8Pr0.2O7-MP-mp-622210-synth_doped.cif,data/source/MP/raw/cifs/mp-622210.cif,mp-622210,0.0,,2014-02-16 07:47:08,6.420495647479224,10.17188/1278110,"@misc{osti_1278110,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2LaCu3O7 (SG:47) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278110"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1676618'}},0.0206010060576886,3.9422618,520.0,-79.09444788,-6.084188298461539,{'tags': ['Lanthanum dibarium tricopper heptaoxide']},-79.09444788,-6.084188298461539,-2.1689347746153844,['bandstructure'],True,[81167],True,2021-05-12 10:58:51.532000,NM,13,10,mp-622210,oxide,Ba2LaCu3O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'La': 1.0, 'Cu': 3.0, 'O': 7.0}",GGA,mp-622210,"['mp-932742', 'mp-931665', 'mp-916330', 'mp-622210', 'mp-1228591', 'mp-1236979', 'mp-1381031', 'mp-1676618', 'mp-1832760', 'mp-1598015']",6.1e-06,"{'Ba': 2.0, 'La': 1.0, 'Cu': 3.0, 'O': 7.0}",185.22976563934355,[],NM,False,47,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.293207211565103e-08,6.1e-06,0,6.1e-06,MP,data/source/MP/cleaned/cifs/MP-mp-622210.cif,True,,data/final/MP/graphs/Ba2Cu3La0.8Pr0.2O7-MP-mp-622210-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
B2Li0.05Mg0.95,2,0.0333333333333333,1.0,True,B2Li0.05Mg0.95,B2Mg1,38.25,Other,True,B66.667Li1.667Mg31.667,B-Li-Mg,3,Supercon,Mg0.95Li0.05B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B2Li0.05Mg0.95-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B2Li0.05Mg0.95-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
B2Mo1,1,0.0,2.0,False,B4Mo2,B4Mo2,0.0,Other,True,B66.667Mo33.333,B-Mo,2,Supercon,B2Mo1,MP-mp-2331,B4Mo2,B-Mo,B66.667Mo33.333,R -3 m,trigonal,3.027958847262584,3.027958847262584,7.20393392,data/final/MP/cifs/B2Mo1-MP-mp-2331.cif,data/source/MP/raw/cifs/mp-2331.cif,mp-2331,0.0,,2011-05-12 22:01:57,7.035996278697895,10.17188/1199416,"@misc{osti_1199416,
    author = ""Persson, Kristin"",
    title = ""Materials Data on B2Mo (SG:166) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199416"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686405'}},0.0,8.84858745,520.0,-50.99919303,-8.499865505,"{'tags': ['Molybdenum boride (1/2)', 'Molybdenum diboride', 'Molybdenum boride (2/4)', 'Molybdenum boride (1/2) - beta', 'Molybdenum boride', 'Dimolybdenium tetraboride']}",-50.99919303,-8.499865505,-0.4317233144444448,"['xas', 'elasticity', 'bandstructure']",True,"[252125, 40907, 418397, 418398, 39554, 167732, 44451, 191908]",True,2021-05-12 10:56:16.728000,NM,6,13,mp-2331,,B2Mo,"{'functional': 'PBE', 'labels': ['B', 'Mo_pv'], 'pot_type': 'paw'}","{'B': 2.0, 'Mo': 1.0}",GGA,mp-2331,"['mp-920254', 'mp-921267', 'mp-906549', 'mp-2331', 'mp-1070862', 'mp-1070903', 'mp-1070939', 'mp-1077759', 'mp-1440002', 'mp-1686405', 'mp-1793532', 'mp-1588848', 'mp-1070920']",0.00061575,"{'B': 4.0, 'Mo': 2.0}",55.49073251748694,[],NM,False,166,0,"[0, 0, 0, 0, 0, 0]",2.2192894995788967e-05,0.00061575,0,0.0012315,MP,data/source/MP/cleaned/cifs/MP-mp-2331.cif,False,,data/final/MP/graphs/B2Mo1-MP-mp-2331.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
B1.84C0.16Mg1,3,0.1066666666666666,1.0,True,B1.84C0.16Mg1,B2Mg1,33.0,Other,True,B61.333C5.333Mg33.333,B-C-Mg,3,Supercon,Mg1B1.84C0.16,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B1.84C0.16Mg1-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B1.84C0.16Mg1-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Mo6Se6Tl2,1,0.0,1.0,True,Mo6Se6Tl2,Mo6Se6Tl2,2.2875,Chevrel,True,Mo42.857Se42.857Tl14.286,Mo-Se-Tl,3,Supercon,Tl2Mo6Se6,MP-mp-3411,Tl2Mo6Se6,Mo-Se-Tl,Mo42.857Se42.857Tl14.286,P 63/m,hexagonal,4.528686,9.236128000475016,9.23612845,data/final/MP/cifs/Mo6Se6Tl2-MP-mp-3411.cif,data/source/MP/raw/cifs/mp-3411.cif,mp-3411,0.3883000000000001,,2011-05-15 16:41:52,7.237248555574806,10.17188/1206717,"@misc{osti_1206717,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Tl(MoSe)3 (SG:176) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1206717"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704781'}},0.0,5.08310258,520.0,-97.57730705,-6.969807646428571,"{'tags': ['Thallium molybdenum selenide (1/3/3)', 'Thallium molybdenum(I/II) selenide (1/3/3)', 'Dithallium octahedro-hexakis(selenomolybdate)', 'Dithallium hexaseleno-octahedro-hexamolybdenum']}",-97.57730705,-6.969807646428571,-0.6881924079092252,"['xas', 'bandstructure']",True,"[53119, 644382, 603627, 23301, 644383, 644381, 604524]",True,2021-05-12 10:57:06.958000,NM,14,10,mp-3411,,Tl(MoSe)3,"{'functional': 'PBE', 'labels': ['Tl_d', 'Mo_pv', 'Se'], 'pot_type': 'paw'}","{'Tl': 1.0, 'Mo': 3.0, 'Se': 3.0}",GGA,mp-3411,"['mp-926439', 'mp-910675', 'mp-926951', 'mp-3411', 'mp-1103582', 'mp-1105103', 'mp-1416373', 'mp-1704781', 'mp-1806018', 'mp-1601950']",8.97e-05,"{'Tl': 2.0, 'Mo': 6.0, 'Se': 6.0}",334.5667329673444,[],NM,False,176,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.362158945357859e-07,8.97e-05,0,0.0001794,MP,data/source/MP/cleaned/cifs/MP-mp-3411.cif,False,,data/final/MP/graphs/Mo6Se6Tl2-MP-mp-3411.json,0,True,6/m,0,3,0,0,0,0,0,1,0,0,0,1.0,False
Ce3Ge2Rh2,1,0.0,4.0,False,Ce12Ge8Rh8,Ce12Ge8Rh8,0.0,Heavy_fermion,True,Ce42.857Ge28.571Rh28.571,Ce-Ge-Rh,3,Supercon,Ce3Rh2Ge2,MP-mp-21597,Ce12Ge8Rh8,Ce-Ge-Rh,Ce42.857Ge28.571Rh28.571,P b c m,orthorhombic,5.608529,8.081324,13.309131,data/final/MP/cifs/Ce3Ge2Rh2-MP-mp-21597.cif,data/source/MP/raw/cifs/mp-21597.cif,mp-21597,0.0,,2014-02-15 07:04:21,8.49433707743128,10.17188/1197023,"@misc{osti_1197023,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ce3(GeRh)2 (SG:57) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197023"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1752907'}},0.0,7.93461383,520.0,-191.00417418,-6.8215776492857145,{'tags': ['Cerium rhodium germanide (3/2/2)']},-191.00417418,-6.8215776492857145,-0.85387209,['xas'],False,[76352],True,2021-05-12 10:56:59.077000,FM,28,7,mp-21597,,Ce3(GeRh)2,"{'functional': 'PBE', 'labels': ['Ce', 'Ge_d', 'Rh_pv'], 'pot_type': 'paw'}","{'Ce': 3.0, 'Ge': 2.0, 'Rh': 2.0}",GGA,mp-21597,"['mp-922122', 'mp-940019', 'mp-940486', 'mp-21597', 'mp-1383857', 'mp-1752907', 'mp-1936964']",1.98119215,"{'Ce': 12.0, 'Ge': 8.0, 'Rh': 8.0}",603.2275787135201,[],FM,True,57,2,"[0.6, 0.6, 0.6, 0.6, 0.6, 0.6, 0.6, 0.6, 0.6, 0.6, 0.6, 0.6, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0131372783334953,1.98119215,12,7.9247686,MP,data/source/MP/cleaned/cifs/MP-mp-21597.cif,False,,data/final/MP/graphs/Ce3Ge2Rh2-MP-mp-21597.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ce0.15Cu1Nd1.85O4,2,0.0428571428571428,1.0,True,Ce0.15Cu1Nd1.85O4,Cu1Nd2O4,21.2325,Cuprate,True,Ce2.143Cu14.286Nd26.429O57.142857142857146,Ce-Cu-Nd-O,4,Supercon,Nd1.85Ce0.15Cu1O4,MP-mp-4158,Nd2Cu1O4,Cu-Nd-O,Cu14.286Nd28.571O57.142857142857146,I 4/m m m,tetragonal,3.973854000245551,3.973854000245551,6.78296857,data/final/MP/cifs/Ce0.15Cu1Nd1.85O4-MP-mp-4158-synth_doped.cif,data/source/MP/raw/cifs/mp-4158.cif,mp-4158,0.0,,2011-05-13 10:19:33,7.086167303782593,10.17188/1207899,"@misc{osti_1207899,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nd2CuO4 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207899"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-670050'}},0.0009497997619085,3.16510927,520.0,-51.48091453,-7.354416361428571,"{'tags': ['Dineodymium copper tetraoxide', 'Dineodymium copper oxide', 'Dineodymium cuprate', 'High pressure experimental phase']}",-51.48091453,-7.354416361428571,-2.971653917142857,"['xas', 'elasticity', 'bandstructure']",True,"[261376, 203228, 160629, 261375, 69479, 186590, 4203, 75830, 75825, 202885, 203229, 71181, 82067, 75828, 69886, 75826, 75829, 75824, 75827, 69482, 86752]",True,2021-05-12 10:56:20.740000,NM,7,11,mp-4158,oxide,Nd2CuO4,"{'functional': 'PBE', 'labels': ['Nd_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Nd': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-4158,"['mp-670050', 'mp-660368', 'mp-4158', 'mp-1078016', 'mp-1173374', 'mp-1440751', 'mp-1668619', 'mp-1797319', 'mp-1588086', 'mp-1590518', 'mp-688505']",0.0084899,"{'Nd': 2.0, 'Cu': 1.0, 'O': 4.0}",97.4899480873212,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",8.708487558528232e-05,0.0084899,0,0.0084899,MP,data/source/MP/cleaned/cifs/MP-mp-4158.cif,True,,data/final/MP/graphs/Ce0.15Cu1Nd1.85O4-MP-mp-4158-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
N0.84Ti1,3,0.0869565217391304,1.0,True,N0.84Ti1,N1Ti1,0.0,Other,True,N45.652Ti54.348,N-Ti,2,Supercon,N0.84Ti1,MP-mp-492,Ti1N1,N-Ti,N50Ti50,F m -3 m,cubic,3.00770274,3.00770274,3.00770274,data/final/MP/cifs/N0.84Ti1-MP-mp-492-synth_doped.cif,data/source/MP/raw/cifs/mp-492.cif,mp-492,0.0,,2011-05-12 17:28:04,5.340297482734746,10.17188/1208488,"@misc{osti_1208488,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TiN (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208488"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1674200'}},0.0,9.09773138,520.0,-19.66499517,-9.832497585,"{'tags': ['Titanium nitride', 'Titanium nitride (1/1)', 'Titanium(III) nitride', 'Titanium nitride - B1', 'Osbornite']}",-19.66499517,-9.832497585,-1.897004114166668,"['xas', 'elasticity', 'bandstructure']",True,"[26947, 192040, 181787, 644778, 64905, 64909, 183415, 236802, 105128, 184916, 644774, 644770, 644780, 644768, 644783, 186008, 152807, 187188, 644777, 644772, 644781, 64904, 656836, 604220, 236801, 644769, 644775, 644776, 186382, 658338, 601248, 644779, 64908, 64907]",True,2021-05-12 10:56:20.740000,NM,2,42,mp-492,,TiN,"{'functional': 'PBE', 'labels': ['Ti_pv', 'N'], 'pot_type': 'paw'}","{'Ti': 1.0, 'N': 1.0}",GGA,mp-492,"['mp-1000437', 'mp-1006912', 'mvc-13876', 'mp-492', 'mp-1057172', 'mp-1057185', 'mp-1057208', 'mp-1058302', 'mp-1058334', 'mp-1058311', 'mp-1058844', 'mp-1058812', 'mp-1058719', 'mp-1058731', 'mp-1058768', 'mp-1058795', 'mp-1059321', 'mp-1059405', 'mp-1059335', 'mp-1059364', 'mp-1059371', 'mp-1059381', 'mp-1060451', 'mp-1060512', 'mp-1060469', 'mp-1061088', 'mp-1061064', 'mp-1061129', 'mp-1440637', 'mp-1674200', 'mp-1793307', 'mp-1011627', 'mp-1595453', 'mp-1594449', 'mp-1058832', 'mp-1061120', 'mp-1057200', 'mp-1058325', 'mp-1059400', 'mp-1058755', 'mp-1060496', 'mp-1059351']",0.0002595,"{'Ti': 1.0, 'N': 1.0}",19.23932072646892,[],NM,False,225,0,"[0, 0]",1.3488002185180434e-05,0.0002595,0,0.0002595,MP,data/source/MP/cleaned/cifs/MP-mp-492.cif,True,,data/final/MP/graphs/N0.84Ti1-MP-mp-492-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
H0.965Pd1,2,0.0178117048346056,2.0,False,H1.93Pd2,H2Pd2,6.45,Other,True,H49.109Pd50.891,H-Pd,2,Supercon,H0.965Pd1,MP-mp-1184548,H2Pd2,H-Pd,H50Pd50,P 63 m c,hexagonal,2.968136003881316,2.96813585,5.040799,data/final/MP/cifs/H0.965Pd1-MP-mp-1184548-synth_doped.cif,data/source/MP/raw/cifs/mp-1184548.cif,mp-1184548,0.0,,2019-01-11 12:52:40.348000,9.276812227294194,,,{'GGA': {'task_id': 'mp-1734957'}},0.0,3.52113336,520.0,-17.47744839,-4.3693620975,{'tags': []},-17.47744839,-4.3693620975,-0.0830581699999992,['bandstructure'],True,[],True,2021-05-12 10:58:27.755000,NM,4,5,mp-1184548,,HPd,"{'functional': 'PBE', 'labels': ['H', 'Pd'], 'pot_type': 'paw'}","{'H': 1.0, 'Pd': 1.0}",GGA,mp-1184548,"['mp-1184548', 'mp-1426775', 'mp-1734957', 'mp-1792734', 'mp-1612181']",3.7e-05,"{'H': 2.0, 'Pd': 2.0}",38.45896345503417,[],NM,False,186,0,"[0, 0, 0, 0]",1.924128820749941e-06,3.7e-05,0,7.4e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1184548.cif,True,,data/final/MP/graphs/H0.965Pd1-MP-mp-1184548-synth_doped.json,0,True,6mm,0,5,0,0,0,0,0,1,0,0,0,1.0,False
Bi2Ca1Cu2Sr2O8,1,0.0,2.0,False,Bi4Ca2Cu4Sr4O16,Bi4Ca2Cu4Sr4O16,88.25,Cuprate,True,Bi13.333Ca6.667Cu13.333Sr13.333O53.333333333333336,Bi-Ca-Cu-Sr-O,5,Supercon,Bi2Ca1Sr2Cu2O8,MP-mp-1218930,Sr4Ca2Cu4Bi4O16,Bi-Ca-Cu-Sr-O,Bi13.333Ca6.667Cu13.333Sr13.333O53.333333333333336,C c c 2,orthorhombic,5.417115,5.472898000129128,16.11398919,data/final/MP/cifs/Bi2Ca1Cu2Sr2O8-MP-mp-1218930.cif,data/source/MP/raw/cifs/mp-1218930.cif,mp-1218930,0.0,,2019-01-12 20:01:06.544000,6.266668983881059,,,,0.039252223722225,4.51768334,520.0,-173.15021002,-5.771673667333333,{'tags': []},-173.15021002,-5.771673667333333,-2.074956548222222,[],False,[],True,2021-05-12 11:00:42.526000,NM,30,3,mp-1218930,oxide,Sr2CaCu2(BiO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",GGA,mp-1218930,"['mp-1218930', 'mp-1359698', 'mp-1817714']",0.00011165,"{'Sr': 4.0, 'Ca': 2.0, 'Cu': 4.0, 'Bi': 4.0, 'O': 16.0}",470.7976286073367,[],NM,False,37,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.743014544498498e-07,0.00011165,0,0.0002233,MP,data/source/MP/cleaned/cifs/MP-mp-1218930.cif,False,,data/final/MP/graphs/Bi2Ca1Cu2Sr2O8-MP-mp-1218930.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Ca0.4La0.6Mn1O3,2,0.0399999999999999,4.0,False,Ca1.6La2.4Mn4O12,Ca2La2Mn4O12,0.0,Oxide,True,Ca8La12Mn20O60,Ca-La-Mn-O,4,Supercon,La0.6Ca0.4Mn1O3,MP-mp-39689,Ca2La2Mn4O12,Ca-La-Mn-O,Ca10La10Mn20O60,P m n 21,orthorhombic,5.479104380000001,5.52886738,7.700679,data/final/MP/cifs/Ca0.4La0.6Mn1O3-MP-mp-39689-synth_doped.cif,data/source/MP/raw/cifs/mp-39689.cif,mp-39689,0.0,,2013-11-18 12:40:04,5.479017180296817,10.17188/1207686,"@misc{osti_1207686,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CaLaMn2O6 (SG:31) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207686"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-1683310'}},0.1050893590166612,5.23572666,520.0,-150.49076929,-7.5245384645,{'tags': ['Lanthanum calcium manganate (III/IV)']},-150.49076929,-7.5245384645,-2.774998104586208,"['xas', 'elasticity', 'bandstructure']",True,[246478],True,2021-05-12 10:56:37.246000,FM,20,18,mp-39689,oxide,CaLaMn2O6,"{'functional': 'PBE', 'labels': ['Ca_sv', 'La', 'Mn_pv', 'O'], 'pot_type': 'paw'}","{'Ca': 1.0, 'La': 1.0, 'Mn': 2.0, 'O': 6.0}",GGA+U,mp-39689,"['mp-915443', 'mp-931300', 'mp-932172', 'mp-646643', 'mvc-11813', 'mp-41744', 'mp-41893', 'mp-39689', 'mp-40316', 'mp-1182471', 'mp-1182841', 'mp-1237098', 'mp-1293799', 'mp-1284909', 'mp-1281712', 'mp-1279698', 'mp-1369165', 'mp-1683310']",7.0005098,"{'Ca': 2.0, 'La': 2.0, 'Mn': 4.0, 'O': 12.0}",233.278464207782,[],FM,True,31,2,"[0.0, 0.0, 0.0, 0.0, 3.6, 3.6, 3.6, 3.6, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0600184832644013,7.0005098,4,14.0010196,MP,data/source/MP/cleaned/cifs/MP-mp-39689.cif,True,,data/final/MP/graphs/Ca0.4La0.6Mn1O3-MP-mp-39689-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,1,0,0,0,1.0,False
La1Sb1,1,0.0,1.0,True,La1Sb1,La1Sb1,0.0,Other,True,La50Sb50,La-Sb,2,Supercon,La1Sb1,MP-mp-1065,La1Sb1,La-Sb,La50Sb50,F m -3 m,cubic,4.63796995,4.63796995,4.63796995,data/final/MP/cifs/La1Sb1-MP-mp-1065.cif,data/source/MP/raw/cifs/mp-1065.cif,mp-1065,0.0,,2015-11-24 07:42:06,6.135695656064844,10.17188/1187259,"@misc{osti_1187259,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaSb (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187259"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1670937'}},0.0,6.45420233,520.0,-11.59945021,-5.799725105,{'tags': ['Lanthanum antimonide']},-11.59945021,-5.799725105,-1.3632209325000009,"['xas', 'bandstructure']",True,"[641904, 44805, 52011, 641901, 641893, 641902]",True,2021-05-12 10:56:51.169000,NM,2,8,mp-1065,,LaSb,"{'functional': 'PBE', 'labels': ['La', 'Sb'], 'pot_type': 'paw'}","{'La': 1.0, 'Sb': 1.0}",GGA,mp-1065,"['mp-988030', 'mp-987208', 'mp-1065', 'mp-1476236', 'mp-1670937', 'mp-1781450', 'mp-988277', 'mp-1590679']",0.00036,"{'La': 1.0, 'Sb': 1.0}",70.54541498009333,[],NM,False,225,0,"[0, 0]",5.103095645572227e-06,0.00036,0,0.00036,MP,data/source/MP/cleaned/cifs/MP-mp-1065.cif,False,,data/final/MP/graphs/La1Sb1-MP-mp-1065.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Co0.7Cu0.3La1.15Sr0.85O4,3,0.1285714285714286,1.0,True,Co0.7Cu0.3La1.15Sr0.85O4,Co1La1Sr1O4,0.0,Cuprate,True,Co10Cu4.286La16.429Sr12.143O57.142857142857146,Co-Cu-La-Sr-O,5,Supercon,La1.15Sr0.85Cu0.3Co0.7O4,MP-mp-1274783,Sr2La2Co2O8,Co-La-Sr-O,Co14.286La14.286Sr14.286O57.142857142857146,I 4 m m,tetragonal,3.852036030794024,3.8600340037132814,6.94756368,data/final/MP/cifs/Co0.7Cu0.3La1.15Sr0.85O4-MP-mp-1274783-synth_doped.cif,data/source/MP/raw/cifs/mp-1274783.cif,mp-1274783,1.3403,,2020-04-24 07:30:05.603000,6.106618071253213,,,,0.0,4.72378166,520.0,-97.02944627,-6.930674733571428,{'tags': []},-97.02944627,-6.930674733571428,-2.767865823095238,[],False,[],True,2021-05-12 11:01:17.921000,AFM,14,6,mp-1274783,oxide,SrLaCoO4,"{'functional': 'PBE', 'labels': ['Sr_sv', 'La', 'Co', 'O'], 'pot_type': 'paw'}","{'Sr': 1.0, 'La': 1.0, 'Co': 1.0, 'O': 4.0}",GGA+U,mp-1274783,"['mp-1274783', 'mp-1286058', 'mp-1277199', 'mp-1283017', 'mp-1286562', 'mp-1274449']",3e-07,"{'Sr': 2.0, 'La': 2.0, 'Co': 2.0, 'O': 8.0}",190.05144036510364,[],AFM,True,5,1,"[0.0, 0.0, 0.0, 0.0, -2.9, 2.9, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",3.157040003734532e-09,3e-07,2,6e-07,MP,data/source/MP/cleaned/cifs/MP-mp-1274783.cif,True,,data/final/MP/graphs/Co0.7Cu0.3La1.15Sr0.85O4-MP-mp-1274783-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,0,0,1,0,1.0,False
Pt0.3Ta0.7,3,0.1,4.0,False,Pt1.2Ta2.8,Pt1Ta3,1.225,Other,True,Pt30Ta70,Pt-Ta,2,Supercon,Pt0.3Ta0.7,MP-mp-1187219,Ta3Pt1,Pt-Ta,Pt25Ta75,P m -3 m,cubic,4.128618,4.128618,4.128618,data/final/MP/cifs/Pt0.3Ta0.7-MP-mp-1187219-synth_doped.cif,data/source/MP/raw/cifs/mp-1187219.cif,mp-1187219,0.0,,2019-01-11 14:55:13.700000,17.41200447596201,,,{'GGA': {'task_id': 'mp-1763652'}},0.0472411499999996,6.25291344,520.0,-42.5757307,-10.643932675,{'tags': []},-42.5757307,-10.643932675,-0.2328725250000012,['bandstructure'],True,[],True,2021-05-12 10:58:31.620000,NM,4,5,mp-1187219,,Ta3Pt,"{'functional': 'PBE', 'labels': ['Ta_pv', 'Pt'], 'pot_type': 'paw'}","{'Ta': 3.0, 'Pt': 1.0}",GGA,mp-1187219,"['mp-1187219', 'mp-1415032', 'mp-1763652', 'mp-1799805', 'mp-1616496']",0.0074793,"{'Ta': 3.0, 'Pt': 1.0}",70.37430275391887,[],NM,False,221,0,"[0, 0, 0, 0]",0.0001062788504797,0.0074793,0,0.0074793,MP,data/source/MP/cleaned/cifs/MP-mp-1187219.cif,True,,data/final/MP/graphs/Pt0.3Ta0.7-MP-mp-1187219-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
As2Ba0.74Fe2K0.26,3,0.096,2.0,False,As4Ba1.48Fe4K0.52,As4Ba1Fe4K1,32.0,Ferrite,True,As40Ba14.8Fe40K5.2,As-Ba-Fe-K,4,Supercon,Ba0.74K0.26Fe2As2,MP-mp-1223517,K1Ba1Fe4As4,As-Ba-Fe-K,As40Ba10Fe40K10,C m m m,orthorhombic,5.479027,5.480024002658328,7.13170472,data/final/MP/cifs/As2Ba0.74Fe2K0.26-MP-mp-1223517-synth_doped.cif,data/source/MP/raw/cifs/mp-1223517.cif,mp-1223517,0.0,,2019-01-12 23:54:03.876000,5.87534599912672,,,{'GGA': {'task_id': 'mp-1743010'}},0.0132513644999994,4.21185628,520.0,-59.66633886,-5.966633886,{'tags': []},-59.66633886,-5.966633886,-0.4120461663000007,[],False,[],True,2021-05-12 11:00:52.054000,FM,10,4,mp-1223517,,KBa(FeAs)4,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",GGA,mp-1223517,"['mp-1223517', 'mp-1396881', 'mp-1743010', 'mp-1827585']",0.9947188,"{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",197.6961518155852,[],FM,True,65,1,"[0.0, 0.0, 0.3, 0.3, 0.3, 0.3, 0.0, 0.0, 0.0, 0.0]",0.0050315536790412,0.9947188,4,0.9947188,MP,data/source/MP/cleaned/cifs/MP-mp-1223517.cif,True,,data/final/MP/graphs/As2Ba0.74Fe2K0.26-MP-mp-1223517-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Mo6Pb0.1Se8Yb0.9,2,0.0133333333333333,1.0,True,Mo6Pb0.1Se8Yb0.9,Mo6Se8Yb1,6.3,Heavy_fermionChevrel,False,Mo40Pb0.667Se53.333Yb6,Mo-Pb-Se-Yb,4,Supercon,Pb0.1Yb0.9Mo6Se8,MP-mp-1103921,Yb1Mo6Se8,Mo-Se-Yb,Mo40Se53.333Yb6.667,R -3,trigonal,6.82637283,6.82637283,6.82637258,data/final/MP/cifs/Mo6Pb0.1Se8Yb0.9-MP-mp-1103921-synth_doped.cif,data/source/MP/raw/cifs/mp-1103921.cif,mp-1103921,0.0,,2018-07-18 20:18:04,7.207876122112935,,,{'GGA': {'task_id': 'mp-1673657'}},0.0413582060000008,4.81150279,520.0,-105.19901031,-7.013267354000001,"{'tags': ['Ytterbium molybdenum(II/III) selenide  (1/6/8)', 'Ytterbium molybdenum selenide (1/6/8)']}",-105.19901031,-7.013267354000001,-0.9596168019166668,['bandstructure'],True,"[644390, 600676]",True,2021-05-12 10:58:20.361000,NM,15,6,mp-1103921,,Yb(Mo3Se4)2,"{'functional': 'PBE', 'labels': ['Yb_2', 'Mo_pv', 'Se'], 'pot_type': 'paw'}","{'Yb': 1.0, 'Mo': 6.0, 'Se': 8.0}",GGA,mp-1103921,"['mp-1103921', 'mp-1104021', 'mp-1430393', 'mp-1673657', 'mp-1806630', 'mp-1603284']",0.0008047,"{'Yb': 1.0, 'Mo': 6.0, 'Se': 8.0}",318.005147027978,[],NM,False,148,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.530462187548188e-06,0.0008047,0,0.0008047,MP,data/source/MP/cleaned/cifs/MP-mp-1103921.cif,True,,data/final/MP/graphs/Mo6Pb0.1Se8Yb0.9-MP-mp-1103921-synth_doped.json,0,True,-3,0,0,0,0,0,0,2,1,0,0,0,1.0,False
Mo1Re4,3,0.1,0.75,False,Mo0.75Re3,Mo1Re3,7.85,Other,True,Mo20Re80,Mo-Re,2,Supercon,Mo1Re4,MP-mp-1219135,Re3Mo1,Mo-Re,Mo25Re75,P -6 m 2,hexagonal,2.7840939971605465,2.7840947500000004,9.130566,data/final/MP/cifs/Mo1Re4-MP-mp-1219135-synth_doped.cif,data/source/MP/raw/cifs/mp-1219135.cif,mp-1219135,0.0,,2019-01-12 20:11:21.516000,17.733846539347173,,,{'GGA': {'task_id': 'mp-1764653'}},0.1297208931249986,7.3736329,520.0,-47.71046775,-11.9276169375,{'tags': []},-47.71046775,-11.9276169375,0.1171892087500001,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,4,5,mp-1219135,,Re3Mo,"{'functional': 'PBE', 'labels': ['Re_pv', 'Mo_pv'], 'pot_type': 'paw'}","{'Re': 3.0, 'Mo': 1.0}",GGA,mp-1219135,"['mp-1219135', 'mp-1432897', 'mp-1764653', 'mp-1938705', 'mp-1613174']",0.0029915,"{'Re': 3.0, 'Mo': 1.0}",61.290939309818505,[],NM,False,187,0,"[0.0, 0.0, 0.0, 0.0]",4.880819308182435e-05,0.0029915,0,0.0029915,MP,data/source/MP/cleaned/cifs/MP-mp-1219135.cif,True,,data/final/MP/graphs/Mo1Re4-MP-mp-1219135-synth_doped.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Nb2Si1,3,0.1333333333333334,3.0,False,Nb6Si3,Nb6Si4,0.0,Other,True,Nb66.667Si33.333,Nb-Si,2,Supercon,Nb2Si1,MP-mp-1078996,Nb6Si4,Nb-Si,Nb60Si40,P 4/m b m,tetragonal,3.51124,6.761111,6.761111,data/final/MP/cifs/Nb2Si1-MP-mp-1078996-synth_doped.cif,data/source/MP/raw/cifs/mp-1078996.cif,mp-1078996,0.0,,2018-04-13 16:49:16,6.929227285004795,,,{'GGA': {'task_id': 'mp-1698428'}},0.0224444126666689,7.44190399,520.0,-88.7654345,-8.87654345,{'tags': ['Niobium silicide (3/2)']},-88.7654345,-8.87654345,-0.6172348179999986,['bandstructure'],True,[645431],True,2021-05-12 10:58:16.596000,NM,10,5,mp-1078996,,Nb3Si2,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Si'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Si': 2.0}",GGA,mp-1078996,"['mp-1078996', 'mp-1425805', 'mp-1698428', 'mp-1780166', 'mp-1601325']",0.0002535,"{'Nb': 6.0, 'Si': 4.0}",160.50798671089004,[],NM,False,127,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.158721322155873e-06,0.0002535,0,0.000507,MP,data/source/MP/cleaned/cifs/MP-mp-1078996.cif,True,,data/final/MP/graphs/Nb2Si1-MP-mp-1078996-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
La0.84Sn3Tm0.16,3,0.08,1.0,True,La0.84Sn3Tm0.16,La1Sn3,3.315,Other,True,La21Sn75Tm4,La-Sn-Tm,3,Supercon,La0.84Sn3Tm0.16,MP-mp-633,La1Sn3,La-Sn,La25Sn75,P m -3 m,cubic,4.820061,4.820061,4.820061,data/final/MP/cifs/La0.84Sn3Tm0.16-MP-mp-633-synth_doped.cif,data/source/MP/raw/cifs/mp-633.cif,mp-633,0.0,,2011-05-13 04:30:54,7.340536659909055,10.17188/1279358,"@misc{osti_1279358,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaSn3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1279358"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688008'}},0.0,8.68748013,520.0,-19.26482408,-4.81620602,"{'tags': ['Lanthanum stannide (1/3)', 'Lanthanum tin (1/3)']}",-19.26482408,-4.81620602,-0.5750253525,"['xas', 'bandstructure']",True,"[641991, 104721, 641986, 261870, 104720, 151359, 642000, 641998, 191074]",True,2021-05-12 10:57:30.779000,NM,4,12,mp-633,,LaSn3,"{'functional': 'PBE', 'labels': ['La', 'Sn_d'], 'pot_type': 'paw'}","{'La': 1.0, 'Sn': 3.0}",GGA,mp-633,"['mp-991111', 'mp-993073', 'mp-633', 'mp-1066557', 'mp-1066573', 'mp-1066594', 'mp-1442023', 'mp-1688008', 'mp-1787436', 'mp-994393', 'mp-1590336', 'mp-1066601']",0.0055557,"{'La': 1.0, 'Sn': 3.0}",111.98441958300587,[],NM,False,221,0,"[0, 0, 0, 0]",4.961136576577034e-05,0.0055557,0,0.0055557,MP,data/source/MP/cleaned/cifs/MP-mp-633.cif,True,,data/final/MP/graphs/La0.84Sn3Tm0.16-MP-mp-633-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba0.066Cu1La1.934O4,2,0.0188571428571428,1.0,True,Ba0.066Cu1La1.934O4,Cu1La2O4,22.6,Cuprate,True,Ba0.943Cu14.286La27.629O57.142857142857146,Ba-Cu-La-O,4,Supercon,La1.934Ba0.066Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ba0.066Cu1La1.934O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ba0.066Cu1La1.934O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As1Co0.05Fe0.95Sm1O1,2,0.025,2.0,False,As2Co0.1Fe1.9Sm2O2,As2Fe2Sm2O2,2.565,Ferrite,True,As25Co1.25Fe23.75Sm25O25,As-Co-Fe-Sm-O,5,Supercon,Sm1Fe0.95Co0.05As1O1,MP-mp-20349,Sm2Fe2As2O2,As-Fe-Sm-O,As25Fe25Sm25O25,P 4/n m m,tetragonal,4.026492,4.026492,9.046755,data/final/MP/cifs/As1Co0.05Fe0.95Sm1O1-MP-mp-20349-synth_doped.cif,data/source/MP/raw/cifs/mp-20349.cif,mp-20349,0.0,,2014-02-19 11:24:42,6.727802583283198,,,{'GGA+U': {'task_id': 'mp-1695938'}},0.3015723809374986,3.77685593,520.0,-52.73407138,-6.5917589225,{'tags': ['Samarium iron arsenic oxide (1/1/1/1)']},-52.73407138,-6.5917589225,-1.6285904237499995,"['xas', 'elasticity', 'bandstructure']",True,"[236652, 236653, 422002, 163457, 163458]",True,2021-05-12 10:56:16.728000,FM,8,10,mp-20349,oxide,SmFeAsO,"{'functional': 'PBE', 'labels': ['Sm_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Sm': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-20349,"['mp-24944', 'mp-1078897', 'mp-1079866', 'mp-1173321', 'mp-20349', 'mp-1425472', 'mp-1695938', 'mp-1772503', 'mp-1789694', 'mp-1588381']",3.75729895,"{'Sm': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",146.67176231613362,[],FM,True,129,1,"[0.0, 0.0, 3.5, 3.5, -0.0, -0.0, -0.0, -0.0]",0.0512341147425717,3.75729895,2,7.5145979,MP,data/source/MP/cleaned/cifs/MP-mp-20349.cif,True,,data/final/MP/graphs/As1Co0.05Fe0.95Sm1O1-MP-mp-20349-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Cu0.985La2Li0.015O4,2,0.0042857142857142,1.0,True,Cu0.985La2Li0.015O4,Cu1La2O4,0.0,Cuprate,True,Cu14.071La28.571Li0.214O57.142857142857146,Cu-La-Li-O,4,Supercon,La2Cu0.985Li0.015O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu0.985La2Li0.015O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu0.985La2Li0.015O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Pt1Sn4,1,0.0,2.0,False,Pt2Sn8,Pt2Sn8,1.19,Other,True,Pt20Sn80,Pt-Sn,2,Supercon,Pt1Sn4,MP-mp-20662,Sn8Pt2,Pt-Sn,Pt20Sn80,C c c a,orthorhombic,6.518976,6.534133995479142,6.64754194,data/final/MP/cifs/Pt1Sn4-MP-mp-20662.cif,data/source/MP/raw/cifs/mp-20662.cif,mp-20662,0.0,,2014-02-22 15:08:59,9.02216064493154,10.17188/1195791,"@misc{osti_1195791,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sn4Pt (SG:68) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195791"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695479'}},0.0,8.05515966,520.0,-47.02851517,-4.702851517,"{'tags': ['Platinum stannide (1/4)', 'Platinum tin (1/4)']}",-47.02851517,-4.702851517,-0.2810124909999999,"['xas', 'elasticity', 'bandstructure']",True,"[54609, 105793, 649677]",True,2021-05-12 10:56:14.760000,NM,10,8,mp-20662,,Sn4Pt,"{'functional': 'PBE', 'labels': ['Sn_d', 'Pt'], 'pot_type': 'paw'}","{'Sn': 4.0, 'Pt': 1.0}",GGA,mp-20662,"['mp-918461', 'mp-919455', 'mp-905158', 'mp-20662', 'mp-1414347', 'mp-1695479', 'mp-1938931', 'mp-1602226']",0.0005186,"{'Sn': 8.0, 'Pt': 2.0}",246.6005688510724,[],NM,False,68,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.20599191977691e-06,0.0005186,0,0.0010372,MP,data/source/MP/cleaned/cifs/MP-mp-20662.cif,False,,data/final/MP/graphs/Pt1Sn4-MP-mp-20662.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ca1.8Cl2Cu1Na0.2O2,3,0.0571428571428571,1.0,True,Ca1.8Cl2Cu1Na0.2O2,Ca2Cl2Cu1O2,26.95,Cuprate,True,Ca25.714Cl28.571Cu14.286Na2.857O28.571428571428573,Ca-Cl-Cu-Na-O,5,Supercon,Ca1.8Na0.2Cu1Cl2O2,MP-mp-23143,Ca2Cu1Cl2O2,Ca-Cl-Cu-O,Ca28.571Cl28.571Cu14.286O28.571428571428573,I 4/m m m,tetragonal,3.88024600076171,3.880246000761709,8.12907187,data/final/MP/cifs/Ca1.8Cl2Cu1Na0.2O2-MP-mp-23143-synth_doped.cif,data/source/MP/raw/cifs/mp-23143.cif,mp-23143,0.0,,2014-02-21 09:50:06,3.554337150605878,10.17188/1199263,"@misc{osti_1199263,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ca2Cu(ClO)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199263"",
    place = ""United States"",
    year = ""2016"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700223'}},0.0191527683333321,4.19679796,520.0,-35.95348475,-5.136212107142858,"{'tags': ['Dicalcium copper dioxide dichloride', 'Dicalcium dichlorodioxocuprate']}",-35.95348475,-5.136212107142858,-2.407440427142858,"['xas', 'elasticity', 'bandstructure']",True,"[1027, 83117, 41581]",True,2021-05-12 10:56:16.728000,NM,7,8,mp-23143,oxide,Ca2Cu(ClO)2,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Cu_pv', 'Cl', 'O'], 'pot_type': 'paw'}","{'Ca': 2.0, 'Cu': 1.0, 'Cl': 2.0, 'O': 2.0}",GGA,mp-23143,"['mp-992231', 'mp-990553', 'mp-23143', 'mp-1436301', 'mp-1700223', 'mp-1803462', 'mp-993865', 'mp-1592909']",0.0134962,"{'Ca': 2.0, 'Cu': 1.0, 'Cl': 2.0, 'O': 2.0}",115.21141865211318,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001171429026557,0.0134962,0,0.0134962,MP,data/source/MP/cleaned/cifs/MP-mp-23143.cif,True,,data/final/MP/graphs/Ca1.8Cl2Cu1Na0.2O2-MP-mp-23143-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Mo2S3,3,0.1333333333333333,1.0,True,Mo2S3,Mo2S4,0.0,Chevrel,True,Mo40S60,Mo-S,2,Supercon,Mo2S3,MP-mp-2815,Mo2S4,Mo-S,Mo33.333S66.667,P 63/m m c,hexagonal,3.1903159980743583,3.19031539,14.879004,data/final/MP/cifs/Mo2S3-MP-mp-2815-synth_doped.cif,data/source/MP/raw/cifs/mp-2815.cif,mp-2815,1.4648999999999996,,2011-05-13 04:19:06,4.053379365580824,10.17188/1202268,"@misc{osti_1202268,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MoS2 (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1202268"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687660'}},0.0,3.76712671,520.0,-43.43443268,-7.239072113333333,"{'tags': ['Molybdenum(IV) sulfide', 'Molybdenite-2H', 'Molybdenite', 'Molybdenite 2H', 'Molybdenum sulfide (1/2)', 'Molybdenum disulfide']}",-43.43443268,-7.239072113333333,-1.2015578587500002,"['diel', 'xas', 'elasticity', 'bandstructure']",True,"[49801, 95569, 644246, 601647, 84180, 191305, 644245, 24000, 31067, 95570, 644250, 105091]",True,2021-05-12 10:56:18.721000,NM,6,16,mp-2815,,MoS2,"{'functional': 'PBE', 'labels': ['Mo_pv', 'S'], 'pot_type': 'paw'}","{'Mo': 1.0, 'S': 2.0}",GGA,mp-2815,"['mp-850809', 'mp-851356', 'mp-850046', 'mp-658582', 'mp-664334', 'mp-655561', 'mp-2815', 'mp-1077043', 'mp-1077396', 'mp-1077798', 'mp-1141285', 'mp-1476234', 'mp-1687660', 'mp-1788428', 'mp-852058', 'mp-1594746']",1.73e-05,"{'Mo': 2.0, 'S': 4.0}",131.15105417850478,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0]",2.638179328159058e-07,1.73e-05,0,3.46e-05,MP,data/source/MP/cleaned/cifs/MP-mp-2815.cif,True,,data/final/MP/graphs/Mo2S3-MP-mp-2815-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
In1.5La1Sn1.5,1,0.0,2.0,False,In3La2Sn3,In3La2Sn3,1.19,Other,True,In37.5La25Sn37.5,In-La-Sn,3,Supercon,La1In1.5Sn1.5,MP-mp-1225978,La2In3Sn3,In-La-Sn,In37.5La25Sn37.5,P m m m,orthorhombic,4.794561,4.797351,9.587081,data/final/MP/cifs/In1.5La1Sn1.5-MP-mp-1225978.cif,data/source/MP/raw/cifs/mp-1225978.cif,mp-1225978,0.0,,2019-01-13 02:00:48.279000,7.367608756678875,,,{'GGA': {'task_id': 'mp-1753406'}},0.0,8.34913117,520.0,-34.42923379,-4.30365422375,{'tags': []},-34.42923379,-4.30365422375,-0.534181603125,['bandstructure'],True,[],True,2021-05-12 10:58:45.495000,NM,8,5,mp-1225978,,La2(InSn)3,"{'functional': 'PBE', 'labels': ['La', 'In_d', 'Sn_d'], 'pot_type': 'paw'}","{'La': 2.0, 'In': 3.0, 'Sn': 3.0}",GGA,mp-1225978,"['mp-1225978', 'mp-1397386', 'mp-1753406', 'mp-1784846', 'mp-1622921']",0.038799,"{'La': 2.0, 'In': 3.0, 'Sn': 3.0}",220.51429087639536,[],NM,False,47,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0001759477802812,0.038799,0,0.038799,MP,data/source/MP/cleaned/cifs/MP-mp-1225978.cif,False,,data/final/MP/graphs/In1.5La1Sn1.5-MP-mp-1225978.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ir0.2Os1.8Th1,3,0.1333333333333333,2.0,False,Ir0.4Os3.6Th2,Os4Th2,2.93,Other,True,Ir6.667Os60Th33.333,Ir-Os-Th,3,Supercon,Th1Ir0.2Os1.8,MP-mp-1828,Th2Os4,Os-Th,Os66.667Th33.333,F d -3 m,cubic,5.4667698,5.466769799999999,5.466769799999999,data/final/MP/cifs/Ir0.2Os1.8Th1-MP-mp-1828-synth_doped.cif,data/source/MP/raw/cifs/mp-1828.cif,mp-1828,0.0,,2011-05-13 23:04:00,17.607854773817674,10.17188/1193028,"@misc{osti_1193028,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ThOs2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1193028"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1674243'}},0.0,8.41198096,520.0,-61.27169294,-10.211948823333334,"{'tags': ['Osmium technetium (2/1)', 'Osmium thorium (2/1)', 'Thorium osmium (1/2)']}",-61.27169294,-10.211948823333334,-0.2557519033333335,"['xas', 'elasticity', 'bandstructure']",True,"[647835, 105570, 150741, 647836, 647839, 105571]",True,2021-05-12 10:56:14.760000,NM,6,8,mp-1828,,ThOs2,"{'functional': 'PBE', 'labels': ['Th', 'Os_pv'], 'pot_type': 'paw'}","{'Th': 1.0, 'Os': 2.0}",GGA,mp-1828,"['mp-912732', 'mp-929076', 'mp-929475', 'mp-1828', 'mp-1437688', 'mp-1674243', 'mp-1804824', 'mp-1588973']",4.25e-06,"{'Th': 2.0, 'Os': 4.0}",115.52536863934976,[],NM,False,74,0,"[0.0, 0.0, -0.0, 0.0, 0.0, -0.0]",7.357691302016556e-08,4.25e-06,0,8.5e-06,MP,data/source/MP/cleaned/cifs/MP-mp-1828.cif,True,,data/final/MP/graphs/Ir0.2Os1.8Th1-MP-mp-1828-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ir1Si1Th1,1,0.0,2.0,False,Ir2Si2Th2,Ir2Si2Th2,6.5,Other,True,Ir33.333Si33.333Th33.333,Ir-Si-Th,3,Supercon,Th1Ir1Si1,MP-mp-1206779,Th2Si2Ir2,Ir-Si-Th,Ir33.333Si33.333Th33.333,I 41 m d,tetragonal,4.190504000235574,4.190504000235574,7.816845689999999,data/final/MP/cifs/Ir1Si1Th1-MP-mp-1206779.cif,data/source/MP/raw/cifs/mp-1206779.cif,mp-1206779,0.0,,2019-01-12 10:01:15.290000,11.826769734938182,,,{'GGA': {'task_id': 'mp-1759315'}},0.0,8.02382042,520.0,-49.51925985,-8.253209974999999,"{'tags': ['LaPtSi', 'ThIrSi']}",-49.51925985,-8.253209974999999,-1.027342411666666,['bandstructure'],True,[],True,2021-05-12 10:58:39.488000,NM,6,5,mp-1206779,,ThSiIr,"{'functional': 'PBE', 'labels': ['Th', 'Si', 'Ir'], 'pot_type': 'paw'}","{'Th': 1.0, 'Si': 1.0, 'Ir': 1.0}",GGA,mp-1206779,"['mp-1206779', 'mp-1394838', 'mp-1759315', 'mp-1873177', 'mp-1624559']",0.0003809,"{'Th': 2.0, 'Si': 2.0, 'Ir': 2.0}",127.0218644857462,[],NM,False,109,0,"[0, 0, 0, 0, 0, 0]",5.99739267789984e-06,0.0003809,0,0.0007618,MP,data/source/MP/cleaned/cifs/MP-mp-1206779.cif,False,,data/final/MP/graphs/Ir1Si1Th1-MP-mp-1206779.json,0,True,4mm,0,0,0,0,5,0,0,0,0,1,0,1.0,False
Ce1Rh1Sn1,1,0.0,3.0,False,Ce3Rh3Sn3,Ce3Rh3Sn3,0.0,Heavy_fermion,True,Ce33.333Rh33.333Sn33.333,Ce-Rh-Sn,3,Supercon,Ce1Rh1Sn1,MP-mp-12374,Ce3Sn3Rh3,Ce-Rh-Sn,Ce33.333Rh33.333Sn33.333,P -6 2 m,hexagonal,4.081929,7.496012003642988,7.49601216,data/final/MP/cifs/Ce1Rh1Sn1-MP-mp-12374.cif,data/source/MP/raw/cifs/mp-12374.cif,mp-12374,0.0,,2011-06-03 21:25:32,9.071937404692132,10.17188/1188737,"@misc{osti_1188737,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeSnRh (SG:189) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188737"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1705154'}},0.0,8.63395962,520.0,-59.88555259,-6.6539502877777785,"{'tags': ['Cerium rhodium tin (1/1/1)', 'Cerium rhodium stannide', 'Cerium rhodium stannide (1/1/1)']}",-59.88555259,-6.6539502877777785,-0.8849606611111116,"['xas', 'bandstructure']",True,"[657265, 415595, 191825]",True,2021-05-12 10:56:51.169000,FM,9,9,mp-12374,,CeSnRh,"{'functional': 'PBE', 'labels': ['Ce', 'Sn_d', 'Rh_pv'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Sn': 1.0, 'Rh': 1.0}",GGA,mp-12374,"['mp-991734', 'mp-992610', 'mp-12374', 'mp-1084814', 'mp-1423188', 'mp-1705154', 'mp-1830817', 'mp-994114', 'mp-1602537']",0.0451590666666666,"{'Ce': 3.0, 'Sn': 3.0, 'Rh': 3.0}",198.63539415267903,[],FM,True,38,1,"[0.0, 0.1, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0006820395759673,0.0451590666666666,1,0.1354772,MP,data/source/MP/cleaned/cifs/MP-mp-12374.cif,False,,data/final/MP/graphs/Ce1Rh1Sn1-MP-mp-12374.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Bi1.1Rb0.9O3,2,0.04,1.0,True,Bi1.1Rb0.9O3,Bi1Rb1O3,11.0,Oxide,True,Bi22Rb18O60,Bi-Rb-O,3,Supercon,Rb0.9Bi1.1O3,MP-mp-975384,Rb1Bi1O3,Bi-Rb-O,Bi20Rb20O60,P m -3 m,cubic,4.335218,4.335218,4.335218,data/final/MP/cifs/Bi1.1Rb0.9O3-MP-mp-975384-synth_doped.cif,data/source/MP/raw/cifs/mp-975384.cif,mp-975384,0.0,,2015-09-17 06:06:03,6.9792519861019375,10.17188/1314782,"@misc{osti_1314782,
    author = ""Persson, Kristin"",
    title = ""Materials Data on RbBiO3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1314782"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1756800'}},0.0,1.83443478,520.0,-24.89159423,-4.978318846,{'tags': []},-24.89159423,-4.978318846,-1.4476285665,['xas'],False,[],True,2021-05-12 10:57:55.580000,NM,5,8,mp-975384,oxide,RbBiO3,"{'functional': 'PBE', 'labels': ['Rb_sv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Rb': 1.0, 'Bi': 1.0, 'O': 3.0}",GGA,mp-975384,"['mp-975402', 'mp-975384', 'mp-975414', 'mp-1414311', 'mp-1756800', 'mp-1933100', 'mp-975434', 'mp-1585541']",0.0394648,"{'Rb': 1.0, 'Bi': 1.0, 'O': 3.0}",81.47658610821,[],NM,False,221,0,"[0, 0, 0, 0, 0]",0.000484369828009,0.0394648,0,0.0394648,MP,data/source/MP/cleaned/cifs/MP-mp-975384.cif,True,,data/final/MP/graphs/Bi1.1Rb0.9O3-MP-mp-975384-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
As2Ba0.2Fe2Na0.8,3,0.12,2.0,False,As4Ba0.4Fe4Na1.6,As4Ba1Fe4Na1,19.2,Ferrite,True,As40Ba4Fe40Na16,As-Ba-Fe-Na,4,Supercon,Ba0.2Na0.8Fe2As2,MP-mp-1227868,Ba1Na1Fe4As4,As-Ba-Fe-Na,As40Ba10Fe40Na10,C m m m,orthorhombic,5.458732000131759,5.462821,6.96934908,data/final/MP/cifs/As2Ba0.2Fe2Na0.8-MP-mp-1227868-synth_doped.cif,data/source/MP/raw/cifs/mp-1227868.cif,mp-1227868,0.0,,2019-01-13 03:39:01.428000,5.934244973483095,,,{'GGA': {'task_id': 'mp-1731957'}},0.0195872770000011,4.30353274,520.0,-59.62394279,-5.962394279,{'tags': []},-59.62394279,-5.962394279,-0.3865939246551718,[],False,[],True,2021-05-12 11:00:59.151000,FM,10,4,mp-1227868,,BaNa(FeAs)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Na_pv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Na': 1.0, 'Fe': 4.0, 'As': 4.0}",GGA,mp-1227868,"['mp-1227868', 'mp-1396889', 'mp-1731957', 'mp-1827521']",0.9949323,"{'Ba': 1.0, 'Na': 1.0, 'Fe': 4.0, 'As': 4.0}",191.22642477974767,[],FM,True,65,1,"[0.0, 0.0, 0.3, 0.3, 0.3, 0.3, 0.0, 0.0, 0.0, 0.0]",0.0052029017493055,0.9949323,4,0.9949323,MP,data/source/MP/cleaned/cifs/MP-mp-1227868.cif,True,,data/final/MP/graphs/As2Ba0.2Fe2Na0.8-MP-mp-1227868-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
As1F0.2Fe1Gd1O0.8,3,0.0999999999999999,2.0,False,As2F0.4Fe2Gd2O1.6,As2Fe2Gd2O2,48.35,Ferrite,True,As25F5Fe25Gd25O20,As-F-Fe-Gd-O,5,Supercon,Gd1Fe1As1F0.2O0.8,MP-mp-1078679,Gd2Fe2As2O2,As-Fe-Gd-O,As25Fe25Gd25O25,P 4/n m m,tetragonal,3.996524,3.996524,9.110606,data/final/MP/cifs/As1F0.2Fe1Gd1O0.8-MP-mp-1078679-synth_doped.cif,data/source/MP/raw/cifs/mp-1078679.cif,mp-1078679,0.0,,2018-04-12 14:54:44,6.938465251324023,,,{'GGA+U': {'task_id': 'mp-1704492'}},0.2756975050000001,4.06882668,520.0,-71.78498399,-8.97312299875,{'tags': ['Gadolinium iron arsenic oxide (1/1/1/1)']},-71.78498399,-8.97312299875,-1.670570473750001,['bandstructure'],True,"[425013, 422003, 425006, 425015, 425010, 236655, 425016]",True,2021-05-12 10:58:16.596000,FM,8,10,mp-1078679,oxide,GdFeAsO,"{'functional': 'PBE', 'labels': ['Gd', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Gd': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-1078679,"['mp-1078679', 'mp-1079389', 'mp-1079927', 'mp-1080502', 'mp-1080613', 'mp-1095209', 'mp-1438268', 'mp-1704492', 'mp-1864230', 'mp-1589235']",10.7990939,"{'Gd': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",145.5164583479414,[],FM,True,129,2,"[6.9, 6.9, 3.6, 3.6, 0.0, 0.0, 0.0, 0.0]",0.1484243641248952,10.7990939,4,21.5981878,MP,data/source/MP/cleaned/cifs/MP-mp-1078679.cif,True,,data/final/MP/graphs/As1F0.2Fe1Gd1O0.8-MP-mp-1078679-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B2Fe0.1Mg0.9,3,0.0666666666666666,1.0,True,B2Fe0.1Mg0.9,B2Mg1,34.0,Other,True,B66.667Fe3.333Mg30,B-Fe-Mg,3,Supercon,Mg0.9Fe0.1B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B2Fe0.1Mg0.9-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B2Fe0.1Mg0.9-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Cu1Sm0.08Sr0.92O2,2,0.0399999999999999,2.0,False,Cu2Sm0.16Sr1.84O4,Cu2Sr2O4,43.0,Cuprate,True,Cu25Sm2Sr23O50,Cu-Sm-Sr-O,4,Supercon,Sr0.92Sm0.08Cu1O2,MP-mp-5787,Sr2Cu2O4,Cu-Sr-O,Cu25Sr25O50,C m c m,orthorhombic,3.644437999912225,3.974263,8.32909336,data/final/MP/cifs/Cu1Sm0.08Sr0.92O2-MP-mp-5787-synth_doped.cif,data/source/MP/raw/cifs/mp-5787.cif,mp-5787,0.0,,2011-05-13 22:43:08,5.167573150857569,10.17188/1276630,"@misc{osti_1276630,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SrCuO2 (SG:63) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1276630"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703560'}},0.0,3.45760864,520.0,-45.24374469,-5.65546808625,"{'tags': ['Strontium cuprate', 'Strontium copper oxide']}",-45.24374469,-5.65546808625,-2.0778125529166664,"['xas', 'elasticity', 'bandstructure']",True,"[77291, 93653, 202992, 16217, 83051, 77293]",True,2021-05-12 10:56:27.046000,NM,8,8,mp-5787,oxide,SrCuO2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Cu': 1.0, 'O': 2.0}",GGA,mp-5787,"['mp-924142', 'mp-909103', 'mp-5787', 'mp-924940', 'mp-1475985', 'mp-1703560', 'mp-1802910', 'mp-1593696']",4e-07,"{'Sr': 2.0, 'Cu': 2.0, 'O': 4.0}",117.71572347282628,[],NM,False,63,0,"[0, 0, 0, 0, 0, 0, 0, 0]",6.796033498317439e-09,4e-07,0,8e-07,MP,data/source/MP/cleaned/cifs/MP-mp-5787.cif,True,,data/final/MP/graphs/Cu1Sm0.08Sr0.92O2-MP-mp-5787-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
C1Fe0.02Mg1Ni2.98,2,0.008,1.0,True,C1Fe0.02Mg1Ni2.98,C1Mg1Ni3,5.46,Other,True,C20Fe0.4Mg20Ni59.6,C-Fe-Mg-Ni,4,Supercon,Mg1C1Ni2.98Fe0.02,MP-mp-10700,Mg1Ni3C1,C-Mg-Ni,C20Mg20Ni60,P m -3 m,cubic,3.810209,3.810209,3.810209,data/final/MP/cifs/C1Fe0.02Mg1Ni2.98-MP-mp-10700-synth_doped.cif,data/source/MP/raw/cifs/mp-10700.cif,mp-10700,0.0,,2011-05-28 10:04:44,6.376007671789427,10.17188/1187303,"@misc{osti_1187303,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MgNi3C (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187303"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678621'}},0.0,6.64260176,520.0,-28.85099542,-5.770199084,{'tags': ['Magnesium nickel carbide (1/3/1)']},-28.85099542,-5.770199084,-0.1367049259999994,"['xas', 'elasticity', 'bandstructure']",True,[77152],True,2021-05-12 10:56:10.715000,NM,5,8,mp-10700,,MgNi3C,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Ni_pv', 'C'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",GGA,mp-10700,"['mp-927245', 'mp-927653', 'mp-911184', 'mp-10700', 'mp-1438083', 'mp-1678621', 'mp-1791467', 'mp-1591421']",0.0387875,"{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",55.31544309398296,[],NM,False,221,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",0.0007012056277683,0.0387875,0,0.0387875,MP,data/source/MP/cleaned/cifs/MP-mp-10700.cif,True,,data/final/MP/graphs/C1Fe0.02Mg1Ni2.98-MP-mp-10700-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Al1Sc3,1,0.0,2.0,False,Al2Sc6,Al2Sc6,0.0,Other,True,Al25Sc75,Al-Sc,2,Supercon,Al1Sc3,MP-mp-862259,Sc6Al2,Al-Sc,Al25Sc75,P 63/m m c,hexagonal,5.047708,6.314799999941848,6.31479981,data/final/MP/cifs/Al1Sc3-MP-mp-862259.cif,data/source/MP/raw/cifs/mp-862259.cif,mp-862259,0.0,,2014-08-22 16:25:24,3.083513198358304,10.17188/1309385,"@misc{osti_1309385,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sc3Al (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1309385"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1732379'}},0.0,4.6450978,520.0,-47.6369784,-5.9546223,{'tags': []},-47.6369784,-5.9546223,-0.2688765137499995,"['bandstructure', 'elasticity']",True,[],True,2021-05-12 10:56:31.128000,FM,8,8,mp-862259,,Sc3Al,"{'functional': 'PBE', 'labels': ['Sc_sv', 'Al'], 'pot_type': 'paw'}","{'Sc': 3.0, 'Al': 1.0}",GGA,mp-862259,"['mp-862259', 'mp-1049891', 'mp-1049935', 'mp-1399684', 'mp-1732379', 'mp-1882887', 'mp-1620365', 'mp-1049953']",0.9802403,"{'Sc': 6.0, 'Al': 2.0}",174.31872418594492,[],FM,True,194,1,"[0.2, 0.2, 0.2, 0.2, 0.2, 0.2, -0.0, -0.0]",0.011246529075722,0.9802403,6,1.9604806,MP,data/source/MP/cleaned/cifs/MP-mp-862259.cif,False,,data/final/MP/graphs/Al1Sc3-MP-mp-862259.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Al1C1Ti3,1,0.0,1.0,True,Al1C1Ti3,Al1C1Ti3,0.0,Other,True,Al20C20Ti60,Al-C-Ti,3,Supercon,Al1C1Ti3,MP-mp-3271,Ti3Al1C1,Al-C-Ti,Al20C20Ti60,P m -3 m,cubic,4.181121,4.181121,4.181121,data/final/MP/cifs/Al1C1Ti3-MP-mp-3271.cif,data/source/MP/raw/cifs/mp-3271.cif,mp-3271,0.0,,2011-05-12 21:53:50,4.148160779582289,10.17188/1206359,"@misc{osti_1206359,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ti3AlC (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1206359"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668104'}},0.0,6.66090088,520.0,-39.62103231,-7.924206461999999,"{'tags': ['Aluminium titanium carbide (1/3/1)', 'Titanium aluminum carbide (3/1/1)', 'Titanium aluminium carbide (3/1/1)', 'High pressure experimental phase']}",-39.62103231,-7.924206461999999,-0.5924399459999989,"['xas', 'elasticity', 'bandstructure']",True,"[185388, 42925, 163846, 606269, 606273, 606276, 182476, 163843]",True,2021-05-12 10:56:20.740000,NM,5,13,mp-3271,,Ti3AlC,"{'functional': 'PBE', 'labels': ['Ti_pv', 'Al', 'C'], 'pot_type': 'paw'}","{'Ti': 3.0, 'Al': 1.0, 'C': 1.0}",GGA,mp-3271,"['mp-991163', 'mp-993120', 'mp-3271', 'mp-1068504', 'mp-1068519', 'mp-1068535', 'mp-1260169', 'mp-1439996', 'mp-1668104', 'mp-1799690', 'mp-994438', 'mp-1590726', 'mp-1068549']",0.0015806,"{'Ti': 3.0, 'Al': 1.0, 'C': 1.0}",73.09340744088684,[],NM,False,221,0,"[0, 0, 0, 0, 0]",2.162438522623652e-05,0.0015806,0,0.0015806,MP,data/source/MP/cleaned/cifs/MP-mp-3271.cif,False,,data/final/MP/graphs/Al1C1Ti3-MP-mp-3271.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
B4Rh4Yb1,1,0.0,6.0,False,B24Rh24Yb6,B24Rh24Yb6,0.0,Heavy_fermion,True,B44.444Rh44.444Yb11.111,B-Rh-Yb,3,Supercon,Yb1Rh4B4,MP-mp-1197168,Yb6B24Rh24,B-Rh-Yb,B44.444Rh44.444Yb11.111,C c c a,orthorhombic,7.476576,7.523693,11.83961084,data/final/MP/cifs/B4Rh4Yb1-MP-mp-1197168.cif,data/source/MP/raw/cifs/mp-1197168.cif,mp-1197168,0.0,,2019-01-12 02:11:50.915000,9.899853165092772,,,,0.0129957002645539,6.42360922,520.0,-376.69994426,-6.975924893703704,{'tags': ['Ytterbium rhodium boride (1/4/4)']},-376.69994426,-6.975924893703704,-0.5632130222222218,[],False,[615347],True,2021-05-12 11:00:01.375000,NM,54,3,mp-1197168,,Yb(BRh)4,"{'functional': 'PBE', 'labels': ['Yb_2', 'B', 'Rh_pv'], 'pot_type': 'paw'}","{'Yb': 1.0, 'B': 4.0, 'Rh': 4.0}",GGA,mp-1197168,"['mp-1197168', 'mp-1883938', 'mp-1984344']",0.0004857166666666,"{'Yb': 6.0, 'B': 24.0, 'Rh': 24.0}",631.9260048193464,[],NM,False,68,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.611774128259105e-06,0.0004857166666666,0,0.0029143,MP,data/source/MP/cleaned/cifs/MP-mp-1197168.cif,False,,data/final/MP/graphs/B4Rh4Yb1-MP-mp-1197168.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Se2V1,1,0.0,1.0,True,Se2V1,Se2V1,0.0,Other,True,Se66.667V33.333,Se-V,2,Supercon,Se2V1,MP-mp-694,V1Se2,Se-V,Se66.667V33.333,P -3 m 1,trigonal,3.3538059993138085,3.35380583,7.000427,data/final/MP/cifs/Se2V1-MP-mp-694.cif,data/source/MP/raw/cifs/mp-694.cif,mp-694,0.0,,2011-05-12 19:46:31,5.08600147515682,10.17188/1284665,"@misc{osti_1284665,
    author = ""Persson, Kristin"",
    title = ""Materials Data on VSe2 (SG:164) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1284665"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1674310'}},0.0,3.4136409,520.0,-18.15064572,-6.05021524,"{'tags': ['Vanadium selenide (1/2)', 'Vanadium(IV) selenide']}",-18.15064572,-6.05021524,-1.0063055648958337,"['bandstructure', 'elasticity']",True,"[652158, 652160, 86520, 652163]",True,2021-05-12 10:56:27.046000,FM,3,10,mp-694,,VSe2,"{'functional': 'PBE', 'labels': ['V_pv', 'Se'], 'pot_type': 'paw'}","{'V': 1.0, 'Se': 2.0}",GGA,mp-694,"['mp-684962', 'mp-1007180', 'mp-1000725', 'mp-694', 'mp-33271', 'mp-1440305', 'mp-1674310', 'mp-1782989', 'mp-1011917', 'mp-1591575']",0.7305515,"{'V': 1.0, 'Se': 2.0}",68.1916200679006,[],FM,True,164,1,"[0.8, 0.0, 0.0]",0.0107132151908484,0.7305515,1,0.7305515,MP,data/source/MP/cleaned/cifs/MP-mp-694.cif,False,,data/final/MP/graphs/Se2V1-MP-mp-694.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ga1Sc3,1,0.0,2.0,False,Ga2Sc6,Ga2Sc6,0.0,Other,True,Ga25Sc75,Ga-Sc,2,Supercon,Ga1Sc3,MP-mp-1186968,Sc6Ga2,Ga-Sc,Ga25Sc75,P 63/m m c,hexagonal,5.034185,6.235997997597033,6.23599827,data/final/MP/cifs/Ga1Sc3-MP-mp-1186968.cif,data/source/MP/raw/cifs/mp-1186968.cif,mp-1186968,0.0,,2019-01-11 14:43:43.727000,4.007682379499581,,,{'GGA': {'task_id': 'mp-1753129'}},0.0239474471875,4.20700292,520.0,-46.72538744,-5.84067343,{'tags': []},-46.72538744,-5.84067343,-0.3342975956249994,['bandstructure'],True,[],True,2021-05-12 10:58:29.672000,FM,8,5,mp-1186968,,Sc3Ga,"{'functional': 'PBE', 'labels': ['Sc_sv', 'Ga_d'], 'pot_type': 'paw'}","{'Sc': 3.0, 'Ga': 1.0}",GGA,mp-1186968,"['mp-1186968', 'mp-1405478', 'mp-1753129', 'mp-1780998', 'mp-1620594']",1.4795185,"{'Sc': 6.0, 'Ga': 2.0}",169.53983755312836,[],FM,True,194,1,"[0.3, 0.3, 0.3, 0.3, 0.3, 0.3, 0.0, 0.0]",0.0174533433717177,1.4795185,6,2.959037,MP,data/source/MP/cleaned/cifs/MP-mp-1186968.cif,False,,data/final/MP/graphs/Ga1Sc3-MP-mp-1186968.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
La3Tl1,1,0.0,1.0,True,La3Tl1,La3Tl1,8.905,Other,True,La75Tl25,La-Tl,2,Supercon,La3Tl1,MP-mp-371,La3Tl1,La-Tl,La75Tl25,P m -3 m,cubic,5.080077,5.080077,5.080077,data/final/MP/cifs/La3Tl1-MP-mp-371.cif,data/source/MP/raw/cifs/mp-371.cif,mp-371,0.0,,2011-05-13 01:00:39,7.866825897387702,10.17188/1207308,"@misc{osti_1207308,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La3Tl (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207308"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696891'}},0.0,8.20468759,520.0,-18.13168413,-4.5329210325,{'tags': ['Lanthanum thallium (3/1)']},-18.13168413,-4.5329210325,-0.240254917083333,"['xas', 'bandstructure']",True,"[642071, 104732]",True,2021-05-12 10:57:06.958000,NM,4,8,mp-371,,La3Tl,"{'functional': 'PBE', 'labels': ['La', 'Tl_d'], 'pot_type': 'paw'}","{'La': 3.0, 'Tl': 1.0}",GGA,mp-371,"['mp-929022', 'mp-912604', 'mp-929400', 'mp-371', 'mp-1441859', 'mp-1696891', 'mp-1779718', 'mp-1597062']",0.0883015,"{'La': 3.0, 'Tl': 1.0}",131.10247336875844,[],NM,False,221,0,"[0, 0, 0, 0]",0.0006735303898625,0.0883015,0,0.0883015,MP,data/source/MP/cleaned/cifs/MP-mp-371.cif,False,,data/final/MP/graphs/La3Tl1-MP-mp-371.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ge1Sn1Tm1,1,0.0,2.0,False,Ge2Sn2Tm2,Ge2Sn2Tm2,0.0,Other,True,Ge33.333Sn33.333Tm33.333,Ge-Sn-Tm,3,Supercon,Tm1Sn1Ge1,MP-mp-1025129,Tm2Sn2Ge2,Ge-Sn-Tm,Ge33.333Sn33.333Tm33.333,C m c m,orthorhombic,4.060496,4.252965999799082,8.32384764,data/final/MP/cifs/Ge1Sn1Tm1-MP-mp-1025129.cif,data/source/MP/raw/cifs/mp-1025129.cif,mp-1025129,0.0,,2016-10-01 12:39:04,8.609635861720909,10.17188/1355227,"@article{osti_1355227,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TmSnGe (SG:63) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1355227"",
    place = ""United States"",
    year = ""2017"",
    month = ""5""
}
",{'GGA': {'task_id': 'mp-1735153'}},0.0,6.1864131,520.0,-29.72124243,-4.953540405,{'tags': []},-29.72124243,-4.953540405,-0.5840620272222221,['bandstructure'],True,[],True,2021-05-12 10:58:09.072000,NM,6,5,mp-1025129,,TmSnGe,"{'functional': 'PBE', 'labels': ['Tm_3', 'Sn_d', 'Ge_d'], 'pot_type': 'paw'}","{'Tm': 1.0, 'Sn': 1.0, 'Ge': 1.0}",GGA,mp-1025129,"['mp-1025129', 'mp-1385632', 'mp-1735153', 'mp-1868731', 'mp-1624393']",0.00027195,"{'Tm': 2.0, 'Sn': 2.0, 'Ge': 2.0}",138.9759138232673,[],NM,False,63,0,"[0, 0, 0, 0, 0, 0]",3.91362780094158e-06,0.00027195,0,0.0005439,MP,data/source/MP/cleaned/cifs/MP-mp-1025129.cif,False,,data/final/MP/graphs/Ge1Sn1Tm1-MP-mp-1025129.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Al0.02Nb3Sn0.98,2,0.01,2.0,False,Al0.04Nb6Sn1.96,Nb6Sn2,17.9,Other,True,Al0.5Nb75Sn24.5,Al-Nb-Sn,3,Supercon,Nb3Sn0.98Al0.02,MP-mp-1326,Nb6Sn2,Nb-Sn,Nb75Sn25,P m -3 n,cubic,5.334611,5.334611,5.334611,data/final/MP/cifs/Al0.02Nb3Sn0.98-MP-mp-1326-synth_doped.cif,data/source/MP/raw/cifs/mp-1326.cif,mp-1326,0.0,,2011-05-14 09:51:48,8.694218121896231,10.17188/1189484,"@misc{osti_1189484,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Sn (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189484"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668415'}},0.0,6.59372491,520.0,-69.93787048,-8.74223381,{'tags': ['Niobium tin (3/1)']},-69.93787048,-8.74223381,-0.163862066250001,"['xas', 'elasticity', 'bandstructure']",True,"[105230, 645503, 645489, 105231, 645498, 645485, 645474, 645496, 645480, 645488, 645482, 645487, 645500, 645493, 645477, 645484, 645502, 645483, 150878, 645479, 645481, 645486, 645473]",True,2021-05-12 10:56:12.755000,NM,8,9,mp-1326,,Nb3Sn,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Sn_d'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Sn': 1.0}",GGA,mp-1326,"['mp-930046', 'mp-913770', 'mp-930577', 'mp-1326', 'mp-1440651', 'mp-1668415', 'mp-1880085', 'mp-1594093', 'mp-1594507']",0.62023085,"{'Nb': 6.0, 'Sn': 2.0}",151.81275738025872,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0081709977567491,0.62023085,0,1.2404617,MP,data/source/MP/cleaned/cifs/MP-mp-1326.cif,True,,data/final/MP/graphs/Al0.02Nb3Sn0.98-MP-mp-1326-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
As7Re3,1,0.0,2.0,False,As14Re6,As14Re6,0.0,Other,True,As70Re30,As-Re,2,Supercon,As7Re3,MP-mp-2473,Re6As14,As-Re,As70Re30,I m -3 m,cubic,7.676797321701827,7.67679732,7.676797319999999,data/final/MP/cifs/As7Re3-MP-mp-2473.cif,data/source/MP/raw/cifs/mp-2473.cif,mp-2473,0.0,,2011-05-16 02:00:34,10.328046111551144,10.17188/1200214,"@misc{osti_1200214,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Re3As7 (SG:229) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1200214"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1707755'}},0.0,7.53180028,520.0,-141.44349111,-7.0721745555,{'tags': ['Rhenium arsenide (3/7)']},-141.44349111,-7.0721745555,-0.0774335164999996,"['xas', 'bandstructure']",True,"[25787, 611260, 611257, 26270]",True,2021-05-12 10:57:01.079000,NM,20,8,mp-2473,,Re3As7,"{'functional': 'PBE', 'labels': ['Re_pv', 'As'], 'pot_type': 'paw'}","{'Re': 3.0, 'As': 7.0}",GGA,mp-2473,"['mp-913952', 'mp-930690', 'mp-2473', 'mp-1413627', 'mp-1707755', 'mp-1841570', 'mp-977689', 'mp-1607956']",0.00165515,"{'Re': 6.0, 'As': 14.0}",348.27181842980724,[],NM,False,229,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",9.504932138708711e-06,0.00165515,0,0.0033103,MP,data/source/MP/cleaned/cifs/MP-mp-2473.cif,False,,data/final/MP/graphs/As7Re3-MP-mp-2473.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,1,0,1.0,False
Bi2Ca1Cu2I0.95Sr2O8.28,2,0.0203327171903881,1.932416454784304,False,Bi3.865Ca1.932Cu3.865I1.836Sr3.865O16,Bi4Ca2Cu4I2Sr4O16,0.0,Cuprate,True,Bi12.323Ca6.161Cu12.323I5.853Sr12.323O51.016635859519404,Bi-Ca-Cu-I-Sr-O,6,Supercon,Bi2Sr2Ca1Cu2I0.95O8.28,MP-mp-1209124,Sr4Ca2Cu4Bi4I2O16,Bi-Ca-Cu-I-Sr-O,Bi12.5Ca6.25Cu12.5I6.25Sr12.5O50,P m n a,orthorhombic,5.21493,5.481615,19.120353,data/final/MP/cifs/Bi2Ca1Cu2I0.95Sr2O8.28-MP-mp-1209124-synth_doped.cif,data/source/MP/raw/cifs/mp-1209124.cif,mp-1209124,0.0,,2019-01-12 11:54:40.777000,6.168902819730907,,,,0.092595106494147,3.5592228,520.0,-175.92812723,-5.4977539759375,{'tags': ['Sr2CaCu2Bi2IO8']},-175.92812723,-5.4977539759375,-1.9605183883333333,[],False,[],True,2021-05-12 11:00:21.818000,NM,32,3,mp-1209124,oxide,Sr2CaCu2Bi2IO8,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Cu_pv', 'Bi', 'I', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'I': 1.0, 'O': 8.0}",GGA,mp-1209124,"['mp-1209124', 'mp-1361882', 'mp-1929533']",0.31195235,"{'Sr': 4.0, 'Ca': 2.0, 'Cu': 4.0, 'Bi': 4.0, 'I': 2.0, 'O': 16.0}",546.5789712906787,[],NM,False,53,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0011414721984761,0.31195235,0,0.6239047,MP,data/source/MP/cleaned/cifs/MP-mp-1209124.cif,True,,data/final/MP/graphs/Bi2Ca1Cu2I0.95Sr2O8.28-MP-mp-1209124-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Be0.62Si0.38,3,0.0933333333333333,3.0,False,Be1.86Si1.14,Be2Si1,9.0,Other,True,Be62Si38,Be-Si,2,Supercon,Be0.62Si0.38,MP-mp-1009829,Be2Si1,Be-Si,Be66.667Si33.333,F m -3 m,cubic,3.7335238,3.7335238,3.7335238,data/final/MP/cifs/Be0.62Si0.38-MP-mp-1009829-synth_doped.cif,data/source/MP/raw/cifs/mp-1009829.cif,mp-1009829,0.0,,2016-09-24 09:12:00,2.08066021265331,10.17188/1326309,"@misc{osti_1326309,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Be2Si (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1326309"",
    place = ""United States"",
    year = ""2016"",
    month = ""9"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1675051'}},0.2588234266666669,5.84888702,520.0,-12.19866947,-4.066223156666667,{'tags': ['Beryllium silicide (2/1) - antifluorite-type']},-12.19866947,-4.066223156666667,0.258823426666666,"['xas', 'elasticity', 'bandstructure']",True,[183010],True,2021-05-12 10:56:08.727000,NM,3,14,mp-1009829,,Be2Si,"{'functional': 'PBE', 'labels': ['Be_sv', 'Si'], 'pot_type': 'paw'}","{'Be': 2.0, 'Si': 1.0}",GGA,mp-1009829,"['mp-1062148', 'mp-1062138', 'mp-1062158', 'mp-1009829', 'mp-1009855', 'mp-1009879', 'mp-1172425', 'mp-1252371', 'mp-1416569', 'mp-1675051', 'mp-1791848', 'mp-1009890', 'mp-1607760', 'mp-1062164']",0.0003751,"{'Be': 2.0, 'Si': 1.0}",36.799488,[],NM,False,225,0,"[0, 0, 0]",1.0193076599326598e-05,0.0003751,0,0.0003751,MP,data/source/MP/cleaned/cifs/MP-mp-1009829.cif,True,,data/final/MP/graphs/Be0.62Si0.38-MP-mp-1009829-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Co0.01Cu2Gd1Ru0.99Sr2O8,2,0.0014285714285714,2.0,False,Co0.02Cu4Gd2Ru1.98Sr4O16,Cu4Gd2Ru2Sr4O16,25.5,Cuprate,True,Co0.071Cu14.286Gd7.143Ru7.071Sr14.286O57.142857142857146,Co-Cu-Gd-Ru-Sr-O,6,Supercon,Ru0.99Co0.01Sr2Gd1Cu2O8,MP-mp-1194240,Sr4Gd2Cu4Ru2O16,Cu-Gd-Ru-Sr-O,Cu14.286Gd7.143Ru7.143Sr14.286O57.142857142857146,P 4/m b m,tetragonal,5.472451,5.472451,11.740702,data/final/MP/cifs/Co0.01Cu2Gd1Ru0.99Sr2O8-MP-mp-1194240-synth_doped.cif,data/source/MP/raw/cifs/mp-1194240.cif,mp-1194240,0.0,,2019-01-11 23:51:58.932000,6.504561898971391,,,{'GGA': {'task_id': 'mp-1765260'}},0.0213449239285443,3.93502801,520.0,-201.55352223,-7.198340079642857,"{'tags': ['Sr2Cu2GdRuO8 orth', 'Sr2Cu2GdRuO8', 'Ruthenium distrontium gadolinium dicopper octaoxide']}",-201.55352223,-7.198340079642857,-2.268654352380952,['bandstructure'],True,[245741],True,2021-05-12 10:58:35.561000,FiM,28,6,mp-1194240,oxide,Sr2GdCu2RuO8,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Gd', 'Cu_pv', 'Ru_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Gd': 1.0, 'Cu': 2.0, 'Ru': 1.0, 'O': 8.0}",GGA,mp-1194240,"['mp-1194240', 'mp-1396976', 'mp-1659973', 'mp-1765260', 'mp-1841948', 'mp-1638264']",4.23696715,"{'Sr': 4.0, 'Gd': 2.0, 'Cu': 4.0, 'Ru': 2.0, 'O': 16.0}",351.6072554818909,[],FiM,True,127,2,"[-0.0, -0.0, -0.0, -0.0, 6.9, 6.9, 0.0, 0.0, 0.0, 0.0, -1.8, -1.8, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0241005672319991,4.23696715,4,8.4739343,MP,data/source/MP/cleaned/cifs/MP-mp-1194240.cif,True,,data/final/MP/graphs/Co0.01Cu2Gd1Ru0.99Sr2O8-MP-mp-1194240-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Fe1Hf2,1,0.0,8.0,False,Fe8Hf16,Fe8Hf16,0.0,Other,True,Fe33.333Hf66.667,Fe-Hf,2,Supercon,Fe1Hf2,MP-mp-2754,Hf16Fe8,Fe-Hf,Fe33.333Hf66.667,F d -3 m,cubic,8.48005586,8.48005586,8.48005586,data/final/MP/cifs/Fe1Hf2-MP-mp-2754.cif,data/source/MP/raw/cifs/mp-2754.cif,mp-2754,0.0,,2011-05-22 14:47:02,12.718149725025752,10.17188/1201765,"@misc{osti_1201765,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Hf2Fe (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201765"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1711652'}},0.0,5.13529395,520.0,-231.45473661,-9.64394735875,"{'tags': ['Hafnium iron (2/1)', 'Hafnium iron hydride (2/1/5)', 'Iron hafnium (1/2)', 'Hafnium iron hydride (2/1/3)']}",-231.45473661,-9.64394735875,-0.1824853087500007,"['xas', 'bandstructure']",True,"[103497, 632172, 632239, 656076, 632245, 106646]",True,2021-05-12 10:57:03.017000,FM,24,9,mp-2754,,Hf2Fe,"{'functional': 'PBE', 'labels': ['Hf_pv', 'Fe_pv'], 'pot_type': 'paw'}","{'Hf': 2.0, 'Fe': 1.0}",GGA,mp-2754,"['mp-941308', 'mp-934867', 'mp-941629', 'mp-2754', 'mp-1191725', 'mp-1416073', 'mp-1711652', 'mp-1815467', 'mp-1607758']",0.25656665,"{'Hf': 16.0, 'Fe': 8.0}",431.2023714080042,[],FM,True,166,1,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.5, 0.4, 0.5, 0.5, 0.5, 0.5, 0.4, 0.5]",0.0047600229871136,0.25656665,8,2.0525332,MP,data/source/MP/cleaned/cifs/MP-mp-2754.cif,False,,data/final/MP/graphs/Fe1Hf2-MP-mp-2754.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
As2Ba0.5Fe1.92K0.5Zn0.08,2,0.032,2.0,False,As4Ba1Fe3.84K1Zn0.16,As4Ba1Fe4K1,34.3,Ferrite,True,As40Ba10Fe38.4K10Zn1.6,As-Ba-Fe-K-Zn,5,Supercon,Ba0.5K0.5Fe1.92Zn0.08As2,MP-mp-1223517,K1Ba1Fe4As4,As-Ba-Fe-K,As40Ba10Fe40K10,C m m m,orthorhombic,5.479027,5.480024002658328,7.13170472,data/final/MP/cifs/As2Ba0.5Fe1.92K0.5Zn0.08-MP-mp-1223517-synth_doped.cif,data/source/MP/raw/cifs/mp-1223517.cif,mp-1223517,0.0,,2019-01-12 23:54:03.876000,5.87534599912672,,,{'GGA': {'task_id': 'mp-1743010'}},0.0132513644999994,4.21185628,520.0,-59.66633886,-5.966633886,{'tags': []},-59.66633886,-5.966633886,-0.4120461663000007,[],False,[],True,2021-05-12 11:00:52.054000,FM,10,4,mp-1223517,,KBa(FeAs)4,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",GGA,mp-1223517,"['mp-1223517', 'mp-1396881', 'mp-1743010', 'mp-1827585']",0.9947188,"{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",197.6961518155852,[],FM,True,65,1,"[0.0, 0.0, 0.3, 0.3, 0.3, 0.3, 0.0, 0.0, 0.0, 0.0]",0.0050315536790412,0.9947188,4,0.9947188,MP,data/source/MP/cleaned/cifs/MP-mp-1223517.cif,True,,data/final/MP/graphs/As2Ba0.5Fe1.92K0.5Zn0.08-MP-mp-1223517-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Al2.98Ni2U1,2,0.0033444816053511,1.0,True,Al2.98Ni2U1,Al3Ni2U1,1.155,Heavy_fermion,True,Al49.833Ni33.445U16.722,Al-Ni-U,3,Supercon,U1Ni2Al2.98,MP-mp-2903,U1Al3Ni2,Al-Ni-U,Al50Ni33.333U16.667,P 6/m m m,hexagonal,4.031899,5.147229997095757,5.14723005,data/final/MP/cifs/Al2.98Ni2U1-MP-mp-2903-synth_doped.cif,data/source/MP/raw/cifs/mp-2903.cif,mp-2903,0.0,,2011-05-13 05:51:52,7.832617582421956,10.17188/1203074,"@misc{osti_1203074,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UAl3Ni2 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1203074"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678525'}},0.1051396383333314,9.05221071,520.0,-36.52297192,-6.087161986666668,"{'tags': ['Uranium nickel aluminium (1/2/3)', 'Aluminum nickel uranium (3/2/1)', 'Aluminium nickel uranium (3/2/1)']}",-36.52297192,-6.087161986666668,-0.4057601766666678,"['xas', 'elasticity', 'bandstructure']",True,"[659220, 602903, 104408, 659142, 370029]",True,2021-05-12 10:56:18.721000,NM,6,9,mp-2903,,UAl3Ni2,"{'functional': 'PBE', 'labels': ['U', 'Al', 'Ni_pv'], 'pot_type': 'paw'}","{'U': 1.0, 'Al': 3.0, 'Ni': 2.0}",GGA,mp-2903,"['mp-991128', 'mp-2903', 'mp-993112', 'mp-1256856', 'mp-1437596', 'mp-1678525', 'mp-1796633', 'mp-994437', 'mp-1589145']",0.0881673,"{'U': 1.0, 'Al': 3.0, 'Ni': 2.0}",92.50973387636644,[],NM,False,191,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0009530597084824,0.0881673,0,0.0881673,MP,data/source/MP/cleaned/cifs/MP-mp-2903.cif,True,,data/final/MP/graphs/Al2.98Ni2U1-MP-mp-2903-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
B4Gd1Rh4,1,0.0,2.0,False,B8Gd2Rh8,B8Gd2Rh8,0.0,Other,True,B44.444Gd11.111Rh44.444,B-Gd-Rh,3,Supercon,Gd1Rh4B4,MP-mp-1106078,Gd2B8Rh8,B-Gd-Rh,B44.444Gd11.111Rh44.444,P 42/n m c,tetragonal,5.350484,5.350484,7.482916,data/final/MP/cifs/B4Gd1Rh4-MP-mp-1106078.cif,data/source/MP/raw/cifs/mp-1106078.cif,mp-1106078,0.0,,2018-07-19 07:42:30,9.489772809640012,,,{'GGA': {'task_id': 'mp-1676935'}},0.0023992313888907,6.80549926,520.0,-150.70266873,-8.372370485,{'tags': ['Gadolinium rhodium boride (1/4/4)']},-150.70266873,-8.372370485,-0.5667126179629618,['bandstructure'],True,"[601532, 614378]",True,2021-05-12 10:58:22.271000,FM,18,6,mp-1106078,,Gd(BRh)4,"{'functional': 'PBE', 'labels': ['Gd', 'B', 'Rh_pv'], 'pot_type': 'paw'}","{'Gd': 1.0, 'B': 4.0, 'Rh': 4.0}",GGA,mp-1106078,"['mp-1106078', 'mp-1381024', 'mp-1676935', 'mp-1770947', 'mp-1828478', 'mp-1604793']",7.22928935,"{'Gd': 2.0, 'B': 8.0, 'Rh': 8.0}",214.2185174882988,[],FM,True,137,1,"[7.0, 7.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0674945325433398,7.22928935,2,14.4585787,MP,data/source/MP/cleaned/cifs/MP-mp-1106078.cif,False,,data/final/MP/graphs/B4Gd1Rh4-MP-mp-1106078.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Al1Pr1Rh1,1,0.0,4.0,False,Al4Pr4Rh4,Al4Pr4Rh4,0.0,Heavy_fermion,True,Al33.333Pr33.333Rh33.333,Al-Pr-Rh,3,Supercon,Pr1Rh1Al1,MP-mp-1209554,Pr4Al4Rh4,Al-Pr-Rh,Al33.333Pr33.333Rh33.333,P n m a,orthorhombic,4.308288,7.125393,8.133136,data/final/MP/cifs/Al1Pr1Rh1-MP-mp-1209554.cif,data/source/MP/raw/cifs/mp-1209554.cif,mp-1209554,0.0,,2019-01-12 12:15:38.215000,7.204065387298052,,,{'GGA': {'task_id': 'mp-1738501'}},0.0,5.58107059,520.0,-73.11624305,-6.0930202541666665,"{'tags': ['TiNiSi', 'PrRhAl', 'AlB2 family']}",-73.11624305,-6.0930202541666665,-0.7960926391666661,[],False,[],True,2021-05-12 11:00:24.227000,NM,12,4,mp-1209554,,PrAlRh,"{'functional': 'PBE', 'labels': ['Pr_3', 'Al', 'Rh_pv'], 'pot_type': 'paw'}","{'Pr': 1.0, 'Al': 1.0, 'Rh': 1.0}",GGA,mp-1209554,"['mp-1209554', 'mp-1405937', 'mp-1738501', 'mp-1775189']",3.15e-05,"{'Pr': 4.0, 'Al': 4.0, 'Rh': 4.0}",249.67300282471888,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.046600896952298e-07,3.15e-05,0,0.000126,MP,data/source/MP/cleaned/cifs/MP-mp-1209554.cif,False,,data/final/MP/graphs/Al1Pr1Rh1-MP-mp-1209554.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ca1Pt2,1,0.0,2.0,False,Ca2Pt4,Ca2Pt4,0.0,Other,True,Ca33.333Pt66.667,Ca-Pt,2,Supercon,Ca1Pt2,MP-mp-842,Ca2Pt4,Ca-Pt,Ca33.333Pt66.667,F d -3 m,cubic,5.46184976,5.46184976,5.46184976,data/final/MP/cifs/Ca1Pt2-MP-mp-842.cif,data/source/MP/raw/cifs/mp-842.cif,mp-842,0.0,,2011-05-13 08:18:29,12.401998775107955,10.17188/1308093,"@misc{osti_1308093,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CaPt2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1308093"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699688'}},0.0,5.73554701,520.0,-33.88724167,-5.647873611666667,{'tags': ['Calcium platinum (1/2)']},-33.88724167,-5.647873611666667,-0.9320685116666668,"['bandstructure', 'elasticity']",True,"[109140, 108147]",True,2021-05-12 10:56:31.128000,NM,6,8,mp-842,,CaPt2,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Pt'], 'pot_type': 'paw'}","{'Ca': 1.0, 'Pt': 2.0}",GGA,mp-842,"['mp-842', 'mp-977845', 'mp-914363', 'mp-1420296', 'mp-1699688', 'mp-1805286', 'mp-978129', 'mp-1593736']",0.01543935,"{'Ca': 2.0, 'Pt': 4.0}",115.21373356080896,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",0.0002680123197613,0.01543935,0,0.0308787,MP,data/source/MP/cleaned/cifs/MP-mp-842.cif,False,,data/final/MP/graphs/Ca1Pt2-MP-mp-842.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Al2La0.992Tb0.008,2,0.0053333333333333,2.0,False,Al4La1.984Tb0.016,Al4La2,1.61,Other,True,Al66.667La33.067Tb0.267,Al-La-Tb,3,Supercon,La0.992Tb0.008Al2,MP-mp-2694,La2Al4,Al-La,Al66.667La33.333,F d -3 m,cubic,5.75810346,5.75810346,5.75810346,data/final/MP/cifs/Al2La0.992Tb0.008-MP-mp-2694-synth_doped.cif,data/source/MP/raw/cifs/mp-2694.cif,mp-2694,0.0,,2011-05-12 21:07:48,4.744791242841679,10.17188/1201263,"@misc{osti_1201263,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaAl2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201263"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686658'}},0.0,8.10972418,520.0,-27.8605497,-4.64342495,{'tags': ['Aluminium lanthanum (2/1)']},-27.8605497,-4.64342495,-0.5010386950000001,"['xas', 'elasticity', 'bandstructure']",True,"[608275, 608277, 608265, 608290, 608288, 57933, 608270, 608269, 603920, 608272, 608286, 608273, 608289, 604450, 608266]",True,2021-05-12 10:56:18.721000,NM,6,10,mp-2694,,LaAl2,"{'functional': 'PBE', 'labels': ['La', 'Al'], 'pot_type': 'paw'}","{'La': 1.0, 'Al': 2.0}",GGA,mp-2694,"['mp-940230', 'mp-925817', 'mp-940644', 'mp-2694', 'mp-1258643', 'mp-1440554', 'mp-1686658', 'mp-1787219', 'mp-1596037', 'mp-1594760']",0.0008869,"{'La': 2.0, 'Al': 4.0}",134.99677475891534,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",1.3139573172527638e-05,0.0008869,0,0.0017738,MP,data/source/MP/cleaned/cifs/MP-mp-2694.cif,True,,data/final/MP/graphs/Al2La0.992Tb0.008-MP-mp-2694-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ba8Cu4Si42,1,0.0,1.0,True,Ba8Cu4Si42,Ba8Cu4Si42,2.9,Other,True,Ba14.815Cu7.407Si77.778,Ba-Cu-Si,3,Supercon,Ba8Si42Cu4,MP-mp-1228302,Ba8Cu4Si42,Ba-Cu-Si,Ba14.815Cu7.407Si77.778,A m a 2,orthorhombic,10.371792,10.40661007,10.40661007,data/final/MP/cifs/Ba8Cu4Si42-MP-mp-1228302.cif,data/source/MP/raw/cifs/mp-1228302.cif,mp-1228302,0.0,,2019-01-13 04:01:52.390000,3.743756776939753,,,,0.010249476234569,6.44773715,520.0,-270.3525082,-5.006527929629629,{'tags': []},-270.3525082,-5.006527929629629,-0.1436801118518518,[],False,[],True,2021-05-12 11:00:59.151000,NM,54,2,mp-1228302,,Ba4Cu2Si21,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Cu_pv', 'Si'], 'pot_type': 'paw'}","{'Ba': 4.0, 'Cu': 2.0, 'Si': 21.0}",GGA,mp-1228302,"['mp-1228302', 'mp-1328003']",0.0017959,"{'Ba': 8.0, 'Cu': 4.0, 'Si': 42.0}",1123.2391519952394,[],NM,False,40,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.197716170790335e-06,0.0017959,0,0.0035918,MP,data/source/MP/cleaned/cifs/MP-mp-1228302.cif,False,,data/final/MP/graphs/Ba8Cu4Si42-MP-mp-1228302.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Nb3Si0.25Sn0.75,3,0.125,2.0,False,Nb6Si0.5Sn1.5,Nb6Sn2,16.4,Other,True,Nb75Si6.25Sn18.75,Nb-Si-Sn,3,Supercon,Nb3Si0.25Sn0.75,MP-mp-1326,Nb6Sn2,Nb-Sn,Nb75Sn25,P m -3 n,cubic,5.334611,5.334611,5.334611,data/final/MP/cifs/Nb3Si0.25Sn0.75-MP-mp-1326-synth_doped.cif,data/source/MP/raw/cifs/mp-1326.cif,mp-1326,0.0,,2011-05-14 09:51:48,8.694218121896231,10.17188/1189484,"@misc{osti_1189484,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Sn (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189484"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668415'}},0.0,6.59372491,520.0,-69.93787048,-8.74223381,{'tags': ['Niobium tin (3/1)']},-69.93787048,-8.74223381,-0.163862066250001,"['xas', 'elasticity', 'bandstructure']",True,"[105230, 645503, 645489, 105231, 645498, 645485, 645474, 645496, 645480, 645488, 645482, 645487, 645500, 645493, 645477, 645484, 645502, 645483, 150878, 645479, 645481, 645486, 645473]",True,2021-05-12 10:56:12.755000,NM,8,9,mp-1326,,Nb3Sn,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Sn_d'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Sn': 1.0}",GGA,mp-1326,"['mp-930046', 'mp-913770', 'mp-930577', 'mp-1326', 'mp-1440651', 'mp-1668415', 'mp-1880085', 'mp-1594093', 'mp-1594507']",0.62023085,"{'Nb': 6.0, 'Sn': 2.0}",151.81275738025872,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0081709977567491,0.62023085,0,1.2404617,MP,data/source/MP/cleaned/cifs/MP-mp-1326.cif,True,,data/final/MP/graphs/Nb3Si0.25Sn0.75-MP-mp-1326-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
As1Ce1F0.02Fe1O0.98,2,0.01,2.0,False,As2Ce2F0.04Fe2O1.96,As2Ce2Fe2O2,0.0,Ferrite,True,As25Ce25F0.5Fe25O24.5,As-Ce-F-Fe-O,5,Supercon,Ce1Fe1As1F0.02O0.98,MP-mp-605060,Ce2Fe2As2O2,As-Ce-Fe-O,As25Ce25Fe25O25,P 4 m m,tetragonal,3.992256,3.992256,9.041971,data/final/MP/cifs/As1Ce1F0.02Fe1O0.98-MP-mp-605060-synth_doped.cif,data/source/MP/raw/cifs/mp-605060.cif,mp-605060,0.0,,2014-02-14 20:12:08,6.611233843492404,10.17188/1277425,"@misc{osti_1277425,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeFeAsO (SG:99) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277425"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-1751604'}},0.2072581873958352,6.30288445,520.0,-55.74271596,-6.967839495,{'tags': []},-55.74271596,-6.967839495,-1.7010452412499992,['bandstructure'],True,[],True,2021-05-12 10:58:51.532000,FiM,8,10,mp-605060,oxide,CeFeAsO,"{'functional': 'PBE', 'labels': ['Ce', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-605060,"['mp-605060', 'mp-917114', 'mp-918266', 'mp-919274', 'mp-1443189', 'mp-1751604', 'mp-1770633', 'mp-1779614', 'mp-1873964', 'mp-1622328']",2.99945325,"{'Ce': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",144.11191005541338,[],FiM,True,99,3,"[-0.5, -0.5, 3.5, 3.5, 0.0, 0.0, 0.0, 0.0]",0.0416267225775671,2.99945325,4,5.9989065,MP,data/source/MP/cleaned/cifs/MP-mp-605060.cif,True,,data/final/MP/graphs/As1Ce1F0.02Fe1O0.98-MP-mp-605060-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
Ni3P1,1,0.0,4.0,False,Ni12P4,Ni12P4,0.0,Ferrite,True,Ni75P25,Ni-P,2,Supercon,Ni3P1,MP-mp-2296,Ni12P4,Ni-P,Ni75P25,I -4,tetragonal,4.3756340021380336,6.684652040398586,6.6846520400000005,data/final/MP/cifs/Ni3P1-MP-mp-2296.cif,data/source/MP/raw/cifs/mp-2296.cif,mp-2296,0.0,,2011-05-19 07:08:19,7.877713774420393,10.17188/1199115,"@misc{osti_1199115,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ni3P (SG:82) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199115"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1676927'}},0.0,9.50040597,520.0,-98.06531306,-6.12908206625,{'tags': ['Nickel phosphide (3/1)']},-98.06531306,-6.12908206625,-0.4406539295833322,"['xas', 'bandstructure']",True,"[98373, 646109, 54177, 43396, 646118, 27161]",True,2021-05-12 10:56:59.077000,NM,16,9,mp-2296,,Ni3P,"{'functional': 'PBE', 'labels': ['Ni_pv', 'P'], 'pot_type': 'paw'}","{'Ni': 3.0, 'P': 1.0}",GGA,mp-2296,"['mp-926129', 'mp-910216', 'mp-925714', 'mp-2296', 'mp-1106299', 'mp-1116089', 'mp-1442573', 'mp-1676927', 'mp-1598502']",0.0182981,"{'Ni': 12.0, 'P': 4.0}",174.57917494373987,[],NM,False,5,0,"[0.0, 0.0, 0.0, 0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0004192504634277,0.0182981,0,0.0731924,MP,data/source/MP/cleaned/cifs/MP-mp-2296.cif,False,,data/final/MP/graphs/Ni3P1-MP-mp-2296.json,0,True,-4,0,0,0,0,2,0,0,0,0,1,0,1.0,False
Si0.28Ta0.72,3,0.1066666666666666,6.0,False,Si1.68Ta4.32,Si2Ta4,0.0,Other,True,Si28Ta72,Si-Ta,2,Supercon,Si0.28Ta0.72,MP-mp-2783,Ta4Si2,Si-Ta,Si33.333Ta66.667,I 4/m c m,tetragonal,5.064350521166502,5.06435052,5.064350519999999,data/final/MP/cifs/Si0.28Ta0.72-MP-mp-2783-synth_doped.cif,data/source/MP/raw/cifs/mp-2783.cif,mp-2783,0.0,,2011-05-13 04:15:18,13.2745948473238,10.17188/1202002,"@misc{osti_1202002,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ta2Si (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1202002"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697009'}},0.0016131517708348,7.45958288,520.0,-61.62053009,-10.270088348333331,{'tags': ['Tantalum silicide (2/1)']},-61.62053009,-10.270088348333331,-0.5327985883333343,"['xas', 'elasticity', 'bandstructure']",True,"[652302, 76160, 42526]",True,2021-05-12 10:56:18.721000,NM,6,16,mp-2783,,Ta2Si,"{'functional': 'PBE', 'labels': ['Ta_pv', 'Si'], 'pot_type': 'paw'}","{'Ta': 2.0, 'Si': 1.0}",GGA,mp-2783,"['mp-924868', 'mp-909837', 'mp-925426', 'mp-2783', 'mp-1072341', 'mp-1072298', 'mp-1072369', 'mp-1138632', 'mp-1146351', 'mp-1258626', 'mp-1263104', 'mp-1441064', 'mp-1697009', 'mp-1795946', 'mp-1595051', 'mp-1072362']",6.855e-05,"{'Ta': 4.0, 'Si': 2.0}",97.56668657988396,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0]",1.4051927436087278e-06,6.855e-05,0,0.0001371,MP,data/source/MP/cleaned/cifs/MP-mp-2783.cif,True,,data/final/MP/graphs/Si0.28Ta0.72-MP-mp-2783-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As1Fe0.9Rh0.1Sm1O1,2,0.0499999999999999,2.0,False,As2Fe1.8Rh0.2Sm2O2,As2Fe2Sm2O2,9.6,Ferrite,True,As25Fe22.5Rh2.5Sm25O25,As-Fe-Rh-Sm-O,5,Supercon,Sm1Fe0.9Rh0.1As1O1,MP-mp-20349,Sm2Fe2As2O2,As-Fe-Sm-O,As25Fe25Sm25O25,P 4/n m m,tetragonal,4.026492,4.026492,9.046755,data/final/MP/cifs/As1Fe0.9Rh0.1Sm1O1-MP-mp-20349-synth_doped.cif,data/source/MP/raw/cifs/mp-20349.cif,mp-20349,0.0,,2014-02-19 11:24:42,6.727802583283198,,,{'GGA+U': {'task_id': 'mp-1695938'}},0.3015723809374986,3.77685593,520.0,-52.73407138,-6.5917589225,{'tags': ['Samarium iron arsenic oxide (1/1/1/1)']},-52.73407138,-6.5917589225,-1.6285904237499995,"['xas', 'elasticity', 'bandstructure']",True,"[236652, 236653, 422002, 163457, 163458]",True,2021-05-12 10:56:16.728000,FM,8,10,mp-20349,oxide,SmFeAsO,"{'functional': 'PBE', 'labels': ['Sm_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Sm': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-20349,"['mp-24944', 'mp-1078897', 'mp-1079866', 'mp-1173321', 'mp-20349', 'mp-1425472', 'mp-1695938', 'mp-1772503', 'mp-1789694', 'mp-1588381']",3.75729895,"{'Sm': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",146.67176231613362,[],FM,True,129,1,"[0.0, 0.0, 3.5, 3.5, -0.0, -0.0, -0.0, -0.0]",0.0512341147425717,3.75729895,2,7.5145979,MP,data/source/MP/cleaned/cifs/MP-mp-20349.cif,True,,data/final/MP/graphs/As1Fe0.9Rh0.1Sm1O1-MP-mp-20349-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ga1Zr2,1,0.0,2.0,False,Ga2Zr4,Ga2Zr4,0.38,Other,True,Ga33.333Zr66.667,Ga-Zr,2,Supercon,Ga1Zr2,MP-mp-569833,Zr4Ga2,Ga-Zr,Ga33.333Zr66.667,I 4/m c m,tetragonal,5.478421909197329,5.47842191,5.478421909999999,data/final/MP/cifs/Ga1Zr2-MP-mp-569833.cif,data/source/MP/raw/cifs/mp-569833.cif,mp-569833,0.0,,2014-02-16 06:57:07,6.788351328429248,10.17188/1275288,"@misc{osti_1275288,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Zr2Ga (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1275288"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695888'}},0.0,3.86627634,520.0,-43.03606117,-7.172676861666667,"{'tags': ['Zirconium gallide (2/1)', 'Gallium zirconium (1/2)']}",-43.03606117,-7.172676861666667,-0.464844434166667,"['xas', 'elasticity', 'bandstructure']",True,"[102806, 635700, 635691]",True,2021-05-12 10:56:22.739000,NM,6,10,mp-569833,,Zr2Ga,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Ga_d'], 'pot_type': 'paw'}","{'Zr': 2.0, 'Ga': 1.0}",GGA,mp-569833,"['mp-941544', 'mp-569833', 'mp-934769', 'mp-941243', 'mp-1077134', 'mp-1077416', 'mp-1431289', 'mp-1695888', 'mp-1787425', 'mp-1590595']",0.0002794,"{'Zr': 4.0, 'Ga': 2.0}",123.37010172408988,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0]",4.529460478598972e-06,0.0002794,0,0.0005588,MP,data/source/MP/cleaned/cifs/MP-mp-569833.cif,False,,data/final/MP/graphs/Ga1Zr2-MP-mp-569833.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ag0.625Al0.375,3,0.0833333333333333,6.0,False,Ag3.75Al2.25,Ag4Al2,0.106,Other,True,Ag62.5Al37.5,Ag-Al,2,Supercon,Ag0.625Al0.375,MP-mp-985805,Al2Ag4,Ag-Al,Ag66.667Al33.333,C m c m,orthorhombic,4.569113,5.097394001168852,5.10979643,data/final/MP/cifs/Ag0.625Al0.375-MP-mp-985805-synth_doped.cif,data/source/MP/raw/cifs/mp-985805.cif,mp-985805,0.0,,2017-11-17 15:09:37,7.814765925012479,10.17188/1316751,"@misc{osti_1316751,
    author = ""Persson, Kristin"",
    title = ""Materials Data on AlAg2 (SG:63) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1316751"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1760271'}},0.0,5.04571075,520.0,-19.27423641,-3.212372735,{'tags': []},-19.27423641,-3.212372735,-0.0754767894444441,"['xas', 'elasticity', 'bandstructure']",True,[],True,2021-05-12 10:56:37.246000,NM,6,9,mp-985805,,AlAg2,"{'functional': 'PBE', 'labels': ['Al', 'Ag'], 'pot_type': 'paw'}","{'Al': 1.0, 'Ag': 2.0}",GGA,mp-985805,"['mp-1040769', 'mp-1040772', 'mp-985805', 'mp-1256890', 'mp-1398492', 'mp-1760271', 'mp-1928111', 'mp-1627544', 'mp-1040771']",1.33e-05,"{'Al': 2.0, 'Ag': 4.0}",103.14899334858234,[],NM,False,63,0,"[0, 0, 0, 0, 0, 0]",2.578793950039609e-07,1.33e-05,0,2.66e-05,MP,data/source/MP/cleaned/cifs/MP-mp-985805.cif,True,,data/final/MP/graphs/Ag0.625Al0.375-MP-mp-985805-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Bi1Ti3,1,0.0,2.0,False,Bi2Ti6,Bi2Ti6,0.0,Other,True,Bi25Ti75,Bi-Ti,2,Supercon,Bi1Ti3,MP-mp-866201,Ti6Bi2,Bi-Ti,Bi25Ti75,P 63/m m c,hexagonal,4.826148,6.0029459951414,6.00294536,data/final/MP/cifs/Bi1Ti3-MP-mp-866201.cif,data/source/MP/raw/cifs/mp-866201.cif,mp-866201,0.0,,2014-09-01 18:37:57,7.774606397198863,10.17188/1311464,"@misc{osti_1311464,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ti3Bi (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1311464"",
    place = ""United States"",
    year = ""2016"",
    month = ""8"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1751632'}},0.0098668541666686,7.42728874,520.0,-55.86361702,-6.9829521275,{'tags': []},-55.86361702,-6.9829521275,-0.0888245374999998,"['bandstructure', 'elasticity']",True,[],True,2021-05-12 10:56:33.121000,NM,8,11,mp-866201,,Ti3Bi,"{'functional': 'PBE', 'labels': ['Ti_pv', 'Bi'], 'pot_type': 'paw'}","{'Ti': 3.0, 'Bi': 1.0}",GGA,mp-866201,"['mp-866201', 'mp-1003340', 'mp-1004937', 'mp-1054455', 'mp-1054389', 'mp-1405229', 'mp-1751632', 'mp-1880290', 'mp-1010595', 'mp-1621581', 'mp-1054468']",0.11534195,"{'Ti': 6.0, 'Bi': 2.0}",150.61217480217746,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0015316417832953,0.11534195,0,0.2306839,MP,data/source/MP/cleaned/cifs/MP-mp-866201.cif,False,,data/final/MP/graphs/Bi1Ti3-MP-mp-866201.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Al0.05B0.95Li2Pt3,2,0.0166666666666666,4.0,False,Al0.2B3.8Li8Pt12,B4Li8Pt12,2.12,Other,True,Al0.833B15.833Li33.333Pt50,Al-B-Li-Pt,4,Supercon,Li2Pt3B0.95Al0.05,MP-mp-20234,Li8B4Pt12,B-Li-Pt,B16.667Li33.333Pt50,P 43 3 2,cubic,6.84464,6.84464,6.84464,data/final/MP/cifs/Al0.05B0.95Li2Pt3-MP-mp-20234-synth_doped.cif,data/source/MP/raw/cifs/mp-20234.cif,mp-20234,0.0,,2014-02-22 21:58:26,12.634205351017416,10.17188/1195368,"@misc{osti_1195368,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Li2BPt3 (SG:212) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195368"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671476'}},0.0,4.76758864,520.0,-128.53533033,-5.35563876375,{'tags': ['Lithium platinum boride (2/3/1)']},-128.53533033,-5.35563876375,-0.5706453247222214,"['xas', 'bandstructure']",True,"[156466, 246448, 84932]",True,2021-05-12 10:56:57.051000,NM,24,8,mp-20234,,Li2BPt3,"{'functional': 'PBE', 'labels': ['Li_sv', 'B', 'Pt'], 'pot_type': 'paw'}","{'Li': 2.0, 'B': 1.0, 'Pt': 3.0}",GGA,mp-20234,"['mp-920353', 'mp-906711', 'mp-921381', 'mp-20234', 'mp-1115994', 'mp-1430060', 'mp-1671476', 'mp-1809887']",0.000293725,"{'Li': 8.0, 'B': 4.0, 'Pt': 12.0}",320.6652014392893,[],NM,False,212,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.6639460556571824e-06,0.000293725,0,0.0011749,MP,data/source/MP/cleaned/cifs/MP-mp-20234.cif,True,,data/final/MP/graphs/Al0.05B0.95Li2Pt3-MP-mp-20234-synth_doped.json,0,True,432,4,0,0,0,0,0,0,1,0,0,0,1.0,False
Co0.2Ir3.8Lu5Si10,3,0.0210526315789473,2.0,False,Co0.4Ir7.6Lu10Si20,Ir8Lu10Si20,5.52,Other,True,Co1.053Ir20Lu26.316Si52.632,Co-Ir-Lu-Si,4,Supercon,Lu5Ir3.8Co0.2Si10,MP-mp-542170,Lu10Si20Ir8,Ir-Lu-Si,Ir21.053Lu26.316Si52.632,P 4/m b m,tetragonal,4.209968,12.553443,12.553443,data/final/MP/cifs/Co0.2Ir3.8Lu5Si10-MP-mp-542170-synth_doped.cif,data/source/MP/raw/cifs/mp-542170.cif,mp-542170,0.0,,2014-02-26 06:26:45,9.633976714725442,10.17188/1266443,"@misc{osti_1266443,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Lu5(Si5Ir2)2 (SG:127) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1266443"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1730128'}},0.0,7.10692048,520.0,-258.01102272,-6.789763755789474,"{'tags': ['Lutetium iridium silicide (5/4/10) - whiskers', 'Lutetium iridium silicide (5/4/10)']}",-258.01102272,-6.789763755789474,-0.8465208884210526,"['xas', 'bandstructure']",True,"[640788, 168655, 56695, 640790]",True,2021-05-12 10:57:15.388000,NM,38,10,mp-542170,,Lu5(Si5Ir2)2,"{'functional': 'PBE', 'labels': ['Lu_3', 'Si', 'Ir'], 'pot_type': 'paw'}","{'Lu': 5.0, 'Si': 10.0, 'Ir': 4.0}",GGA,mp-542170,"['mp-940622', 'mp-940197', 'mp-925770', 'mp-542170', 'mp-1144050', 'mp-1197492', 'mp-1203653', 'mp-1236864', 'mp-1389871', 'mp-1730128']",0.00209085,"{'Lu': 10.0, 'Si': 20.0, 'Ir': 8.0}",663.4443573135914,[],NM,False,127,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.303015398205322e-06,0.00209085,0,0.0041817,MP,data/source/MP/cleaned/cifs/MP-mp-542170.cif,True,,data/final/MP/graphs/Co0.2Ir3.8Lu5Si10-MP-mp-542170-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
As0.1Fe1La1P0.9O1,2,0.0499999999999999,2.0,False,As0.2Fe2La2P1.8O2,Fe2La2P2O2,5.96,Ferrite,True,As2.5Fe25La25P22.5O25,As-Fe-La-P-O,5,Supercon,La1Fe1As0.1P0.9O1,MP-mp-510668,La2Fe2P2O2,Fe-La-P-O,Fe25La25P25O25,P 4/n m m,tetragonal,4.068879,4.068879,9.084981,data/final/MP/cifs/As0.1Fe1La1P0.9O1-MP-mp-510668-synth_doped.cif,data/source/MP/raw/cifs/mp-510668.cif,mp-510668,0.0,,2014-02-26 04:17:37,5.337337070142887,,,{'GGA+U': {'task_id': 'mp-1704083'}},0.3903949226041714,6.29241646,520.0,-55.52669053,-6.94083631625,{'tags': []},-55.52669053,-6.94083631625,-1.734766549583334,"['xas', 'bandstructure']",True,"[162724, 420381, 391428]",True,2021-05-12 10:57:15.388000,FM,8,7,mp-510668,oxide,LaFePO,"{'functional': 'PBE', 'labels': ['La', 'Fe_pv', 'P', 'O'], 'pot_type': 'paw'}","{'La': 1.0, 'Fe': 1.0, 'P': 1.0, 'O': 1.0}",GGA+U,mp-510668,"['mp-542977', 'mp-510668', 'mp-1422599', 'mp-1704083', 'mp-1768909', 'mp-1779846', 'mp-1595432']",3.95130975,"{'La': 2.0, 'Fe': 2.0, 'P': 2.0, 'O': 2.0}",150.40891327693348,[],FM,True,129,1,"[0.0, 0.0, 3.7, 3.7, 0.0, 0.0, 0.0, 0.0]",0.0525408988591631,3.95130975,2,7.9026195,MP,data/source/MP/cleaned/cifs/MP-mp-510668.cif,True,,data/final/MP/graphs/As0.1Fe1La1P0.9O1-MP-mp-510668-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
As1Fe0.96Ni0.04Sm1O1,2,0.02,2.0,False,As2Fe1.92Ni0.08Sm2O2,As2Fe2Sm2O2,7.5,Ferrite,True,As25Fe24Ni1Sm25O25,As-Fe-Ni-Sm-O,5,Supercon,Sm1Fe0.96Ni0.04As1O1,MP-mp-20349,Sm2Fe2As2O2,As-Fe-Sm-O,As25Fe25Sm25O25,P 4/n m m,tetragonal,4.026492,4.026492,9.046755,data/final/MP/cifs/As1Fe0.96Ni0.04Sm1O1-MP-mp-20349-synth_doped.cif,data/source/MP/raw/cifs/mp-20349.cif,mp-20349,0.0,,2014-02-19 11:24:42,6.727802583283198,,,{'GGA+U': {'task_id': 'mp-1695938'}},0.3015723809374986,3.77685593,520.0,-52.73407138,-6.5917589225,{'tags': ['Samarium iron arsenic oxide (1/1/1/1)']},-52.73407138,-6.5917589225,-1.6285904237499995,"['xas', 'elasticity', 'bandstructure']",True,"[236652, 236653, 422002, 163457, 163458]",True,2021-05-12 10:56:16.728000,FM,8,10,mp-20349,oxide,SmFeAsO,"{'functional': 'PBE', 'labels': ['Sm_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Sm': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-20349,"['mp-24944', 'mp-1078897', 'mp-1079866', 'mp-1173321', 'mp-20349', 'mp-1425472', 'mp-1695938', 'mp-1772503', 'mp-1789694', 'mp-1588381']",3.75729895,"{'Sm': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",146.67176231613362,[],FM,True,129,1,"[0.0, 0.0, 3.5, 3.5, -0.0, -0.0, -0.0, -0.0]",0.0512341147425717,3.75729895,2,7.5145979,MP,data/source/MP/cleaned/cifs/MP-mp-20349.cif,True,,data/final/MP/graphs/As1Fe0.96Ni0.04Sm1O1-MP-mp-20349-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Cd6Na1,2,0.0219780219780219,5.5,False,Cd33Na5.5,Cd33Na6,0.0,Other,True,Cd85.714Na14.286,Cd-Na,2,Supercon,Cd6Na1,MP-mp-1203422,Na6Cd33,Cd-Na,Cd84.615Na15.385,P m -3,cubic,9.793417,9.793417,9.793417,data/final/MP/cifs/Cd6Na1-MP-mp-1203422-synth_doped.cif,data/source/MP/raw/cifs/mp-1203422.cif,mp-1203422,0.0,,2019-01-12 07:16:45.907000,6.801820509982636,,,,0.003440980138067,2.17361584,520.0,-41.0776523,-1.053273135897436,"{'tags': ['Mg2Zn11', 'Sodium cadmide (2/11)', 'Na2Cd11']}",-41.0776523,-1.053273135897436,-0.0689009861361625,[],False,[421373],True,2021-05-12 11:00:12.709000,NM,39,2,mp-1203422,,Na2Cd11,"{'functional': 'PBE', 'labels': ['Na_pv', 'Cd'], 'pot_type': 'paw'}","{'Na': 2.0, 'Cd': 11.0}",GGA,mp-1203422,"['mp-1203422', 'mp-1370410']",0.0001692333333333,"{'Na': 6.0, 'Cd': 33.0}",939.2965798298565,[],NM,False,200,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.40510857701584e-07,0.0001692333333333,0,0.0005077,MP,data/source/MP/cleaned/cifs/MP-mp-1203422.cif,True,,data/final/MP/graphs/Cd6Na1-MP-mp-1203422-synth_doped.json,0,True,m-3,2,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Cu3La1O7,1,0.0,1.0,True,Ba2Cu3La1O7,Ba2Cu3La1O7,89.6,Cuprate,True,Ba15.385Cu23.077La7.692O53.84615384615385,Ba-Cu-La-O,4,Supercon,La1Ba2Cu3O7,MP-mp-622210,Ba2La1Cu3O7,Ba-Cu-La-O,Ba15.385Cu23.077La7.692O53.84615384615385,P m m m,orthorhombic,3.912033,3.978575,11.900925,data/final/MP/cifs/Ba2Cu3La1O7-MP-mp-622210.cif,data/source/MP/raw/cifs/mp-622210.cif,mp-622210,0.0,,2014-02-16 07:47:08,6.420495647479224,10.17188/1278110,"@misc{osti_1278110,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2LaCu3O7 (SG:47) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278110"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1676618'}},0.0206010060576886,3.9422618,520.0,-79.09444788,-6.084188298461539,{'tags': ['Lanthanum dibarium tricopper heptaoxide']},-79.09444788,-6.084188298461539,-2.1689347746153844,['bandstructure'],True,[81167],True,2021-05-12 10:58:51.532000,NM,13,10,mp-622210,oxide,Ba2LaCu3O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'La': 1.0, 'Cu': 3.0, 'O': 7.0}",GGA,mp-622210,"['mp-932742', 'mp-931665', 'mp-916330', 'mp-622210', 'mp-1228591', 'mp-1236979', 'mp-1381031', 'mp-1676618', 'mp-1832760', 'mp-1598015']",6.1e-06,"{'Ba': 2.0, 'La': 1.0, 'Cu': 3.0, 'O': 7.0}",185.22976563934355,[],NM,False,47,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.293207211565103e-08,6.1e-06,0,6.1e-06,MP,data/source/MP/cleaned/cifs/MP-mp-622210.cif,False,,data/final/MP/graphs/Ba2Cu3La1O7-MP-mp-622210.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
La0.84Ru3Si2Tm0.16,3,0.0533333333333333,1.0,True,La0.84Ru3Si2Tm0.16,La1Ru3Si2,6.1,Other,True,La14Ru50Si33.333Tm2.667,La-Ru-Si-Tm,4,Supercon,La0.84Tm0.16Ru3Si2,MP-mp-29240,La2Si4Ru6,La-Ru-Si,La16.667Ru50Si33.333,P 6/m m m,hexagonal,3.6088705,5.693851997310984,5.69385245,data/final/MP/cifs/La0.84Ru3Si2Tm0.16-MP-mp-29240-synth_doped.cif,data/source/MP/raw/cifs/mp-29240.cif,mp-29240,0.0,,2014-02-24 11:42:03,8.166084465628895,10.17188/1203620,"@misc{osti_1203620,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaSi2Ru3 (SG:193) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1203620"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1719509'}},0.0844490616666675,8.56766587,520.0,-95.13702135,-7.9280851125,{'tags': []},-95.13702135,-7.9280851125,-0.6361177608333328,"['xas', 'bandstructure']",True,[],True,2021-05-12 10:57:03.017000,NM,12,10,mp-29240,,LaSi2Ru3,"{'functional': 'PBE', 'labels': ['La', 'Si', 'Ru_pv'], 'pot_type': 'paw'}","{'La': 1.0, 'Si': 2.0, 'Ru': 3.0}",GGA,mp-29240,"['mp-925171', 'mp-924493', 'mp-909454', 'mp-29240', 'mp-1172476', 'mp-1254946', 'mp-1406081', 'mp-1719509', 'mp-1834844', 'mp-1618500']",0.00014945,"{'La': 2.0, 'Si': 4.0, 'Ru': 6.0}",202.6489324904347,[],NM,False,38,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, 0.0, 0.0, 0.0, -0.0]",1.4749645918520125e-06,0.00014945,0,0.0002989,MP,data/source/MP/cleaned/cifs/MP-mp-29240.cif,True,,data/final/MP/graphs/La0.84Ru3Si2Tm0.16-MP-mp-29240-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
As1Fe1.01Li0.99,2,0.0066666666666666,2.0,False,As2Fe2.02Li1.98,As2Fe2Li2,14.0,Ferrite,True,As33.333Fe33.667Li33,As-Fe-Li,3,Supercon,Li0.99Fe1.01As1,MP-mp-21471,Li2Fe2As2,As-Fe-Li,As33.333Fe33.333Li33.333,P 4/n m m,tetragonal,3.790629,3.790629,6.107451,data/final/MP/cifs/As1Fe1.01Li0.99-MP-mp-21471-synth_doped.cif,data/source/MP/raw/cifs/mp-21471.cif,mp-21471,0.0,,2013-10-29 11:57:13,5.21140049061562,10.17188/1196927,"@misc{osti_1196927,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LiFeAs (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196927"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686578'}},0.0,4.20304559,520.0,-32.72438031,-5.454063385,"{'tags': ['Lithium iron arsenide', 'Iron lithium arsenide']}",-32.72438031,-5.454063385,-0.4413801444444445,"['xas', 'elasticity']",False,"[290700, 168206, 610480, 169175, 162250, 162056, 166457, 163870]",True,2021-05-12 10:56:16.728000,FM,6,18,mp-21471,,LiFeAs,"{'functional': 'PBE', 'labels': ['Li_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Li': 1.0, 'Fe': 1.0, 'As': 1.0}",GGA,mp-21471,"['mp-917215', 'mp-674647', 'mp-919059', 'mp-920059', 'mp-1071407', 'mp-21471', 'mp-1071451', 'mp-38403', 'mp-33848', 'mp-37001', 'mp-34336', 'mp-36599', 'mp-36822', 'mp-36276', 'mp-1439936', 'mp-1686578', 'mp-1784376', 'mp-1071444']",0.2682074,"{'Li': 2.0, 'Fe': 2.0, 'As': 2.0}",87.75715855248485,[],FM,True,129,1,"[-0.0, -0.0, 0.3, 0.3, -0.0, -0.0]",0.0061124905232567,0.2682074,2,0.5364148,MP,data/source/MP/cleaned/cifs/MP-mp-21471.cif,True,,data/final/MP/graphs/As1Fe1.01Li0.99-MP-mp-21471-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Be1Mo3,1,0.0,2.0,False,Be2Mo6,Be2Mo6,0.0,Other,True,Be25Mo75,Be-Mo,2,Supercon,Be1Mo3,MP-mp-11271,Be2Mo6,Be-Mo,Be25Mo75,P m -3 n,cubic,4.854445,4.854445,4.854445,data/final/MP/cifs/Be1Mo3-MP-mp-11271.cif,data/source/MP/raw/cifs/mp-11271.cif,mp-11271,0.0,,2011-05-29 12:06:03,8.617302186212072,10.17188/1187693,"@misc{osti_1187693,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BeMo3 (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187693"",
    place = ""United States"",
    year = ""2015"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702980'}},0.1216181984375008,6.97805723,520.0,-72.53949348,-9.067436685,{'tags': ['Beryllium molybdenum (1/3)']},-72.53949348,-9.067436685,0.0016488037499993,"['xas', 'bandstructure']",True,[58715],True,2021-05-12 10:56:51.169000,NM,8,8,mp-11271,,BeMo3,"{'functional': 'PBE', 'labels': ['Be_sv', 'Mo_pv'], 'pot_type': 'paw'}","{'Be': 1.0, 'Mo': 3.0}",GGA,mp-11271,"['mp-934560', 'mp-11271', 'mp-941075', 'mp-941384', 'mp-1413261', 'mp-1702980', 'mp-1804608', 'mp-1594625']",0.00292545,"{'Be': 2.0, 'Mo': 6.0}",114.39808510458818,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",5.114508686619036e-05,0.00292545,0,0.0058509,MP,data/source/MP/cleaned/cifs/MP-mp-11271.cif,False,,data/final/MP/graphs/Be1Mo3-MP-mp-11271.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Al6Re1,1,0.0,2.0,False,Al12Re2,Al12Re2,1.85,Other,True,Al85.714Re14.286,Al-Re,2,Supercon,Al6Re1,MP-mp-16528,Al12Re2,Al-Re,Al85.714Re14.286,C m c m,orthorhombic,5.05882284,5.05882284,9.033693,data/final/MP/cifs/Al6Re1-MP-mp-16528.cif,data/source/MP/raw/cifs/mp-16528.cif,mp-16528,0.0,,2011-05-28 13:39:37,5.0511430902639285,10.17188/1191979,"@misc{osti_1191979,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Al6Re (SG:63) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191979"",
    place = ""United States"",
    year = ""2015"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1669792'}},0.006465356138996,7.69864709,520.0,-72.7172626,-5.194090185714286,{'tags': ['Aluminium rhenium (6/1)']},-72.7172626,-5.194090185714286,-0.2058070192857144,"['xas', 'elasticity', 'bandstructure']",True,[58149],True,2021-05-12 10:56:14.760000,NM,14,10,mp-16528,,Al6Re,"{'functional': 'PBE', 'labels': ['Al', 'Re_pv'], 'pot_type': 'paw'}","{'Al': 6.0, 'Re': 1.0}",GGA,mp-16528,"['mp-940686', 'mp-932080', 'mp-940260', 'mp-16528', 'mp-1103935', 'mp-1259216', 'mp-1475634', 'mp-1669792', 'mp-1879224', 'mp-1602944']",0.0020274,"{'Al': 12.0, 'Re': 2.0}",228.86993346998565,[],NM,False,63,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.7716612831242652e-05,0.0020274,0,0.0040548,MP,data/source/MP/cleaned/cifs/MP-mp-16528.cif,False,,data/final/MP/graphs/Al6Re1-MP-mp-16528.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
C1In1Ti2,1,0.0,2.0,False,C2In2Ti4,C2In2Ti4,3.1,Other,True,C25In25Ti50,C-In-Ti,3,Supercon,Ti2In1C1,MP-mp-20315,Ti4In2C2,C-In-Ti,C25In25Ti50,P 63/m m c,hexagonal,3.146612001608497,3.14661293,14.217167,data/final/MP/cifs/C1In1Ti2-MP-mp-20315.cif,data/source/MP/raw/cifs/mp-20315.cif,mp-20315,0.0,,2014-02-21 13:17:36,6.06319055995977,10.17188/1195440,"@misc{osti_1195440,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ti2InC (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195440"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-919039'}},0.0,7.38665946,520.0,-60.88923856,-7.61115482,"{'tags': ['Titanium indium carbide (2/1/1)', 'High pressure experimental phase']}",-60.88923856,-7.61115482,-0.668792704166667,"['xas', 'elasticity', 'bandstructure']",True,"[161964, 163504, 180620, 161965, 42920, 161963, 618127, 163513, 163512]",True,2021-05-12 10:56:14.760000,NM,8,7,mp-20315,,Ti2InC,"{'functional': 'PBE', 'labels': ['Ti_pv', 'In_d', 'C'], 'pot_type': 'paw'}","{'Ti': 2.0, 'In': 1.0, 'C': 1.0}",GGA,mp-20315,"['mp-920043', 'mp-906251', 'mp-919039', 'mp-20315', 'mp-1439612', 'mp-1803112', 'mp-1594025']",0.0023965,"{'Ti': 4.0, 'In': 2.0, 'C': 2.0}",121.90745267304546,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",3.931671029871141e-05,0.0023965,0,0.004793,MP,data/source/MP/cleaned/cifs/MP-mp-20315.cif,False,,data/final/MP/graphs/C1In1Ti2-MP-mp-20315.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ce2In8Rh1,1,0.0,1.0,True,Ce2In8Rh1,Ce2In8Rh1,0.8125,Heavy_fermion,True,Ce18.182In72.727Rh9.091,Ce-In-Rh,3,Supercon,Ce2Rh1In8,MP-mp-1206465,Ce2In8Rh1,Ce-In-Rh,Ce18.182In72.727Rh9.091,P 4/m m m,tetragonal,4.697377,4.697377,12.232865,data/final/MP/cifs/Ce2In8Rh1-MP-mp-1206465.cif,data/source/MP/raw/cifs/mp-1206465.cif,mp-1206465,0.0,,2019-01-12 09:46:15.381000,8.007829413936218,,,{'GGA': {'task_id': 'mp-1737813'}},0.0,7.99783756,520.0,-45.84956794,-4.16814254,{'tags': []},-45.84956794,-4.16814254,-0.4186919927272728,[],False,[],True,2021-05-12 11:00:17.126000,FM,11,4,mp-1206465,,Ce2In8Rh,"{'functional': 'PBE', 'labels': ['Ce', 'In_d', 'Rh_pv'], 'pot_type': 'paw'}","{'Ce': 2.0, 'In': 8.0, 'Rh': 1.0}",GGA,mp-1206465,"['mp-1206465', 'mp-1442917', 'mp-1737813', 'mp-1938886']",1.4747072,"{'Ce': 2.0, 'In': 8.0, 'Rh': 1.0}",269.9224560476763,[],FM,True,123,1,"[0.6, 0.6, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0054634476197101,1.4747072,2,1.4747072,MP,data/source/MP/cleaned/cifs/MP-mp-1206465.cif,False,,data/final/MP/graphs/Ce2In8Rh1-MP-mp-1206465.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B2Ru1Sc0.2Y0.8,3,0.0999999999999999,4.0,False,B8Ru4Sc0.8Y3.2,B8Ru4Y4,8.1,Other,True,B50Ru25Sc5Y20,B-Ru-Sc-Y,4,Supercon,Y0.8Sc0.2Ru1B2,MP-mp-1188195,Y4B8Ru4,B-Ru-Y,B50Ru25Y25,P n m a,orthorhombic,5.326399,5.924459,6.362677,data/final/MP/cifs/B2Ru1Sc0.2Y0.8-MP-mp-1188195-synth_doped.cif,data/source/MP/raw/cifs/mp-1188195.cif,mp-1188195,0.0,,2019-01-11 19:15:33.337000,7.000000449478844,,,,0.0,6.19814435,520.0,-125.97096122,-7.87318507625,"{'tags': ['Yttrium ruthenium boride (1/1/2)', 'LuRuB2', 'YRuB2']}",-125.97096122,-7.87318507625,-0.5982739987499999,[],False,[615399],True,2021-05-12 10:59:52.436000,NM,16,3,mp-1188195,,YB2Ru,"{'functional': 'PBE', 'labels': ['Y_sv', 'B', 'Ru_pv'], 'pot_type': 'paw'}","{'Y': 1.0, 'B': 2.0, 'Ru': 1.0}",GGA,mp-1188195,"['mp-1188195', 'mp-1834131', 'mp-1982221']",0.001016,"{'Y': 4.0, 'B': 8.0, 'Ru': 4.0}",200.7808421553609,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.024097496739925e-05,0.001016,0,0.004064,MP,data/source/MP/cleaned/cifs/MP-mp-1188195.cif,True,,data/final/MP/graphs/B2Ru1Sc0.2Y0.8-MP-mp-1188195-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Te3Zr1,1,0.0,2.0,False,Te6Zr2,Te6Zr2,2.308333333,Other,True,Te75Zr25,Te-Zr,2,Supercon,Te3Zr1,MP-mp-2089,Zr2Te6,Te-Zr,Te75Zr25,P 1 21/m 1,monoclinic,3.950031,5.98697,10.42713908,data/final/MP/cifs/Te3Zr1-MP-mp-2089.cif,data/source/MP/raw/cifs/mp-2089.cif,mp-2089,0.0,,2011-05-13 11:02:01,6.430112720356544,10.17188/1196085,"@misc{osti_1196085,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrTe3 (SG:11) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196085"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700337'}},0.0,5.54602323,520.0,-41.68835637,-5.21104454625,{'tags': ['Zirconium telluride (1/3)']},-41.68835637,-5.21104454625,-1.0331436912500005,"['xas', 'elasticity', 'bandstructure']",True,"[71033, 51004, 42076, 653232, 653211, 86763, 86764]",True,2021-05-12 10:56:14.760000,NM,8,12,mp-2089,,ZrTe3,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Te'], 'pot_type': 'paw'}","{'Zr': 1.0, 'Te': 3.0}",GGA,mp-2089,"['mp-923546', 'mp-908434', 'mp-922768', 'mp-2089', 'mp-570656', 'mp-1079384', 'mp-1079511', 'mp-1080553', 'mp-1417066', 'mp-1700337', 'mp-1776674', 'mp-1595520']",2.06e-05,"{'Zr': 2.0, 'Te': 6.0}",244.82786064203003,[],NM,False,11,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.682815015086854e-07,2.06e-05,0,4.12e-05,MP,data/source/MP/cleaned/cifs/MP-mp-2089.cif,False,,data/final/MP/graphs/Te3Zr1-MP-mp-2089.json,0,True,2/m,0,0,3,0,0,0,0,1,0,0,0,1.0,False
Sm1,1,0.0,4.0,False,Sm4,Sm4,0.0,Other,True,Sm100,Sm,1,Supercon,Sm1,MP-mp-69,Sm4,Sm,Sm100,P 63/m m c,hexagonal,3.650153999447763,3.65015392,11.746542,data/final/MP/cifs/Sm1-MP-mp-69.cif,data/source/MP/raw/cifs/mp-69.cif,mp-69,0.0,,2011-05-13 00:09:26,7.368487912582846,10.17188/1284458,"@misc{osti_1284458,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sm (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1284458"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700275'}},0.0,3.0595384,520.0,-18.87434454,-4.718586135,"{'tags': ['Samarium', 'Samarium - HP, HT', 'High pressure experimental phase']}",-18.87434454,-4.718586135,0.0,"['eos', 'elasticity', 'bandstructure', 'surfaces']",True,"[652632, 652637, 52482]",True,2021-05-12 10:56:27.046000,NM,4,8,mp-69,,Sm,"{'functional': 'PBE', 'labels': ['Sm_3'], 'pot_type': 'paw'}",{'Sm': 1.0},GGA,mp-69,"['mp-930961', 'mp-930585', 'mp-913791', 'mp-69', 'mp-1441481', 'mp-1700275', 'mp-1778544', 'mp-1594421']",0.00229825,{'Sm': 4.0},135.53861091506204,[],NM,False,187,0,"[0.0, 0.0, -0.0, 0.0]",6.782569142427597e-05,0.00229825,0,0.009193,MP,data/source/MP/cleaned/cifs/MP-mp-69.cif,False,,data/final/MP/graphs/Sm1-MP-mp-69.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
As1Ce1F0.3Fe1O0.7,3,0.15,2.0,False,As2Ce2F0.6Fe2O1.4,As2Ce2Fe2O2,46.0,Ferrite,True,As25Ce25F7.5Fe25O17.5,As-Ce-F-Fe-O,5,Supercon,Ce1Fe1As1F0.3O0.7,MP-mp-605060,Ce2Fe2As2O2,As-Ce-Fe-O,As25Ce25Fe25O25,P 4 m m,tetragonal,3.992256,3.992256,9.041971,data/final/MP/cifs/As1Ce1F0.3Fe1O0.7-MP-mp-605060-synth_doped.cif,data/source/MP/raw/cifs/mp-605060.cif,mp-605060,0.0,,2014-02-14 20:12:08,6.611233843492404,10.17188/1277425,"@misc{osti_1277425,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeFeAsO (SG:99) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277425"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-1751604'}},0.2072581873958352,6.30288445,520.0,-55.74271596,-6.967839495,{'tags': []},-55.74271596,-6.967839495,-1.7010452412499992,['bandstructure'],True,[],True,2021-05-12 10:58:51.532000,FiM,8,10,mp-605060,oxide,CeFeAsO,"{'functional': 'PBE', 'labels': ['Ce', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-605060,"['mp-605060', 'mp-917114', 'mp-918266', 'mp-919274', 'mp-1443189', 'mp-1751604', 'mp-1770633', 'mp-1779614', 'mp-1873964', 'mp-1622328']",2.99945325,"{'Ce': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",144.11191005541338,[],FiM,True,99,3,"[-0.5, -0.5, 3.5, 3.5, 0.0, 0.0, 0.0, 0.0]",0.0416267225775671,2.99945325,4,5.9989065,MP,data/source/MP/cleaned/cifs/MP-mp-605060.cif,True,,data/final/MP/graphs/As1Ce1F0.3Fe1O0.7-MP-mp-605060-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
Cu1S4V2,1,0.0,2.0,False,Cu2S8V4,Cu2S8V4,4.45,Other,True,Cu14.286S57.143V28.571,Cu-S-V,3,Supercon,Cu1V2S4,MP-mp-5178,V4Cu2S8,Cu-S-V,Cu14.286S57.143V28.571,F d -3 m,cubic,6.980894730000001,6.980894729999999,6.980894729999999,data/final/MP/cifs/Cu1S4V2-MP-mp-5178.cif,data/source/MP/raw/cifs/mp-5178.cif,mp-5178,0.0,,2011-05-15 10:00:26,4.054604565376014,10.17188/1263130,"@misc{osti_1263130,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V2CuS4 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1263130"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702473'}},0.0598581738095269,5.46157253,520.0,-88.20830333,-6.300593095000001,"{'tags': ['Copper divanadium(III) sulfide', 'Copper vanadium sulfide (1/2/4)', 'Copper(I) vanadium(III) vanadium(IV) sulfide']}",-88.20830333,-6.300593095000001,-1.0433333410714292,"['xas', 'bandstructure']",True,"[190441, 188999, 190442, 628949, 35267, 10035, 628953]",True,2021-05-12 10:57:10.838000,FiM,14,10,mp-5178,,V2CuS4,"{'functional': 'PBE', 'labels': ['V_pv', 'Cu_pv', 'S'], 'pot_type': 'paw'}","{'V': 2.0, 'Cu': 1.0, 'S': 4.0}",GGA,mp-5178,"['mp-916002', 'mp-931483', 'mp-932498', 'mp-5178', 'mp-1103841', 'mp-1104153', 'mp-1428337', 'mp-1702473', 'mp-1865350', 'mp-1599402']",3.00003305,"{'V': 4.0, 'Cu': 2.0, 'S': 8.0}",240.5571493186837,[],FiM,True,227,2,"[1.5, 1.5, 1.5, 1.5, -0.1, -0.1, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0249423728082646,3.00003305,6,6.0000661,MP,data/source/MP/cleaned/cifs/MP-mp-5178.cif,False,,data/final/MP/graphs/Cu1S4V2-MP-mp-5178.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ga1Th2,1,0.0,2.0,False,Ga2Th4,Ga2Th4,0.0,Other,True,Ga33.333Th66.667,Ga-Th,2,Supercon,Ga1Th2,MP-mp-568411,Th4Ga2,Ga-Th,Ga33.333Th66.667,I 4/m c m,tetragonal,5.891739996387733,6.082883229099898,6.082883230000001,data/final/MP/cifs/Ga1Th2-MP-mp-568411.cif,data/source/MP/raw/cifs/mp-568411.cif,mp-568411,0.0,,2014-02-16 07:18:06,10.623539551056211,10.17188/1274427,"@misc{osti_1274427,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Th2Ga (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1274427"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687593'}},0.0,6.55869207,520.0,-37.91127213,-6.318545355,"{'tags': ['Gallium thorium (1/2)', 'Thorium gallide (2/1)']}",-37.91127213,-6.318545355,-0.3666078475000003,"['xas', 'elasticity', 'bandstructure']",True,"[635536, 102812]",True,2021-05-12 10:56:22.739000,NM,6,9,mp-568411,,Th2Ga,"{'functional': 'PBE', 'labels': ['Th', 'Ga_d'], 'pot_type': 'paw'}","{'Th': 2.0, 'Ga': 1.0}",GGA,mp-568411,"['mp-928875', 'mp-928341', 'mp-912329', 'mp-568411', 'mp-1076972', 'mp-1300917', 'mp-1687593', 'mp-1882766', 'mp-1594406']",0.002308,"{'Th': 4.0, 'Ga': 2.0}",166.8736277992346,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0]",2.766165068067857e-05,0.002308,0,0.004616,MP,data/source/MP/cleaned/cifs/MP-mp-568411.cif,False,,data/final/MP/graphs/Ga1Th2-MP-mp-568411.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Cu1La1.737Sr0.263O4,3,0.0751428571428571,1.0,True,Cu1La1.737Sr0.263O4,Cu1La2O4,8.0,Cuprate,True,Cu14.286La24.814Sr3.757O57.142857142857146,Cu-La-Sr-O,4,Supercon,La1.737Sr0.263Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La1.737Sr0.263O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La1.737Sr0.263O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ca1Pb1.2Tl1.8,3,0.0999999999999999,1.0,True,Ca1Pb1.2Tl1.8,Ca1Pb1Tl2,2.8,Other,True,Ca25Pb30Tl45,Ca-Pb-Tl,3,Supercon,Ca1Tl1.8Pb1.2,MP-mp-1097156,Ca1Tl2Pb1,Ca-Pb-Tl,Ca25Pb25Tl50,I m m m,orthorhombic,12.46634200054304,13.05266739,13.052667389083645,data/final/MP/cifs/Ca1Pb1.2Tl1.8-MP-mp-1097156-synth_doped.cif,data/source/MP/raw/cifs/mp-1097156.cif,mp-1097156,0.0,,2018-05-26 01:19:33,0.698114738892654,,,,1.388878704166666,-2.79422287,520.0,-5.9925486,-1.49813715,{'tags': []},-5.9925486,-1.49813715,1.1127461608333336,[],False,[],True,2021-05-12 10:59:26.677000,NM,4,2,mp-1097156,,CaTl2Pb,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Tl_d', 'Pb_d'], 'pot_type': 'paw'}","{'Ca': 1.0, 'Tl': 2.0, 'Pb': 1.0}",GGA,mp-1097156,"['mp-1097156', 'mp-1357876']",5.9e-06,"{'Ca': 1.0, 'Tl': 2.0, 'Pb': 1.0}",1560.470832430714,[],NM,False,71,0,"[0, 0, 0, 0]",3.7809101441580224e-09,5.9e-06,0,5.9e-06,MP,data/source/MP/cleaned/cifs/MP-mp-1097156.cif,True,,data/final/MP/graphs/Ca1Pb1.2Tl1.8-MP-mp-1097156-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,0,1,0,1.0,False
Ba2Cu3Pr0.7Sm0.3O7,3,0.0461538461538461,1.0,True,Ba2Cu3Pr0.7Sm0.3O7,Ba2Cu3Pr1O7,0.0,Cuprate,True,Ba15.385Cu23.077Pr5.385Sm2.308O53.84615384615385,Ba-Cu-Pr-Sm-O,5,Supercon,Sm0.3Pr0.7Ba2Cu3O7,MP-mp-20936,Ba2Pr1Cu3O7,Ba-Cu-Pr-O,Ba15.385Cu23.077Pr7.692O53.84615384615385,P m m m,orthorhombic,3.903923,3.95568,11.916432,data/final/MP/cifs/Ba2Cu3Pr0.7Sm0.3O7-MP-mp-20936-synth_doped.cif,data/source/MP/raw/cifs/mp-20936.cif,mp-20936,0.0,,2014-02-22 14:41:55,6.480717836004672,10.17188/1196129,"@misc{osti_1196129,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2PrCu3O7 (SG:47) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196129"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698257'}},0.0256000172756332,3.18514576,520.0,-78.62827906,-6.048329158461538,"{'tags': ['Dibarium praseodymium tricopper heptaoxide', 'Praseodymium dibarium dicopper copper(III) oxide', 'Praseodymium dibarium tricopper heptaoxide', 'Praseodymium dibarium copper(III) dicopper oxide']}",-78.62827906,-6.048329158461538,-2.145007016153845,"['xas', 'bandstructure']",True,"[41452, 94377, 81168, 173910, 89221]",True,2021-05-12 10:56:57.051000,NM,13,8,mp-20936,oxide,Ba2PrCu3O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Pr_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Pr': 1.0, 'Cu': 3.0, 'O': 7.0}",GGA,mp-20936,"['mp-988090', 'mp-987725', 'mp-20936', 'mp-1417367', 'mp-1698257', 'mp-1833655', 'mp-988324', 'mp-1602318']",0.0007234,"{'Ba': 2.0, 'Pr': 1.0, 'Cu': 3.0, 'O': 7.0}",184.02152853403555,[],NM,False,47,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.931061793491212e-06,0.0007234,0,0.0007234,MP,data/source/MP/cleaned/cifs/MP-mp-20936.cif,True,,data/final/MP/graphs/Ba2Cu3Pr0.7Sm0.3O7-MP-mp-20936-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
As1Ge1Re1,1,0.0,2.0,False,As2Ge2Re2,As2Ge2Re2,0.0,Other,True,As33.333Ge33.333Re33.333,As-Ge-Re,3,Supercon,As1Ge1Re1,MP-mp-1219536,Re2Ge2As2,As-Ge-Re,As33.333Ge33.333Re33.333,C 1 2/m 1,monoclinic,3.2369239994401275,4.872376459999999,6.915187192718807,data/final/MP/cifs/As1Ge1Re1-MP-mp-1219536.cif,data/source/MP/raw/cifs/mp-1219536.cif,mp-1219536,0.0,,2019-01-12 20:31:32.470000,11.12581194262138,,,{'GGA': {'task_id': 'mp-1757876'}},0.0061841645238098,7.81064524,520.0,-43.66801515,-7.278002525000001,{'tags': []},-43.66801515,-7.278002525000001,-0.0357780433333327,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,6,5,mp-1219536,,ReGeAs,"{'functional': 'PBE', 'labels': ['Re_pv', 'Ge_d', 'As'], 'pot_type': 'paw'}","{'Re': 1.0, 'Ge': 1.0, 'As': 1.0}",GGA,mp-1219536,"['mp-1219536', 'mp-1445989', 'mp-1757876', 'mp-1877465', 'mp-1625345']",0.0008201,"{'Re': 2.0, 'Ge': 2.0, 'As': 2.0}",99.63062513778276,[],NM,False,12,0,"[0, 0, 0, 0, 0, 0]",1.6462809479833223e-05,0.0008201,0,0.0016402,MP,data/source/MP/cleaned/cifs/MP-mp-1219536.cif,False,,data/final/MP/graphs/As1Ge1Re1-MP-mp-1219536.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
Pb1,1,0.0,2.0,False,Pb2,Pb2,6.4701,Other,True,Pb100,Pb,1,Supercon,Pb1,MP-mp-20745,Pb2,Pb,Pb100,P 63/m m c,hexagonal,3.5483880003302883,3.54838787,5.841275,data/final/MP/cifs/Pb1-MP-mp-20745.cif,data/source/MP/raw/cifs/mp-20745.cif,mp-20745,0.0,,2014-02-21 06:03:54,10.803597041477024,10.17188/1195910,"@misc{osti_1195910,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Pb (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195910"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671696'}},0.0142713200000001,6.75473692,520.0,-7.3967515,-3.69837575,"{'tags': ['High pressure experimental phase', 'Lead', 'Lead - HP']}",-7.3967515,-3.69837575,0.0142713200000001,"['xas', 'elasticity', 'bandstructure', 'surfaces']",True,"[54313, 77864, 648350]",True,2021-05-12 10:56:14.760000,NM,2,8,mp-20745,,Pb,"{'functional': 'PBE', 'labels': ['Pb_d'], 'pot_type': 'paw'}",{'Pb': 1.0},GGA,mp-20745,"['mp-905163', 'mp-918466', 'mp-919474', 'mp-20745', 'mp-1440020', 'mp-1671696', 'mp-1793324', 'mp-1595976']",0.00308295,{'Pb': 2.0},63.69428501981242,[],NM,False,194,0,"[0, 0]",9.68046033970248e-05,0.00308295,0,0.0061659,MP,data/source/MP/cleaned/cifs/MP-mp-20745.cif,False,,data/final/MP/graphs/Pb1-MP-mp-20745.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Nb1Ru1Si1,1,0.0,6.0,False,Nb6Ru6Si6,Nb6Ru6Si6,2.65,Other,True,Nb33.333Ru33.333Si33.333,Nb-Ru-Si,3,Supercon,Nb1Ru1Si1,MP-mp-1188541,Nb6Si6Ru6,Nb-Ru-Si,Nb33.333Ru33.333Si33.333,I m a 2,orthorhombic,6.55132200204642,7.456803738998719,7.280552001964691,data/final/MP/cifs/Nb1Ru1Si1-MP-mp-1188541.cif,data/source/MP/raw/cifs/mp-1188541.cif,mp-1188541,0.0,,2019-01-11 19:31:14.544000,8.248671024403214,,,{'GGA': {'task_id': 'mp-1707738'}},0.0,8.11425449,520.0,-160.79472992,-8.933040551111112,{'tags': ['Niobium ruthenium silicide (1/1/1)']},-160.79472992,-8.933040551111112,-0.6423709794444458,['bandstructure'],True,[600057],True,2021-05-12 10:58:33.577000,NM,18,4,mp-1188541,,NbSiRu,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Si', 'Ru_pv'], 'pot_type': 'paw'}","{'Nb': 1.0, 'Si': 1.0, 'Ru': 1.0}",GGA,mp-1188541,"['mp-1188541', 'mp-1436929', 'mp-1707738', 'mp-1604354']",0.0001108166666666,"{'Nb': 6.0, 'Si': 6.0, 'Ru': 6.0}",268.2195174362547,[],NM,False,46,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.478939662390604e-06,0.0001108166666666,0,0.0006649,MP,data/source/MP/cleaned/cifs/MP-mp-1188541.cif,False,,data/final/MP/graphs/Nb1Ru1Si1-MP-mp-1188541.json,0,True,mm2,0,0,0,6,0,0,0,0,0,1,0,1.0,False
Be2Re1,1,0.0,4.0,False,Be8Re4,Be8Re4,0.0,Other,True,Be66.667Re33.333,Be-Re,2,Supercon,Be2Re1,MP-mp-11275,Be8Re4,Be-Re,Be66.667Re33.333,P 63/m m c,hexagonal,4.376781999359788,4.37678252,7.156537,data/final/MP/cifs/Be2Re1-MP-mp-11275.cif,data/source/MP/raw/cifs/mp-11275.cif,mp-11275,0.0,,2011-05-29 16:38:34,11.425838304666572,10.17188/1187697,"@misc{osti_1187697,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Be2Re (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187697"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703532'}},0.0,6.49823451,520.0,-84.2623946,-7.021866216666666,{'tags': ['Beryllium rhenium (2/1)']},-84.2623946,-7.021866216666666,-0.3807485783333331,"['xas', 'elasticity', 'bandstructure']",True,[58732],True,2021-05-12 10:56:10.715000,NM,12,8,mp-11275,,Be2Re,"{'functional': 'PBE', 'labels': ['Be_sv', 'Re_pv'], 'pot_type': 'paw'}","{'Be': 2.0, 'Re': 1.0}",GGA,mp-11275,"['mp-11275', 'mp-912116', 'mp-928224', 'mp-928729', 'mp-1420078', 'mp-1703532', 'mp-1803301', 'mp-1601522']",9.825e-06,"{'Be': 8.0, 'Re': 4.0}",118.72534846165108,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.310160846796261e-07,9.825e-06,0,3.93e-05,MP,data/source/MP/cleaned/cifs/MP-mp-11275.cif,False,,data/final/MP/graphs/Be2Re1-MP-mp-11275.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Fe1.5K0.8Se2,3,0.1302325581395348,1.0,True,Fe1.5K0.8Se2,Fe2K1Se2,32.4,Ferrite,True,Fe34.884K18.605Se46.512,Fe-K-Se,3,Supercon,K0.8Fe1.5Se2,MP-mp-1070735,K1Fe2Se2,Fe-K-Se,Fe40K20Se40,I 4/m m m,tetragonal,3.783558000712664,3.783558000712664,7.91886339,data/final/MP/cifs/Fe1.5K0.8Se2-MP-mp-1070735-synth_doped.cif,data/source/MP/raw/cifs/mp-1070735.cif,mp-1070735,0.0,,2018-03-22 03:52:22,4.804538531009527,,,{'GGA': {'task_id': 'mp-1761650'}},0.0327827750000011,3.42423866,520.0,-27.50456218,-5.500912436,{'tags': ['Potassium iron selenide (1/2/2)']},-27.50456218,-5.500912436,-0.6812646755374999,['bandstructure'],True,[186573],True,2021-05-12 10:58:14.654000,FM,5,8,mp-1070735,,K(FeSe)2,"{'functional': 'PBE', 'labels': ['K_sv', 'Fe_pv', 'Se'], 'pot_type': 'paw'}","{'K': 1.0, 'Fe': 2.0, 'Se': 2.0}",GGA,mp-1070735,"['mp-1070735', 'mp-1070765', 'mp-1070841', 'mp-1416829', 'mp-1761650', 'mp-1797161', 'mp-1585994', 'mp-1070830']",6.0503851,"{'K': 1.0, 'Fe': 2.0, 'Se': 2.0}",106.69540665041993,[],FM,True,139,1,"[0.0, 2.8, 2.8, 0.0, 0.0]",0.0567070813069176,6.0503851,2,6.0503851,MP,data/source/MP/cleaned/cifs/MP-mp-1070735.cif,True,,data/final/MP/graphs/Fe1.5K0.8Se2-MP-mp-1070735-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ru2Si2U1,1,0.0,1.0,True,Ru2Si2U1,Ru2Si2U1,1.231538462,Heavy_fermion,True,Ru40Si40U20,Ru-Si-U,3,Supercon,U1Ru2Si2,MP-mp-3388,U1Si2Ru2,Ru-Si-U,Ru40Si40U20,I 4/m m m,tetragonal,4.158676000898558,4.158676000898558,5.61744113,data/final/MP/cifs/Ru2Si2U1-MP-mp-3388.cif,data/source/MP/raw/cifs/mp-3388.cif,mp-3388,0.0,,2011-05-13 04:30:05,9.956832496604427,10.17188/1206675,"@misc{osti_1206675,
    author = ""Persson, Kristin"",
    title = ""Materials Data on U(SiRu)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1206675"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686680'}},0.0,9.49980175,520.0,-43.93435978,-8.786871956,"{'tags': ['Uranium ruthenium germanide (1/2/2)', 'Uranium ruthenium silicide (1/2/2)', 'Ruthenium uranium silicide (2/1/2)']}",-43.93435978,-8.786871956,-0.6203084840000003,"['xas', 'elasticity', 'bandstructure']",True,"[604007, 40549, 603775, 657192, 650657, 650659, 656244, 650651, 659029, 650655, 657104, 650654]",True,2021-05-12 10:56:20.740000,NM,5,10,mp-3388,,U(SiRu)2,"{'functional': 'PBE', 'labels': ['U', 'Si', 'Ru_pv'], 'pot_type': 'paw'}","{'U': 1.0, 'Si': 2.0, 'Ru': 2.0}",GGA,mp-3388,"['mp-908075', 'mp-923326', 'mp-922549', 'mp-3388', 'mp-1143681', 'mp-1441027', 'mp-1686680', 'mp-1864234', 'mp-1588085', 'mp-1586352']",0.00906,"{'U': 1.0, 'Si': 2.0, 'Ru': 2.0}",82.7765065997446,[],NM,False,139,0,"[0.0, 0.0, 0.0, -0.0, -0.0]",0.0001094513452205,0.00906,0,0.00906,MP,data/source/MP/cleaned/cifs/MP-mp-3388.cif,False,,data/final/MP/graphs/Ru2Si2U1-MP-mp-3388.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Fe1La0.85Sr1.15O4,2,0.0428571428571428,1.0,True,Fe1La0.85Sr1.15O4,Fe1La1Sr1O4,0.0,Oxide,True,Fe14.286La12.143Sr16.429O57.142857142857146,Fe-La-Sr-O,4,Supercon,La0.85Sr1.15Fe1O4,MP-mp-1218154,Sr1La1Fe1O4,Fe-La-Sr-O,Fe14.286La14.286Sr14.286O57.142857142857146,I 4 m m,tetragonal,3.937158001734294,3.937158001734294,6.88960943,data/final/MP/cifs/Fe1La0.85Sr1.15O4-MP-mp-1218154-synth_doped.cif,data/source/MP/raw/cifs/mp-1218154.cif,mp-1218154,0.8383000000000003,,2019-01-12 19:22:12.501000,5.887594614670473,,,{'GGA+U': {'task_id': 'mp-1759367'}},0.016510487916669,5.76152369,520.0,-50.2033373,-7.1719053285714285,{'tags': []},-50.2033373,-7.1719053285714285,-2.9028548959523803,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,FM,7,5,mp-1218154,oxide,SrLaFeO4,"{'functional': 'PBE', 'labels': ['Sr_sv', 'La', 'Fe_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 1.0, 'La': 1.0, 'Fe': 1.0, 'O': 4.0}",GGA+U,mp-1218154,"['mp-1218154', 'mp-1406782', 'mp-1759367', 'mp-1796050', 'mp-1625101']",5.0028359,"{'Sr': 1.0, 'La': 1.0, 'Fe': 1.0, 'O': 4.0}",97.68976115045156,[],FM,True,107,1,"[0.0, 0.0, 4.4, 0.0, 0.0, 0.0, 0.0]",0.0512114661872819,5.0028359,1,5.0028359,MP,data/source/MP/cleaned/cifs/MP-mp-1218154.cif,True,,data/final/MP/graphs/Fe1La0.85Sr1.15O4-MP-mp-1218154-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,0,0,1,0,1.0,False
Ba1Cu1Tl0.76O4.5,3,0.0968122786304604,1.7778523391812866,False,Ba1.778Cu1.778Tl1.351O8,Ba2Cu2Tl2O8,86.0,Cuprate,True,Ba13.774Cu13.774Tl10.468O61.98347107438016,Ba-Cu-Tl-O,4,Supercon,Tl0.76Ba1Cu1O4.5,MP-mvc-11834,Ba2Tl2Cu2O8,Ba-Cu-Tl-O,Ba14.286Cu14.286Tl14.286O57.142857142857146,I 4/m m m,tetragonal,3.732021999425989,3.732021999425989,16.06361062,data/final/MP/cifs/Ba1Cu1Tl0.76O4.5-MP-mvc-11834-synth_doped.cif,data/source/MP/raw/cifs/mvc-11834.cif,mvc-11834,0.0,,2013-11-18 12:28:55,7.061489956942412,10.17188/1318336,"@misc{osti_1318336,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BaTlCuO4 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1318336"",
    place = ""United States"",
    year = ""2014"",
    month = ""9"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1733109'}},0.1530334416071728,3.04091876,520.0,-71.56273436,-5.111623882857143,{'tags': []},-71.56273436,-5.111623882857143,-1.4795289304761898,['xas'],False,[],True,2021-05-12 10:57:59.523000,NM,14,4,mvc-11834,oxide,BaTlCuO4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Tl_d', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Tl': 1.0, 'Cu': 1.0, 'O': 4.0}",GGA,mvc-11834,"['mvc-11834', 'mp-1386589', 'mp-1733109', 'mp-1833961']",0.01143535,"{'Ba': 2.0, 'Tl': 2.0, 'Cu': 2.0, 'O': 8.0}",220.69405687912507,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001036307924346,0.01143535,0,0.0228707,MP,data/source/MP/cleaned/cifs/MP-mvc-11834.cif,True,,data/final/MP/graphs/Ba1Cu1Tl0.76O4.5-MP-mvc-11834-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
C0.46W0.54,3,0.08,2.0,False,C0.92W1.08,C1W1,9.0,Other,True,C46W54,C-W,2,Supercon,C0.46W0.54,MP-mp-1894,W1C1,C-W,C50W50,P -6 m 2,hexagonal,2.852907,2.9283199959743635,2.92832042,data/final/MP/cifs/C0.46W0.54-MP-mp-1894-synth_doped.cif,data/source/MP/raw/cifs/mp-1894.cif,mp-1894,0.0,,2011-05-12 17:47:36,15.350369295511475,10.17188/1193675,"@misc{osti_1193675,
    author = ""Persson, Kristin"",
    title = ""Materials Data on WC (SG:187) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1193675"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668674'}},0.0,7.78064382,520.0,-22.43019027,-11.215095135,"{'tags': ['Tungsten carbide (1/1) - h', 'Qusongite', 'Tungsten carbide (1/1)', 'Tungsten carbide - h', 'High pressure experimental phase', 'Tungsten carbide']}",-22.43019027,-11.215095135,-0.1226415499999991,"['xas', 'elasticity', 'bandstructure']",True,"[5212, 290352, 246151, 165099, 246149, 22258, 162416, 167895, 619091, 43380, 260168, 15406, 77566, 619090, 619096, 260171, 169401, 260166, 246150, 619088]",True,2021-05-12 10:56:14.760000,NM,2,18,mp-1894,,WC,"{'functional': 'PBE', 'labels': ['W_pv', 'C'], 'pot_type': 'paw'}","{'W': 1.0, 'C': 1.0}",GGA,mp-1894,"['mp-906287', 'mp-920052', 'mp-919065', 'mp-1894', 'mp-1056906', 'mp-1056929', 'mp-1056966', 'mp-1057325', 'mp-1057365', 'mp-1057304', 'mp-1115952', 'mp-1441004', 'mp-1668674', 'mp-1923176', 'mp-1590542', 'mp-1589375', 'mp-1056943', 'mp-1057342']",5.59e-05,"{'W': 1.0, 'C': 1.0}",21.18631365214464,[],NM,False,187,0,"[0, 0]",2.638495819415068e-06,5.59e-05,0,5.59e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1894.cif,True,,data/final/MP/graphs/C0.46W0.54-MP-mp-1894-synth_doped.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
B2C1Ni2Tb0.25Y0.75,3,0.0833333333333333,1.0,True,B2C1Ni2Tb0.25Y0.75,B2C1Ni2Y1,10.02,Other,True,B33.333C16.667Ni33.333Tb4.167Y12.5,B-C-Ni-Tb-Y,5,Supercon,Y0.75Tb0.25Ni2B2C1,MP-mp-6576,Y1Ni2B2C1,B-C-Ni-Y,B33.333C16.667Ni33.333Y16.667,I 4/m m m,tetragonal,3.548790000501972,3.548790000501972,5.76144136,data/final/MP/cifs/B2C1Ni2Tb0.25Y0.75-MP-mp-6576-synth_doped.cif,data/source/MP/raw/cifs/mp-6576.cif,mp-6576,0.0,,2011-05-13 05:21:43,6.099730998852292,10.17188/1281366,"@misc{osti_1281366,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281366"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688230'}},0.0,6.81083016,520.0,-43.677878,-7.279646333333333,{'tags': []},-43.677878,-7.279646333333333,-0.5109282141666659,"['xas', 'bandstructure']",True,"[75816, 89142, 83231, 79574, 41549]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6576,,YNi2B2C,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6576,"['mp-6576', 'mp-1007054', 'mp-1000583', 'mp-1439516', 'mp-1688230', 'mp-1794280', 'mp-1011792', 'mp-1597064']",0.0006603,"{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.3152437079014,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",1.010943177297096e-05,0.0006603,0,0.0006603,MP,data/source/MP/cleaned/cifs/MP-mp-6576.cif,True,,data/final/MP/graphs/B2C1Ni2Tb0.25Y0.75-MP-mp-6576-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B4Er1Ir4,1,0.0,2.0,False,B8Er2Ir8,B8Er2Ir8,2.22,Other,True,B44.444Er11.111Ir44.444,B-Er-Ir,3,Supercon,Er1Ir4B4,MP-mp-1189046,Er2B8Ir8,B-Er-Ir,B44.444Er11.111Ir44.444,P 42/n m c,tetragonal,5.40279,5.40279,7.462393,data/final/MP/cifs/B4Er1Ir4-MP-mp-1189046.cif,data/source/MP/raw/cifs/mp-1189046.cif,mp-1189046,0.0,,2019-01-11 19:54:01.106000,14.931795777347562,,,,0.0,8.29144286,520.0,-142.51600435,-7.917555797222223,{'tags': ['Erbium iridium boride (1/4/4)']},-142.51600435,-7.917555797222223,-0.5132216224074079,[],False,[659488],True,2021-05-12 10:59:54.607000,NM,18,3,mp-1189046,,Er(BIr)4,"{'functional': 'PBE', 'labels': ['Er_3', 'B', 'Ir'], 'pot_type': 'paw'}","{'Er': 1.0, 'B': 4.0, 'Ir': 4.0}",GGA,mp-1189046,"['mp-1189046', 'mp-1394418', 'mp-1788188']",0.00207495,"{'Er': 2.0, 'B': 8.0, 'Ir': 8.0}",217.82829479388937,[],NM,False,137,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.905124402652403e-05,0.00207495,0,0.0041499,MP,data/source/MP/cleaned/cifs/MP-mp-1189046.cif,False,,data/final/MP/graphs/B4Er1Ir4-MP-mp-1189046.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Bi1F0.4La1S2O0.6,2,0.0399999999999999,2.0,False,Bi2F0.8La2S4O1.2,Bi2F1La2S4O1,10.26,Oxide,True,Bi20F8La20S40O12,Bi-F-La-S-O,5,Supercon,La1Bi1S2F0.4O0.6,MP-mp-1223274,La2Bi2S4O1F1,Bi-F-La-S-O,Bi20F10La20S40O10,P -4 m 2,tetragonal,4.109577,4.109577,13.150136,data/final/MP/cifs/Bi1F0.4La1S2O0.6-MP-mp-1223274-synth_doped.cif,data/source/MP/raw/cifs/mp-1223274.cif,mp-1223274,0.0,,2019-01-12 23:41:28.903000,6.422922901673022,,,{'GGA': {'task_id': 'mp-1744170'}},0.0471324534999961,7.2695309,520.0,-59.26664004,-5.926664004,{'tags': []},-59.26664004,-5.926664004,-2.137031777,[],False,[],True,2021-05-12 11:00:52.054000,NM,10,4,mp-1223274,oxide,La2Bi2S4OF,"{'functional': 'PBE', 'labels': ['La', 'Bi', 'S', 'O', 'F'], 'pot_type': 'paw'}","{'La': 2.0, 'Bi': 2.0, 'S': 4.0, 'O': 1.0, 'F': 1.0}",GGA,mp-1223274,"['mp-1223274', 'mp-1388342', 'mp-1744170', 'mp-1861685']",0.0001151,"{'La': 2.0, 'Bi': 2.0, 'S': 4.0, 'O': 1.0, 'F': 1.0}",222.0876908666605,[],NM,False,115,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.182637522630872e-07,0.0001151,0,0.0001151,MP,data/source/MP/cleaned/cifs/MP-mp-1223274.cif,True,,data/final/MP/graphs/Bi1F0.4La1S2O0.6-MP-mp-1223274-synth_doped.json,0,True,-42m,0,0,0,0,6,0,0,1,0,0,0,1.0,False
Ba1Bi0.1Pb0.9O3,2,0.0399999999999999,2.0,False,Ba2Bi0.2Pb1.8O6,Ba2Pb2O6,2.91,Oxide,True,Ba20Bi2Pb18O60,Ba-Bi-Pb-O,4,Supercon,Ba1Pb0.9Bi0.1O3,MP-mp-22230,Ba2Pb2O6,Ba-Pb-O,Ba20Pb20O60,I m m a,orthorhombic,6.133862002250079,6.155866510000001,6.155866509646406,data/final/MP/cifs/Ba1Bi0.1Pb0.9O3-MP-mp-22230-synth_doped.cif,data/source/MP/raw/cifs/mp-22230.cif,mp-22230,0.2093999999999996,,2014-02-21 02:34:22,7.878976238337828,10.17188/1197446,"@misc{osti_1197446,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BaPbO3 (SG:74) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197446"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677620'}},0.0,2.99294363,520.0,-57.91751158,-5.791751158,"{'tags': ['Barium plumbate(IV)', 'Barium lead oxide', 'Barium plumbate', 'Barium lead(IV) oxide']}",-57.91751158,-5.791751158,-2.1088509750000006,"['xas', 'bandstructure']",True,"[252031, 94313, 154038, 245600, 51657, 94312, 245601, 78681, 154039, 15933, 67811, 245602]",True,2021-05-12 10:56:59.077000,NM,10,7,mp-22230,oxide,BaPbO3,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Pb_d', 'O'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Pb': 1.0, 'O': 3.0}",GGA,mp-22230,"['mp-547522', 'mp-22230', 'mp-1078282', 'mp-1437547', 'mp-1677620', 'mp-1828697', 'mp-1589590']",5.66e-05,"{'Ba': 2.0, 'Pb': 2.0, 'O': 6.0}",165.45383803885784,[],NM,False,74,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.841787494431788e-07,5.66e-05,0,0.0001132,MP,data/source/MP/cleaned/cifs/MP-mp-22230.cif,True,,data/final/MP/graphs/Ba1Bi0.1Pb0.9O3-MP-mp-22230-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,0,1,0,0.5,False
N0.99Ti1,2,0.0050251256281407,1.0,True,N0.99Ti1,N1Ti1,4.38,Other,True,N49.749Ti50.251,N-Ti,2,Supercon,N0.99Ti1,MP-mp-492,Ti1N1,N-Ti,N50Ti50,F m -3 m,cubic,3.00770274,3.00770274,3.00770274,data/final/MP/cifs/N0.99Ti1-MP-mp-492-synth_doped.cif,data/source/MP/raw/cifs/mp-492.cif,mp-492,0.0,,2011-05-12 17:28:04,5.340297482734746,10.17188/1208488,"@misc{osti_1208488,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TiN (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208488"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1674200'}},0.0,9.09773138,520.0,-19.66499517,-9.832497585,"{'tags': ['Titanium nitride', 'Titanium nitride (1/1)', 'Titanium(III) nitride', 'Titanium nitride - B1', 'Osbornite']}",-19.66499517,-9.832497585,-1.897004114166668,"['xas', 'elasticity', 'bandstructure']",True,"[26947, 192040, 181787, 644778, 64905, 64909, 183415, 236802, 105128, 184916, 644774, 644770, 644780, 644768, 644783, 186008, 152807, 187188, 644777, 644772, 644781, 64904, 656836, 604220, 236801, 644769, 644775, 644776, 186382, 658338, 601248, 644779, 64908, 64907]",True,2021-05-12 10:56:20.740000,NM,2,42,mp-492,,TiN,"{'functional': 'PBE', 'labels': ['Ti_pv', 'N'], 'pot_type': 'paw'}","{'Ti': 1.0, 'N': 1.0}",GGA,mp-492,"['mp-1000437', 'mp-1006912', 'mvc-13876', 'mp-492', 'mp-1057172', 'mp-1057185', 'mp-1057208', 'mp-1058302', 'mp-1058334', 'mp-1058311', 'mp-1058844', 'mp-1058812', 'mp-1058719', 'mp-1058731', 'mp-1058768', 'mp-1058795', 'mp-1059321', 'mp-1059405', 'mp-1059335', 'mp-1059364', 'mp-1059371', 'mp-1059381', 'mp-1060451', 'mp-1060512', 'mp-1060469', 'mp-1061088', 'mp-1061064', 'mp-1061129', 'mp-1440637', 'mp-1674200', 'mp-1793307', 'mp-1011627', 'mp-1595453', 'mp-1594449', 'mp-1058832', 'mp-1061120', 'mp-1057200', 'mp-1058325', 'mp-1059400', 'mp-1058755', 'mp-1060496', 'mp-1059351']",0.0002595,"{'Ti': 1.0, 'N': 1.0}",19.23932072646892,[],NM,False,225,0,"[0, 0]",1.3488002185180434e-05,0.0002595,0,0.0002595,MP,data/source/MP/cleaned/cifs/MP-mp-492.cif,True,,data/final/MP/graphs/N0.99Ti1-MP-mp-492-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Bi1F0.5La0.9S2Sm0.1O0.5,2,0.0399999999999999,2.0,False,Bi2F1La1.8S4Sm0.2O1,Bi2F1La2S4O1,2.93,Oxide,True,Bi20F10La18S40Sm2O10,Bi-F-La-S-Sm-O,6,Supercon,La0.9Sm0.1Bi1S2F0.5O0.5,MP-mp-1223274,La2Bi2S4O1F1,Bi-F-La-S-O,Bi20F10La20S40O10,P -4 m 2,tetragonal,4.109577,4.109577,13.150136,data/final/MP/cifs/Bi1F0.5La0.9S2Sm0.1O0.5-MP-mp-1223274-synth_doped.cif,data/source/MP/raw/cifs/mp-1223274.cif,mp-1223274,0.0,,2019-01-12 23:41:28.903000,6.422922901673022,,,{'GGA': {'task_id': 'mp-1744170'}},0.0471324534999961,7.2695309,520.0,-59.26664004,-5.926664004,{'tags': []},-59.26664004,-5.926664004,-2.137031777,[],False,[],True,2021-05-12 11:00:52.054000,NM,10,4,mp-1223274,oxide,La2Bi2S4OF,"{'functional': 'PBE', 'labels': ['La', 'Bi', 'S', 'O', 'F'], 'pot_type': 'paw'}","{'La': 2.0, 'Bi': 2.0, 'S': 4.0, 'O': 1.0, 'F': 1.0}",GGA,mp-1223274,"['mp-1223274', 'mp-1388342', 'mp-1744170', 'mp-1861685']",0.0001151,"{'La': 2.0, 'Bi': 2.0, 'S': 4.0, 'O': 1.0, 'F': 1.0}",222.0876908666605,[],NM,False,115,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.182637522630872e-07,0.0001151,0,0.0001151,MP,data/source/MP/cleaned/cifs/MP-mp-1223274.cif,True,,data/final/MP/graphs/Bi1F0.5La0.9S2Sm0.1O0.5-MP-mp-1223274-synth_doped.json,0,True,-42m,0,0,0,0,6,0,0,1,0,0,0,1.0,False
As2Ba0.5Fe1.8K0.5Ni0.2,3,0.0799999999999999,2.0,False,As4Ba1Fe3.6K1Ni0.4,As4Ba1Fe4K1,11.1,Ferrite,True,As40Ba10Fe36K10Ni4,As-Ba-Fe-K-Ni,5,Supercon,Ba0.5K0.5Fe1.8Ni0.2As2,MP-mp-1223517,K1Ba1Fe4As4,As-Ba-Fe-K,As40Ba10Fe40K10,C m m m,orthorhombic,5.479027,5.480024002658328,7.13170472,data/final/MP/cifs/As2Ba0.5Fe1.8K0.5Ni0.2-MP-mp-1223517-synth_doped.cif,data/source/MP/raw/cifs/mp-1223517.cif,mp-1223517,0.0,,2019-01-12 23:54:03.876000,5.87534599912672,,,{'GGA': {'task_id': 'mp-1743010'}},0.0132513644999994,4.21185628,520.0,-59.66633886,-5.966633886,{'tags': []},-59.66633886,-5.966633886,-0.4120461663000007,[],False,[],True,2021-05-12 11:00:52.054000,FM,10,4,mp-1223517,,KBa(FeAs)4,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",GGA,mp-1223517,"['mp-1223517', 'mp-1396881', 'mp-1743010', 'mp-1827585']",0.9947188,"{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",197.6961518155852,[],FM,True,65,1,"[0.0, 0.0, 0.3, 0.3, 0.3, 0.3, 0.0, 0.0, 0.0, 0.0]",0.0050315536790412,0.9947188,4,0.9947188,MP,data/source/MP/cleaned/cifs/MP-mp-1223517.cif,True,,data/final/MP/graphs/As2Ba0.5Fe1.8K0.5Ni0.2-MP-mp-1223517-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
As2Fe1.84Pt0.16Sr1,3,0.0639999999999999,1.0,True,As2Fe1.84Pt0.16Sr1,As2Fe2Sr1,16.0,Ferrite,True,As40Fe36.8Pt3.2Sr20,As-Fe-Pt-Sr,4,Supercon,Sr1Fe1.84Pt0.16As2,MP-mp-4488,Sr1Fe2As2,As-Fe-Sr,As40Fe40Sr20,I 4/m m m,tetragonal,3.9729799997357778,3.9729799997357778,6.45523327,data/final/MP/cifs/As2Fe1.84Pt0.16Sr1-MP-mp-4488-synth_doped.cif,data/source/MP/raw/cifs/mp-4488.cif,mp-4488,0.0,,2011-05-13 03:37:13,6.319998834487784,10.17188/1208187,"@misc{osti_1208187,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr(FeAs)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208187"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672865'}},0.0,5.13397273,520.0,-30.61898897,-6.123797794,"{'tags': ['Strontium diiron arsenide - HT', 'Strontium diiron arsenide', 'Strontium diiron diarsenide', 'Iron strontium arsenide (2/1/2)', 'Strontium diiron arsenide - LT']}",-30.61898897,-6.123797794,-0.5342483613333335,"['xas', 'elasticity', 'bandstructure']",True,"[182330, 181993, 610527, 163209, 163208, 163869]",True,2021-05-12 10:56:20.740000,NM,5,8,mp-4488,,Sr(FeAs)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Fe': 2.0, 'As': 2.0}",GGA,mp-4488,"['mp-906356', 'mp-920135', 'mp-919110', 'mp-4488', 'mp-1439153', 'mp-1672865', 'mp-1873948', 'mp-1592272']",0.0029206,"{'Sr': 1.0, 'Fe': 2.0, 'As': 2.0}",91.7377588211838,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",3.183640016422098e-05,0.0029206,0,0.0029206,MP,data/source/MP/cleaned/cifs/MP-mp-4488.cif,True,,data/final/MP/graphs/As2Fe1.84Pt0.16Sr1-MP-mp-4488-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ca1Rh1.2Sn4.5,2,0.0432835820895522,5.777759259259259,False,Ca5.778Rh6.933Sn26,Ca6Rh8Sn26,8.7,Other,True,Ca14.925Rh17.91Sn67.164,Ca-Rh-Sn,3,Supercon,Ca1Rh1.2Sn4.5,MP-mp-4363,Ca6Sn26Rh8,Ca-Rh-Sn,Ca15Rh20Sn65,P m -3 n,cubic,9.84313,9.84313,9.84313,data/final/MP/cifs/Ca1Rh1.2Sn4.5-MP-mp-4363-synth_doped.cif,data/source/MP/raw/cifs/mp-4363.cif,mp-4363,0.0,,2014-02-15 18:49:13,7.226292400553128,10.17188/1208100,"@misc{osti_1208100,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ca3Sn13Rh4 (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208100"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-941135'}},0.0,7.48134851,520.0,-195.3182753,-4.8829568825,"{'tags': ['Calcium rhodium stannide (3/4/13)', 'Calcium rhodium tin (3/4/13)']}",-195.3182753,-4.8829568825,-0.5030336207499999,"['xas', 'bandstructure']",True,"[619526, 58930, 58931, 58932]",True,2021-05-12 10:57:08.928000,NM,40,5,mp-4363,,Ca3Sn13Rh4,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Sn_d', 'Rh_pv'], 'pot_type': 'paw'}","{'Ca': 3.0, 'Sn': 13.0, 'Rh': 4.0}",GGA,mp-4363,"['mp-934615', 'mp-941514', 'mp-941135', 'mp-4363', 'mp-1345428']",0.0015042,"{'Ca': 6.0, 'Sn': 26.0, 'Rh': 8.0}",953.6733856191524,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.15453911723337e-06,0.0015042,0,0.0030084,MP,data/source/MP/cleaned/cifs/MP-mp-4363.cif,True,,data/final/MP/graphs/Ca1Rh1.2Sn4.5-MP-mp-4363-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
B2C1Fe0.01Ho1Ni1.99,2,0.0033333333333333,1.0,True,B2C1Fe0.01Ho1Ni1.99,B2C1Ho1Ni2,7.0,Other,True,B33.333C16.667Fe0.167Ho16.667Ni33.167,B-C-Fe-Ho-Ni,5,Supercon,Ho1Ni1.99Fe0.01B2C1,MP-mp-6646,Ho1Ni2B2C1,B-C-Ho-Ni,B33.333C16.667Ho16.667Ni33.333,I 4/m m m,tetragonal,3.529863997734658,3.529863997734658,5.76032203,data/final/MP/cifs/B2C1Fe0.01Ho1Ni1.99-MP-mp-6646-synth_doped.cif,data/source/MP/raw/cifs/mp-6646.cif,mp-6646,0.0,,2011-05-13 04:24:09,8.11075125231065,10.17188/1281460,"@misc{osti_1281460,
    author = ""Persson, Kristin"",
    title = ""Materials Data on HoNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281460"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1670774'}},0.0,6.70981387,520.0,-41.84364575,-6.973940958333333,{'tags': ['Holmium dinickel diboride carbide']},-41.84364575,-6.973940958333333,-0.5192332130555558,"['xas', 'elasticity', 'bandstructure']",True,"[79064, 56650, 79065, 79062, 79063, 79575]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-6646,,HoNi2B2C,"{'functional': 'PBE', 'labels': ['Ho_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Ho': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6646,"['mp-1007146', 'mp-6646', 'mp-1000682', 'mp-1439301', 'mp-1670774', 'mp-1782657', 'mp-1011887', 'mp-1589032']",0.0032459,"{'Ho': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",64.68537905730652,[],NM,False,139,0,"[0.0, -0.0, -0.0, 0.0, 0.0, 0.0]",5.017980952271099e-05,0.0032459,0,0.0032459,MP,data/source/MP/cleaned/cifs/MP-mp-6646.cif,True,,data/final/MP/graphs/B2C1Fe0.01Ho1Ni1.99-MP-mp-6646-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Be2Nb3,1,0.0,2.0,False,Be4Nb6,Be4Nb6,2.3,Other,True,Be40Nb60,Be-Nb,2,Supercon,Be2Nb3,MP-mp-11272,Be4Nb6,Be-Nb,Be40Nb60,P 4/m b m,tetragonal,3.364092,6.538072,6.538072,data/final/MP/cifs/Be2Nb3-MP-mp-11272.cif,data/source/MP/raw/cifs/mp-11272.cif,mp-11272,0.0,,2011-05-29 14:17:15,6.853194405890619,10.17188/1187694,"@misc{osti_1187694,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Be2Nb3 (SG:127) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187694"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688286'}},0.0,4.15189219,520.0,-76.91424098,-7.691424098000001,{'tags': ['Beryllium niobium (2/3)']},-76.91424098,-7.691424098000001,-0.134875928000001,"['xas', 'elasticity', 'bandstructure']",True,[58722],True,2021-05-12 10:56:10.715000,NM,10,8,mp-11272,,Be2Nb3,"{'functional': 'PBE', 'labels': ['Be_sv', 'Nb_pv'], 'pot_type': 'paw'}","{'Be': 2.0, 'Nb': 3.0}",GGA,mp-11272,"['mp-11272', 'mp-912104', 'mp-928137', 'mp-928781', 'mp-1300767', 'mp-1688286', 'mp-1860689', 'mp-1599766']",0.00016045,"{'Be': 4.0, 'Nb': 6.0}",143.80277341271088,[],NM,False,127,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.2315285886665333e-06,0.00016045,0,0.0003209,MP,data/source/MP/cleaned/cifs/MP-mp-11272.cif,False,,data/final/MP/graphs/Be2Nb3-MP-mp-11272.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ba2Cu4Pr0.9Y0.1O8,2,0.0133333333333333,1.0,True,Ba2Cu4Pr0.9Y0.1O8,Ba2Cu4Pr1O8,0.0,Cuprate,True,Ba13.333Cu26.667Pr6Y0.667O53.333333333333336,Ba-Cu-Pr-Y-O,5,Supercon,Y0.1Pr0.9Ba2Cu4O8,MP-mp-6779,Ba2Pr1Cu4O8,Ba-Cu-Pr-O,Ba13.333Cu26.667Pr6.667O53.333333333333336,C m m m,orthorhombic,3.929110001624248,3.949708,13.95458511,data/final/MP/cifs/Ba2Cu4Pr0.9Y0.1O8-MP-mp-6779-synth_doped.cif,data/source/MP/raw/cifs/mp-6779.cif,mp-6779,0.0,,2011-05-16 04:48:00,6.178482380811956,10.17188/1283406,"@misc{osti_1283406,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Pr(CuO2)4 (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1283406"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1676400'}},0.0,3.2175718,520.0,-89.48122933,-5.965415288666667,"{'tags': ['Praseodymium barium copper oxide (1/2/4/8)', 'Praseodymium dibarium tricopper copper(III) oxide', 'Praseodymium dibarium tetracopper octaoxide']}",-89.48122933,-5.965415288666667,-2.025191587000001,"['xas', 'bandstructure']",True,"[75850, 75815, 90748, 87940, 90757]",True,2021-05-12 10:57:34.594000,NM,15,8,mp-6779,oxide,Ba2Pr(CuO2)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Pr_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Pr': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-6779,"['mp-1000699', 'mp-6779', 'mp-1007159', 'mp-1381422', 'mp-1676400', 'mp-1835392', 'mp-1011903', 'mp-1598918']",0.0021731,"{'Ba': 2.0, 'Pr': 1.0, 'Cu': 4.0, 'O': 8.0}",214.40214033168536,[],NM,False,65,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",1.0135626429093296e-05,0.0021731,0,0.0021731,MP,data/source/MP/cleaned/cifs/MP-mp-6779.cif,True,,data/final/MP/graphs/Ba2Cu4Pr0.9Y0.1O8-MP-mp-6779-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Bi1Li3,1,0.0,1.0,True,Bi1Li3,Bi1Li3,0.0,Other,True,Bi25Li75,Bi-Li,2,Supercon,Bi1Li3,MP-mp-23222,Li3Bi1,Bi-Li,Bi25Li75,F m -3 m,cubic,4.76371475,4.76371475,4.76371475,data/final/MP/cifs/Bi1Li3-MP-mp-23222.cif,data/source/MP/raw/cifs/mp-23222.cif,mp-23222,0.3798999999999997,,2014-02-21 07:23:23,4.99210029486996,10.17188/1199341,"@misc{osti_1199341,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Li3Bi (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199341"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699250'}},0.0,2.94117106,520.0,-11.73482585,-2.9337064625,"{'tags': ['Bismuth lithium (1/3)', 'Bismuth lithium (3/1)']}",-11.73482585,-2.9337064625,-0.5295057349999999,"['xas', 'bandstructure', 'diel', 'phonons', 'elasticity']",True,"[58797, 616778]",True,2021-05-12 10:56:16.728000,NM,4,8,mp-23222,,Li3Bi,"{'functional': 'PBE', 'labels': ['Li_sv', 'Bi'], 'pot_type': 'paw'}","{'Li': 3.0, 'Bi': 1.0}",GGA,mp-23222,"['mp-941113', 'mp-941421', 'mp-934592', 'mp-23222', 'mp-1140502', 'mp-1438852', 'mp-1699250', 'mp-1799929']",0.0018188,"{'Li': 3.0, 'Bi': 1.0}",76.4402757952696,[],NM,False,225,0,"[0, 0, 0, 0]",2.379373937466293e-05,0.0018188,0,0.0018188,MP,data/source/MP/cleaned/cifs/MP-mp-23222.cif,False,,data/final/MP/graphs/Bi1Li3-MP-mp-23222.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
B0.86Ba0.14,2,0.0057142857142857,7.0,False,B6.02Ba0.98,B6Ba1,0.0,Other,True,B86Ba14,B-Ba,2,Supercon,B0.86Ba0.14,MP-mp-954,Ba1B6,B-Ba,B85.714Ba14.286,P m -3 m,cubic,4.280126,4.280126,4.280126,data/final/MP/cifs/B0.86Ba0.14-MP-mp-954-synth_doped.cif,data/source/MP/raw/cifs/mp-954.cif,mp-954,0.0623000000000004,,2011-05-12 19:59:40,4.281989037924458,10.17188/1313319,"@misc{osti_1313319,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BaB6 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1313319"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1673398'}},0.0,4.18823747,520.0,-44.8651221,-6.409303157142857,"{'tags': ['Barium octahedro-hexaboride', 'Barium hexaboride', 'Barium octahedro-hexaboride (1/1)', 'Barium boride (1/6)']}",-44.8651221,-6.409303157142857,-0.4099715207142854,"['xas', 'bandstructure']",True,"[196518, 194634, 76124, 659483, 612529, 51495, 612527]",True,2021-05-12 10:57:55.580000,NM,7,10,mp-954,,BaB6,"{'functional': 'PBE', 'labels': ['Ba_sv', 'B'], 'pot_type': 'paw'}","{'Ba': 1.0, 'B': 6.0}",GGA,mp-954,"['mp-658246', 'mp-663033', 'mp-678181', 'mp-954', 'mp-1077832', 'mp-1077848', 'mp-1439800', 'mp-1673398', 'mp-1801524', 'mp-1595856']",5.7e-06,"{'Ba': 1.0, 'B': 6.0}",78.40967655904984,[],NM,False,221,0,"[0, 0, 0, 0, 0, 0, 0]",7.269510920259141e-08,5.7e-06,0,5.7e-06,MP,data/source/MP/cleaned/cifs/MP-mp-954.cif,True,,data/final/MP/graphs/B0.86Ba0.14-MP-mp-954-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Al0.975Nb3Si0.025,2,0.0125,2.0,False,Al1.95Nb6Si0.05,Al2Nb6,18.5,Other,True,Al24.375Nb75Si0.625,Al-Nb-Si,3,Supercon,Nb3Al0.975Si0.025,MP-mp-796,Nb6Al2,Al-Nb,Al25Nb75,P m -3 n,cubic,5.215254,5.215254,5.215254,data/final/MP/cifs/Al0.975Nb3Si0.025-MP-mp-796-synth_doped.cif,data/source/MP/raw/cifs/mp-796.cif,mp-796,0.0,,2011-05-13 16:07:37,7.157298025966356,,,{'GGA': {'task_id': 'mp-1686893'}},0.0460773865000003,5.52947534,520.0,-69.48918494,-8.6861481175,"{'tags': ['Aluminium niobium (1/3)', 'Niobium aluminide (3/1)', 'Aluminum niobium (1/3)']}",-69.48918494,-8.6861481175,-0.1737753800000003,"['bandstructure', 'elasticity']",True,"[608675, 608654, 608688, 608668, 608669, 608685, 608676, 608683, 58014, 608657, 107856, 608655, 608666, 608691, 608656, 608665, 608673, 608653, 608661]",True,2021-05-12 10:56:31.128000,NM,8,10,mp-796,,Nb3Al,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Al': 1.0}",GGA,mp-796,"['mp-911586', 'mp-927906', 'mp-796', 'mp-927472', 'mp-1260512', 'mp-1440919', 'mp-1686893', 'mp-1927652', 'mp-1591599', 'mp-1587739']",0.16323955,"{'Nb': 6.0, 'Al': 2.0}",141.8490379078192,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0023015954483396,0.16323955,0,0.3264791,MP,data/source/MP/cleaned/cifs/MP-mp-796.cif,True,,data/final/MP/graphs/Al0.975Nb3Si0.025-MP-mp-796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
As2Ba0.816Fe2K0.184,3,0.0597333333333333,3.0,False,As6Ba2.448Fe6K0.552,As6Ba2Fe6K1,12.0,Ferrite,True,As40Ba16.32Fe40K3.68,As-Ba-Fe-K,4,Supercon,Ba0.816K0.184Fe2As2,MP-mp-1223567,K1Ba2Fe6As6,As-Ba-Fe-K,As40Ba13.333Fe40K6.667,C 1 2/m 1,monoclinic,5.48060788,7.102799640000001,8.784942288492543,data/final/MP/cifs/As2Ba0.816Fe2K0.184-MP-mp-1223567-synth_doped.cif,data/source/MP/raw/cifs/mp-1223567.cif,mp-1223567,0.0,,2019-01-12 23:56:38.667000,6.101417464045543,,,,0.0186882046666676,4.38014394,520.0,-90.51509253,-6.034339502,{'tags': []},-90.51509253,-6.034339502,-0.4527993862000007,[],False,[],True,2021-05-12 11:00:52.054000,FM,15,4,mp-1223567,,KBa2(FeAs)6,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 2.0, 'Fe': 6.0, 'As': 6.0}",GGA,mp-1223567,"['mp-1223567', 'mp-1374097', 'mp-1656306', 'mp-1808539']",1.3326448,"{'K': 1.0, 'Ba': 2.0, 'Fe': 6.0, 'As': 6.0}",298.92336486922324,[],FM,True,12,2,"[0.0, 0.0, 0.0, 0.3, 0.3, 0.1, 0.3, 0.1, 0.3, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0044581486649028,1.3326448,6,1.3326448,MP,data/source/MP/cleaned/cifs/MP-mp-1223567.cif,True,,data/final/MP/graphs/As2Ba0.816Fe2K0.184-MP-mp-1223567-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
Mo1Si2,1,0.0,1.0,True,Mo1Si2,Mo1Si2,0.0,Other,True,Mo33.333Si66.667,Mo-Si,2,Supercon,Mo1Si2,MP-mp-2592,Si2Mo1,Mo-Si,Mo33.333Si66.667,I 4/m m m,tetragonal,3.220376003200851,3.220376003200851,4.54597254,data/final/MP/cifs/Mo1Si2-MP-mp-2592.cif,data/source/MP/raw/cifs/mp-2592.cif,mp-2592,0.0,,2011-05-12 18:50:43,6.190200108190454,10.17188/1201077,"@misc{osti_1201077,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Si2Mo (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201077"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668680'}},0.0,10.58156186,520.0,-23.19117503,-7.730391676666667,"{'tags': ['Molybdenum silicide (1/2)', 'Molybdenum silicide - alpha']}",-23.19117503,-7.730391676666667,-0.4983013199999995,"['xas', 'elasticity', 'bandstructure']",True,"[644411, 71500, 73598, 96023, 644425, 644400, 168744, 26868, 644420, 105092, 182115, 644422, 85756, 191611]",True,2021-05-12 10:56:18.721000,NM,3,16,mp-2592,,Si2Mo,"{'functional': 'PBE', 'labels': ['Si', 'Mo_pv'], 'pot_type': 'paw'}","{'Si': 2.0, 'Mo': 1.0}",GGA,mp-2592,"['mp-922806', 'mp-908457', 'mp-923568', 'mp-2592', 'mp-1063241', 'mp-1063267', 'mp-1063300', 'mp-1124917', 'mp-1133355', 'mp-1267801', 'mp-1440815', 'mp-1668680', 'mp-1791246', 'mp-1588271', 'mp-1595065', 'mp-1063284']",0.0001386,"{'Si': 2.0, 'Mo': 1.0}",40.80421529917708,[],NM,False,139,0,"[0, 0, 0]",3.396707888726272e-06,0.0001386,0,0.0001386,MP,data/source/MP/cleaned/cifs/MP-mp-2592.cif,False,,data/final/MP/graphs/Mo1Si2-MP-mp-2592.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B1.938C0.062Mg1,2,0.0413333333333333,1.0,True,B1.938C0.062Mg1,B2Mg1,37.0,Other,True,B64.6C2.067Mg33.333,B-C-Mg,3,Supercon,Mg1B1.938C0.062,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B1.938C0.062Mg1-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B1.938C0.062Mg1-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
B2Ir0.02Mg0.98,2,0.0133333333333333,1.0,True,B2Ir0.02Mg0.98,B2Mg1,33.2,Other,True,B66.667Ir0.667Mg32.667,B-Ir-Mg,3,Supercon,Mg0.98Ir0.02B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B2Ir0.02Mg0.98-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B2Ir0.02Mg0.98-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Cu2Gd1La0.2Ru1Sr1.8O8,3,0.0285714285714285,2.0,False,Cu4Gd2La0.4Ru2Sr3.6O16,Cu4Gd2Ru2Sr4O16,0.0,Cuprate,True,Cu14.286Gd7.143La1.429Ru7.143Sr12.857O57.142857142857146,Cu-Gd-La-Ru-Sr-O,6,Supercon,Ru1Sr1.8La0.2Gd1Cu2O8,MP-mp-1194240,Sr4Gd2Cu4Ru2O16,Cu-Gd-Ru-Sr-O,Cu14.286Gd7.143Ru7.143Sr14.286O57.142857142857146,P 4/m b m,tetragonal,5.472451,5.472451,11.740702,data/final/MP/cifs/Cu2Gd1La0.2Ru1Sr1.8O8-MP-mp-1194240-synth_doped.cif,data/source/MP/raw/cifs/mp-1194240.cif,mp-1194240,0.0,,2019-01-11 23:51:58.932000,6.504561898971391,,,{'GGA': {'task_id': 'mp-1765260'}},0.0213449239285443,3.93502801,520.0,-201.55352223,-7.198340079642857,"{'tags': ['Sr2Cu2GdRuO8 orth', 'Sr2Cu2GdRuO8', 'Ruthenium distrontium gadolinium dicopper octaoxide']}",-201.55352223,-7.198340079642857,-2.268654352380952,['bandstructure'],True,[245741],True,2021-05-12 10:58:35.561000,FiM,28,6,mp-1194240,oxide,Sr2GdCu2RuO8,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Gd', 'Cu_pv', 'Ru_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Gd': 1.0, 'Cu': 2.0, 'Ru': 1.0, 'O': 8.0}",GGA,mp-1194240,"['mp-1194240', 'mp-1396976', 'mp-1659973', 'mp-1765260', 'mp-1841948', 'mp-1638264']",4.23696715,"{'Sr': 4.0, 'Gd': 2.0, 'Cu': 4.0, 'Ru': 2.0, 'O': 16.0}",351.6072554818909,[],FiM,True,127,2,"[-0.0, -0.0, -0.0, -0.0, 6.9, 6.9, 0.0, 0.0, 0.0, 0.0, -1.8, -1.8, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0241005672319991,4.23696715,4,8.4739343,MP,data/source/MP/cleaned/cifs/MP-mp-1194240.cif,True,,data/final/MP/graphs/Cu2Gd1La0.2Ru1Sr1.8O8-MP-mp-1194240-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Fe1Se0.93,2,0.0362694300518134,2.0,False,Fe2Se1.86,Fe2Se2,7.0,Ferrite,True,Fe51.813Se48.187,Fe-Se,2,Supercon,Fe1Se0.93,MP-mp-20311,Fe2Se2,Fe-Se,Fe50Se50,P 4/n m m,tetragonal,3.688905,3.688905,5.854194,data/final/MP/cifs/Fe1Se0.93-MP-mp-20311-synth_doped.cif,data/source/MP/raw/cifs/mp-20311.cif,mp-20311,0.0,,2013-10-20 07:09:24,5.619828229873189,10.17188/1195438,"@misc{osti_1195438,
    author = ""Persson, Kristin"",
    title = ""Materials Data on FeSe (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195438"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668877'}},0.0,3.48880228,520.0,-25.01949237,-6.2548730925,"{'tags': ['Iron selenide - NN AFM', 'Iron selenide - orthorhombic, LT', 'Iron selenide', 'Iron sulfide', 'Iron selenide (1/1) - nonmagnetic', 'Iron selenide - tetragonal', 'Iron selenide - alpha LT', 'Iron selenide - LT', 'High pressure experimental phase', 'Iron selenide - alpha']}",-25.01949237,-6.2548730925,-0.5079131286718743,"['xas', 'elasticity', 'bandstructure']",True,"[196301, 196298, 196299, 196297, 290701, 165958, 185464, 163561, 169257, 163560, 977900, 169311, 169303, 26889, 166440, 162901, 169283, 165957, 169271, 977903, 169259, 977901, 185465, 165959, 169306, 169267, 163557, 169287, 169297, 169289, 163556, 169299, 163562, 166441, 182544, 163559, 169269, 169263, 169265, 169315, 169255, 166439, 169293, 169313, 163555, 169291, 169301, 165960, 169253, 169295, 169970, 163558, 169285, 169261, 169309]",True,2021-05-12 10:56:14.760000,NM,4,55,mp-20311,,FeSe,"{'functional': 'PBE', 'labels': ['Fe_pv', 'Se'], 'pot_type': 'paw'}","{'Fe': 1.0, 'Se': 1.0}",GGA,mp-20311,"['mp-684656', 'mp-20311', 'mp-1063646', 'mp-1063662', 'mp-1063681', 'mp-1063669', 'mp-1063680', 'mp-1063695', 'mp-1063686', 'mp-1063699', 'mp-1063715', 'mp-1063717', 'mp-1063876', 'mp-1063734', 'mp-1063891', 'mp-1063735', 'mp-1063910', 'mp-1063918', 'mp-1063922', 'mp-1063931', 'mp-1063774', 'mp-1063781', 'mp-1064091', 'mp-1064111', 'mp-1063801', 'mp-1064112', 'mp-1064180', 'mp-1064138', 'mp-1064153', 'mp-1065102', 'mp-1065123', 'mp-1065075', 'mp-1065161', 'mp-1065131', 'mp-1065030', 'mp-1065055', 'mp-1065085', 'mp-1065094', 'mp-1440814', 'mp-1668877', 'mp-1799618', 'mp-1593782', 'mp-1592730', 'mp-1065081', 'mp-1065148', 'mp-1063928', 'mp-1063726', 'mp-1063683', 'mp-1063709', 'mp-1063911', 'mp-1063795', 'mp-1065121', 'mp-1063725', 'mp-1064139', 'mp-1064165']",3.455e-05,"{'Fe': 2.0, 'Se': 2.0}",79.66398961559156,[],NM,False,129,0,"[0, 0, 0, 0]",8.673931638803586e-07,3.455e-05,0,6.91e-05,MP,data/source/MP/cleaned/cifs/MP-mp-20311.cif,True,,data/final/MP/graphs/Fe1Se0.93-MP-mp-20311-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B4Dy1Ir2Rh2,1,0.0,2.0,False,B8Dy2Ir4Rh4,B8Dy2Ir4Rh4,4.585,Other,True,B44.444Dy11.111Ir22.222Rh22.222,B-Dy-Ir-Rh,4,Supercon,Dy1Ir2Rh2B4,MP-mp-1225314,Dy2B8Ir4Rh4,B-Dy-Ir-Rh,B44.444Dy11.111Ir22.222Rh22.222,P 42 m c,tetragonal,5.380172,5.380172,7.473099,data/final/MP/cifs/B4Dy1Ir2Rh2-MP-mp-1225314.cif,data/source/MP/raw/cifs/mp-1225314.cif,mp-1225314,0.0,,2019-01-13 01:26:36.713000,12.2206161679737,,,,0.0217950077777944,7.5505995,520.0,-137.51779006,-7.639877225555556,{'tags': []},-137.51779006,-7.639877225555556,-0.5587849474074074,[],False,[],True,2021-05-12 11:00:54.298000,NM,18,3,mp-1225314,,DyB4(IrRh)2,"{'functional': 'PBE', 'labels': ['Dy_3', 'B', 'Ir', 'Rh_pv'], 'pot_type': 'paw'}","{'Dy': 1.0, 'B': 4.0, 'Ir': 2.0, 'Rh': 2.0}",GGA,mp-1225314,"['mp-1225314', 'mp-1375365', 'mp-1831354']",0.00098255,"{'Dy': 2.0, 'B': 8.0, 'Ir': 4.0, 'Rh': 4.0}",216.31819753046543,[],NM,False,105,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",9.084302765250448e-06,0.00098255,0,0.0019651,MP,data/source/MP/cleaned/cifs/MP-mp-1225314.cif,False,,data/final/MP/graphs/B4Dy1Ir2Rh2-MP-mp-1225314.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
Au0.388Ga0.612,3,0.1093333333333333,3.0,False,Au1.164Ga1.836,Au1Ga2,1.355,Other,True,Au38.8Ga61.2,Au-Ga,2,Supercon,Au0.388Ga0.612,MP-mp-2776,Ga2Au1,Au-Ga,Au33.333Ga66.667,F m -3 m,cubic,4.40327555,4.40327555,4.40327555,data/final/MP/cifs/Au0.388Ga0.612-MP-mp-2776-synth_doped.cif,data/source/MP/raw/cifs/mp-2776.cif,mp-2776,0.0,,2011-05-12 21:57:19,9.253557284351938,10.17188/1201942,"@misc{osti_1201942,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ga2Au (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201942"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687524'}},0.0,3.58527429,520.0,-10.04441228,-3.3481374266666664,"{'tags': ['Gold gallium (1/2)', 'Gallium gold (2/1)']}",-10.04441228,-3.3481374266666664,-0.2381128983333328,"['xas', 'elasticity', 'bandstructure']",True,"[611874, 611864, 150958, 58458]",True,2021-05-12 10:56:18.721000,NM,3,8,mp-2776,,Ga2Au,"{'functional': 'PBE', 'labels': ['Ga_d', 'Au'], 'pot_type': 'paw'}","{'Ga': 2.0, 'Au': 1.0}",GGA,mp-2776,"['mp-991379', 'mp-2776', 'mp-993315', 'mp-1439079', 'mp-1687524', 'mp-1795480', 'mp-994626', 'mp-1589089']",0.000866,"{'Ga': 2.0, 'Au': 1.0}",60.36880695215696,[],NM,False,225,0,"[0, 0, 0]",1.4345156774198237e-05,0.000866,0,0.000866,MP,data/source/MP/cleaned/cifs/MP-mp-2776.cif,True,,data/final/MP/graphs/Au0.388Ga0.612-MP-mp-2776-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ge0.29Nb0.71,3,0.08,8.0,False,Ge2.32Nb5.68,Ge2Nb6,6.0,Other,True,Ge29Nb71,Ge-Nb,2,Supercon,Ge0.29Nb0.71,MP-mp-1373,Nb6Ge2,Ge-Nb,Ge25Nb75,P m -3 n,cubic,5.175188,5.175188,5.175188,data/final/MP/cifs/Ge0.29Nb0.71-MP-mp-1373-synth_doped.cif,data/source/MP/raw/cifs/mp-1373.cif,mp-1373,0.0,,2011-05-14 10:04:58,8.418834172896334,10.17188/1189733,"@misc{osti_1189733,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Ge (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189733"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687944'}},0.0536666316666671,5.20674172,520.0,-71.98443657,-8.99805457125,"{'tags': ['Niobium germanide (3/1)', 'Germanium niobium (1/3)']}",-71.98443657,-8.99805457125,-0.2663188274999992,"['xas', 'elasticity', 'bandstructure']",True,"[637197, 637221, 637219, 637190, 637220, 637224, 637204, 637193, 637198, 637223, 26573, 637222, 637214, 53719]",True,2021-05-12 10:56:12.755000,NM,8,9,mp-1373,,Nb3Ge,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Ge_d'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Ge': 1.0}",GGA,mp-1373,"['mp-913712', 'mp-930518', 'mp-930009', 'mp-1373', 'mp-1079804', 'mp-1476243', 'mp-1687944', 'mp-1926238', 'mp-1590510']",0.5080796,"{'Nb': 6.0, 'Ge': 2.0}",138.60483919622226,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0073313399870651,0.5080796,0,1.0161592,MP,data/source/MP/cleaned/cifs/MP-mp-1373.cif,True,,data/final/MP/graphs/Ge0.29Nb0.71-MP-mp-1373-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Mo0.25Tc0.75,1,0.0,4.0,False,Mo1Tc3,Mo1Tc3,15.8,Other,True,Mo25Tc75,Mo-Tc,2,Supercon,Mo0.25Tc0.75,MP-mp-1217419,Tc3Mo1,Mo-Tc,Mo25Tc75,P -6 m 2,hexagonal,2.771946000429626,2.7719463,8.98802,data/final/MP/cifs/Mo0.25Tc0.75-MP-mp-1217419.cif,data/source/MP/raw/cifs/mp-1217419.cif,mp-1217419,0.0,,2019-01-12 18:45:30.956000,10.826364113091092,,,{'GGA': {'task_id': 'mp-1767414'}},0.1035310075000008,8.14973765,520.0,-41.51337873,-10.3783446825,{'tags': []},-41.51337873,-10.3783446825,0.1035310075000008,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,4,5,mp-1217419,,Tc3Mo,"{'functional': 'PBE', 'labels': ['Tc_pv', 'Mo_pv'], 'pot_type': 'paw'}","{'Tc': 3.0, 'Mo': 1.0}",GGA,mp-1217419,"['mp-1217419', 'mp-1413888', 'mp-1767414', 'mp-1790935', 'mp-1615741']",0.0019919,"{'Tc': 3.0, 'Mo': 1.0}",59.80868524891407,[],NM,False,187,0,"[0.0, 0.0, 0.0, 0.0]",3.330452745633907e-05,0.0019919,0,0.0019919,MP,data/source/MP/cleaned/cifs/MP-mp-1217419.cif,False,,data/final/MP/graphs/Mo0.25Tc0.75-MP-mp-1217419.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Cu1Hg1O4.34,2,0.040767386091127,0.9217897465437788,True,Ba1.843Cu0.922Hg0.922O4,Ba2Cu1Hg1O4,59.0,Cuprate,True,Ba23.981Cu11.99Hg11.99O52.038369304556355,Ba-Cu-Hg-O,4,Supercon,Hg1Ba2Cu1O4.34,MP-mp-6562,Ba2Cu1Hg1O4,Ba-Cu-Hg-O,Ba25Cu12.5Hg12.5O50,P 4/m m m,tetragonal,3.933714,3.933714,9.827602,data/final/MP/cifs/Ba2Cu1Hg1O4.34-MP-mp-6562-synth_doped.cif,data/source/MP/raw/cifs/mp-6562.cif,mp-6562,0.0,,2011-05-13 18:18:06,6.582036471328142,10.17188/1281336,"@misc{osti_1281336,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2CuHgO4 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281336"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697135'}},0.0234340381250053,2.58068675,520.0,-40.91481298,-5.1143516225,"{'tags': ['Mercury dibarium copper oxide', 'High pressure experimental phase']}",-40.91481298,-5.1143516225,-1.953767533125,"['xas', 'bandstructure']",True,"[75722, 75720, 75724, 75721, 75723]",True,2021-05-12 10:57:32.679000,NM,8,8,mp-6562,oxide,Ba2CuHgO4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Cu_pv', 'Hg', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",GGA,mp-6562,"['mp-6562', 'mp-990899', 'mp-992892', 'mp-1435690', 'mp-1697135', 'mp-1878488', 'mp-994198', 'mp-1592659']",0.0003984,"{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",152.07335344042525,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0, 0, 0]",2.619788352047311e-06,0.0003984,0,0.0003984,MP,data/source/MP/cleaned/cifs/MP-mp-6562.cif,True,,data/final/MP/graphs/Ba2Cu1Hg1O4.34-MP-mp-6562-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
As1.902Ba1Ni2P0.098,2,0.0392,1.0,True,As1.902Ba1Ni2P0.098,As2Ba1Ni2,0.763,Ferrite,True,As38.04Ba20Ni40P1.96,As-Ba-Ni-P,4,Supercon,Ba1Ni2As1.902P0.098,MP-mp-568280,Ba1Ni2As2,As-Ba-Ni,As40Ba20Ni40,I 4/m m m,tetragonal,4.156554001148825,4.156554001148825,6.57789079,data/final/MP/cifs/As1.902Ba1Ni2P0.098-MP-mp-568280-synth_doped.cif,data/source/MP/raw/cifs/mp-568280.cif,mp-568280,0.0,,2014-02-16 06:02:25,6.607461026403792,10.17188/1274340,"@misc{osti_1274340,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba(NiAs)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1274340"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698065'}},0.0,5.18272169,520.0,-26.07345637,-5.214691274,"{'tags': ['Barium nickel arsenide (1/2/2)', 'Barium dinickel diarsenide']}",-26.07345637,-5.214691274,-0.6551950740000002,"['xas', 'elasticity', 'bandstructure']",True,"[185463, 609856, 164197]",True,2021-05-12 10:56:22.739000,NM,5,10,mp-568280,,Ba(NiAs)2,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ni_pv', 'As'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Ni': 2.0, 'As': 2.0}",GGA,mp-568280,"['mp-568280', 'mp-1069503', 'mp-1069542', 'mp-1069572', 'mp-1441346', 'mp-1698065', 'mp-1795849', 'mp-1923070', 'mp-1595137', 'mp-1069566']",0.0042893,"{'Ba': 1.0, 'Ni': 2.0, 'As': 2.0}",101.67032396892152,[],NM,False,139,0,"[0, 0, 0, 0, 0]",4.218831840558656e-05,0.0042893,0,0.0042893,MP,data/source/MP/cleaned/cifs/MP-mp-568280.cif,True,,data/final/MP/graphs/As1.902Ba1Ni2P0.098-MP-mp-568280-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Bi2Ca1Cu1.98Fe0.02Sr2O8,2,0.0026666666666666,2.0,False,Bi4Ca2Cu3.96Fe0.04Sr4O16,Bi4Ca2Cu4Sr4O16,71.5,Cuprate,True,Bi13.333Ca6.667Cu13.2Fe0.133Sr13.333O53.333333333333336,Bi-Ca-Cu-Fe-Sr-O,6,Supercon,Bi2Sr2Ca1Cu1.98Fe0.02O8,MP-mp-1218930,Sr4Ca2Cu4Bi4O16,Bi-Ca-Cu-Sr-O,Bi13.333Ca6.667Cu13.333Sr13.333O53.333333333333336,C c c 2,orthorhombic,5.417115,5.472898000129128,16.11398919,data/final/MP/cifs/Bi2Ca1Cu1.98Fe0.02Sr2O8-MP-mp-1218930-synth_doped.cif,data/source/MP/raw/cifs/mp-1218930.cif,mp-1218930,0.0,,2019-01-12 20:01:06.544000,6.266668983881059,,,,0.039252223722225,4.51768334,520.0,-173.15021002,-5.771673667333333,{'tags': []},-173.15021002,-5.771673667333333,-2.074956548222222,[],False,[],True,2021-05-12 11:00:42.526000,NM,30,3,mp-1218930,oxide,Sr2CaCu2(BiO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",GGA,mp-1218930,"['mp-1218930', 'mp-1359698', 'mp-1817714']",0.00011165,"{'Sr': 4.0, 'Ca': 2.0, 'Cu': 4.0, 'Bi': 4.0, 'O': 16.0}",470.7976286073367,[],NM,False,37,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.743014544498498e-07,0.00011165,0,0.0002233,MP,data/source/MP/cleaned/cifs/MP-mp-1218930.cif,True,,data/final/MP/graphs/Bi2Ca1Cu1.98Fe0.02Sr2O8-MP-mp-1218930-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Hf1V2,1,0.0,2.0,False,Hf2V4,Hf2V4,8.984,Other,True,Hf33.333V66.667,Hf-V,2,Supercon,Hf1V2,MP-mp-1077017,Hf2V4,Hf-V,Hf33.333V66.667,I 41/a m d,tetragonal,5.147745850539648,5.14774585,5.14774585,data/final/MP/cifs/Hf1V2-MP-mp-1077017.cif,data/source/MP/raw/cifs/mp-1077017.cif,mp-1077017,0.0,,2018-04-07 18:44:03,9.47163160017764,,,{'GGA': {'task_id': 'mp-1759109'}},0.0337706083333326,5.06389256,520.0,-56.04737833,-9.341229721666666,{'tags': ['Hafnium vanadium (1/2)']},-56.04737833,-9.341229721666666,0.033770608333332,['bandstructure'],True,[187951],True,2021-05-12 10:58:14.654000,NM,6,5,mp-1077017,,HfV2,"{'functional': 'PBE', 'labels': ['Hf_pv', 'V_pv'], 'pot_type': 'paw'}","{'Hf': 1.0, 'V': 2.0}",GGA,mp-1077017,"['mp-1077017', 'mp-1391381', 'mp-1759109', 'mp-1796366', 'mp-1627385']",0.03458425,"{'Hf': 2.0, 'V': 4.0}",98.30836742237948,[],NM,False,141,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0007035871087434,0.03458425,0,0.0691685,MP,data/source/MP/cleaned/cifs/MP-mp-1077017.cif,False,,data/final/MP/graphs/Hf1V2-MP-mp-1077017.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Al1Nb2.91Zr0.09,2,0.0449999999999999,2.0,False,Al2Nb5.82Zr0.18,Al2Nb6,14.6,Other,True,Al25Nb72.75Zr2.25,Al-Nb-Zr,3,Supercon,Nb2.91Zr0.09Al1,MP-mp-796,Nb6Al2,Al-Nb,Al25Nb75,P m -3 n,cubic,5.215254,5.215254,5.215254,data/final/MP/cifs/Al1Nb2.91Zr0.09-MP-mp-796-synth_doped.cif,data/source/MP/raw/cifs/mp-796.cif,mp-796,0.0,,2011-05-13 16:07:37,7.157298025966356,,,{'GGA': {'task_id': 'mp-1686893'}},0.0460773865000003,5.52947534,520.0,-69.48918494,-8.6861481175,"{'tags': ['Aluminium niobium (1/3)', 'Niobium aluminide (3/1)', 'Aluminum niobium (1/3)']}",-69.48918494,-8.6861481175,-0.1737753800000003,"['bandstructure', 'elasticity']",True,"[608675, 608654, 608688, 608668, 608669, 608685, 608676, 608683, 58014, 608657, 107856, 608655, 608666, 608691, 608656, 608665, 608673, 608653, 608661]",True,2021-05-12 10:56:31.128000,NM,8,10,mp-796,,Nb3Al,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Al': 1.0}",GGA,mp-796,"['mp-911586', 'mp-927906', 'mp-796', 'mp-927472', 'mp-1260512', 'mp-1440919', 'mp-1686893', 'mp-1927652', 'mp-1591599', 'mp-1587739']",0.16323955,"{'Nb': 6.0, 'Al': 2.0}",141.8490379078192,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0023015954483396,0.16323955,0,0.3264791,MP,data/source/MP/cleaned/cifs/MP-mp-796.cif,True,,data/final/MP/graphs/Al1Nb2.91Zr0.09-MP-mp-796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Cr0.25V0.75,1,0.0,4.0,False,Cr1V3,Cr1V3,1.36,Other,True,Cr25V75,Cr-V,2,Supercon,Cr0.25V0.75,MP-mp-1187695,V3Cr1,Cr-V,Cr25V75,F m -3 m,cubic,4.17713714,4.177137139999999,4.177137139999999,data/final/MP/cifs/Cr0.25V0.75-MP-mp-1187695.cif,data/source/MP/raw/cifs/mp-1187695.cif,mp-1187695,0.0,,2019-01-11 15:16:53.713000,6.599355541507171,,,{'GGA': {'task_id': 'mp-1767813'}},0.0,6.08080562,520.0,-37.01888967,-9.2547224175,{'tags': []},-37.01888967,-9.2547224175,-0.0285309975000007,['bandstructure'],True,[],True,2021-05-12 10:58:31.620000,NM,4,5,mp-1187695,,V3Cr,"{'functional': 'PBE', 'labels': ['V_pv', 'Cr_pv'], 'pot_type': 'paw'}","{'V': 3.0, 'Cr': 1.0}",GGA,mp-1187695,"['mp-1187695', 'mp-1436418', 'mp-1767813', 'mp-1791546', 'mp-1610549']",0.009072,"{'V': 3.0, 'Cr': 1.0}",51.53724569092947,[],NM,False,225,0,"[0.0, 0.0, 0.0, -0.0]",0.0001760280332869,0.009072,0,0.009072,MP,data/source/MP/cleaned/cifs/MP-mp-1187695.cif,False,,data/final/MP/graphs/Cr0.25V0.75-MP-mp-1187695.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
As2Ba0.5Fe1.9K0.5Zn0.1,2,0.04,2.0,False,As4Ba1Fe3.8K1Zn0.2,As4Ba1Fe4K1,30.15,Ferrite,True,As40Ba10Fe38K10Zn2,As-Ba-Fe-K-Zn,5,Supercon,Ba0.5K0.5Fe1.9Zn0.1As2,MP-mp-1223517,K1Ba1Fe4As4,As-Ba-Fe-K,As40Ba10Fe40K10,C m m m,orthorhombic,5.479027,5.480024002658328,7.13170472,data/final/MP/cifs/As2Ba0.5Fe1.9K0.5Zn0.1-MP-mp-1223517-synth_doped.cif,data/source/MP/raw/cifs/mp-1223517.cif,mp-1223517,0.0,,2019-01-12 23:54:03.876000,5.87534599912672,,,{'GGA': {'task_id': 'mp-1743010'}},0.0132513644999994,4.21185628,520.0,-59.66633886,-5.966633886,{'tags': []},-59.66633886,-5.966633886,-0.4120461663000007,[],False,[],True,2021-05-12 11:00:52.054000,FM,10,4,mp-1223517,,KBa(FeAs)4,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",GGA,mp-1223517,"['mp-1223517', 'mp-1396881', 'mp-1743010', 'mp-1827585']",0.9947188,"{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",197.6961518155852,[],FM,True,65,1,"[0.0, 0.0, 0.3, 0.3, 0.3, 0.3, 0.0, 0.0, 0.0, 0.0]",0.0050315536790412,0.9947188,4,0.9947188,MP,data/source/MP/cleaned/cifs/MP-mp-1223517.cif,True,,data/final/MP/graphs/As2Ba0.5Fe1.9K0.5Zn0.1-MP-mp-1223517-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ca1.867Cl2Cu1Na0.133O2,2,0.038,1.0,True,Ca1.867Cl2Cu1Na0.133O2,Ca2Cl2Cu1O2,20.0,Cuprate,True,Ca26.671Cl28.571Cu14.286Na1.9O28.571428571428573,Ca-Cl-Cu-Na-O,5,Supercon,Ca1.867Na0.133Cu1Cl2O2,MP-mp-23143,Ca2Cu1Cl2O2,Ca-Cl-Cu-O,Ca28.571Cl28.571Cu14.286O28.571428571428573,I 4/m m m,tetragonal,3.88024600076171,3.880246000761709,8.12907187,data/final/MP/cifs/Ca1.867Cl2Cu1Na0.133O2-MP-mp-23143-synth_doped.cif,data/source/MP/raw/cifs/mp-23143.cif,mp-23143,0.0,,2014-02-21 09:50:06,3.554337150605878,10.17188/1199263,"@misc{osti_1199263,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ca2Cu(ClO)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199263"",
    place = ""United States"",
    year = ""2016"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700223'}},0.0191527683333321,4.19679796,520.0,-35.95348475,-5.136212107142858,"{'tags': ['Dicalcium copper dioxide dichloride', 'Dicalcium dichlorodioxocuprate']}",-35.95348475,-5.136212107142858,-2.407440427142858,"['xas', 'elasticity', 'bandstructure']",True,"[1027, 83117, 41581]",True,2021-05-12 10:56:16.728000,NM,7,8,mp-23143,oxide,Ca2Cu(ClO)2,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Cu_pv', 'Cl', 'O'], 'pot_type': 'paw'}","{'Ca': 2.0, 'Cu': 1.0, 'Cl': 2.0, 'O': 2.0}",GGA,mp-23143,"['mp-992231', 'mp-990553', 'mp-23143', 'mp-1436301', 'mp-1700223', 'mp-1803462', 'mp-993865', 'mp-1592909']",0.0134962,"{'Ca': 2.0, 'Cu': 1.0, 'Cl': 2.0, 'O': 2.0}",115.21141865211318,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001171429026557,0.0134962,0,0.0134962,MP,data/source/MP/cleaned/cifs/MP-mp-23143.cif,True,,data/final/MP/graphs/Ca1.867Cl2Cu1Na0.133O2-MP-mp-23143-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ru0.475V0.525,2,0.05,2.0,False,Ru0.95V1.05,Ru1V1,3.12,Other,True,Ru47.5V52.5,Ru-V,2,Supercon,Ru0.475V0.525,MP-mp-1395,V1Ru1,Ru-V,Ru50V50,P m -3 m,cubic,3.014694,3.014694,3.014694,data/final/MP/cifs/Ru0.475V0.525-MP-mp-1395-synth_doped.cif,data/source/MP/raw/cifs/mp-1395.cif,mp-1395,0.0,,2011-05-12 19:37:14,9.21288886283982,10.17188/1189837,"@misc{osti_1189837,
    author = ""Persson, Kristin"",
    title = ""Materials Data on VRu (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189837"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688485'}},0.0,7.72767567,520.0,-18.82570789,-9.412853945,"{'tags': ['Ruthenium vanadium (1/1)', 'Ruthenium vanadium (1/1) - HT']}",-18.82570789,-9.412853945,-0.2337060825000012,"['xas', 'elasticity', 'bandstructure']",True,"[106010, 106011]",True,2021-05-12 10:56:12.755000,FiM,2,17,mp-1395,,VRu,"{'functional': 'PBE', 'labels': ['V_pv', 'Ru_pv'], 'pot_type': 'paw'}","{'V': 1.0, 'Ru': 1.0}",GGA,mp-1395,"['mp-991544', 'mp-993492', 'mp-2829', 'mp-1395', 'mp-1059722', 'mp-1059669', 'mp-1059766', 'mp-1059703', 'mp-1059619', 'mp-1059801', 'mp-1442257', 'mp-1688485', 'mp-1792970', 'mp-994797', 'mp-1591529', 'mp-1059798', 'mp-1059699']",0.647887,"{'V': 1.0, 'Ru': 1.0}",27.39868439535897,[],FiM,True,221,2,"[0.7, -0.1]",0.023646646337141,0.647887,2,0.647887,MP,data/source/MP/cleaned/cifs/MP-mp-1395.cif,True,,data/final/MP/graphs/Ru0.475V0.525-MP-mp-1395-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Pt1Tl2,1,0.0,2.0,False,Pt2Tl4,Pt2Tl4,1.58,Other,True,Pt33.333Tl66.667,Pt-Tl,2,Supercon,Pt1Tl2,MP-mp-571160,Tl4Pt2,Pt-Tl,Pt33.333Tl66.667,I 4/m c m,tetragonal,5.680769997297979,5.732619159976752,5.7326191600000005,data/final/MP/cifs/Pt1Tl2-MP-mp-571160.cif,data/source/MP/raw/cifs/mp-571160.cif,mp-571160,0.0,,2014-02-16 06:52:04,14.237538220996615,10.17188/1276112,"@misc{osti_1276112,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Tl2Pt (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1276112"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696269'}},0.0066347046296297,7.0553334,520.0,-21.89847414,-3.64974569,{'tags': ['Platinum thallium (1/2)']},-21.89847414,-3.64974569,-0.0510143555555557,"['xas', 'elasticity', 'bandstructure']",True,"[102797, 649780]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-571160,,Tl2Pt,"{'functional': 'PBE', 'labels': ['Tl_d', 'Pt'], 'pot_type': 'paw'}","{'Tl': 2.0, 'Pt': 1.0}",GGA,mp-571160,"['mp-941240', 'mp-941546', 'mp-934762', 'mp-571160', 'mp-1414708', 'mp-1696269', 'mp-1924190', 'mp-1587369']",8.65e-06,"{'Tl': 4.0, 'Pt': 2.0}",140.85546196618537,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0]",1.2282093827609714e-07,8.65e-06,0,1.73e-05,MP,data/source/MP/cleaned/cifs/MP-mp-571160.cif,False,,data/final/MP/graphs/Pt1Tl2-MP-mp-571160.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Fe1Se0.99,2,0.0050251256281407,2.0,False,Fe2Se1.98,Fe2Se2,6.99,Ferrite,True,Fe50.251Se49.749,Fe-Se,2,Supercon,Fe1Se0.99,MP-mp-20311,Fe2Se2,Fe-Se,Fe50Se50,P 4/n m m,tetragonal,3.688905,3.688905,5.854194,data/final/MP/cifs/Fe1Se0.99-MP-mp-20311-synth_doped.cif,data/source/MP/raw/cifs/mp-20311.cif,mp-20311,0.0,,2013-10-20 07:09:24,5.619828229873189,10.17188/1195438,"@misc{osti_1195438,
    author = ""Persson, Kristin"",
    title = ""Materials Data on FeSe (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195438"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668877'}},0.0,3.48880228,520.0,-25.01949237,-6.2548730925,"{'tags': ['Iron selenide - NN AFM', 'Iron selenide - orthorhombic, LT', 'Iron selenide', 'Iron sulfide', 'Iron selenide (1/1) - nonmagnetic', 'Iron selenide - tetragonal', 'Iron selenide - alpha LT', 'Iron selenide - LT', 'High pressure experimental phase', 'Iron selenide - alpha']}",-25.01949237,-6.2548730925,-0.5079131286718743,"['xas', 'elasticity', 'bandstructure']",True,"[196301, 196298, 196299, 196297, 290701, 165958, 185464, 163561, 169257, 163560, 977900, 169311, 169303, 26889, 166440, 162901, 169283, 165957, 169271, 977903, 169259, 977901, 185465, 165959, 169306, 169267, 163557, 169287, 169297, 169289, 163556, 169299, 163562, 166441, 182544, 163559, 169269, 169263, 169265, 169315, 169255, 166439, 169293, 169313, 163555, 169291, 169301, 165960, 169253, 169295, 169970, 163558, 169285, 169261, 169309]",True,2021-05-12 10:56:14.760000,NM,4,55,mp-20311,,FeSe,"{'functional': 'PBE', 'labels': ['Fe_pv', 'Se'], 'pot_type': 'paw'}","{'Fe': 1.0, 'Se': 1.0}",GGA,mp-20311,"['mp-684656', 'mp-20311', 'mp-1063646', 'mp-1063662', 'mp-1063681', 'mp-1063669', 'mp-1063680', 'mp-1063695', 'mp-1063686', 'mp-1063699', 'mp-1063715', 'mp-1063717', 'mp-1063876', 'mp-1063734', 'mp-1063891', 'mp-1063735', 'mp-1063910', 'mp-1063918', 'mp-1063922', 'mp-1063931', 'mp-1063774', 'mp-1063781', 'mp-1064091', 'mp-1064111', 'mp-1063801', 'mp-1064112', 'mp-1064180', 'mp-1064138', 'mp-1064153', 'mp-1065102', 'mp-1065123', 'mp-1065075', 'mp-1065161', 'mp-1065131', 'mp-1065030', 'mp-1065055', 'mp-1065085', 'mp-1065094', 'mp-1440814', 'mp-1668877', 'mp-1799618', 'mp-1593782', 'mp-1592730', 'mp-1065081', 'mp-1065148', 'mp-1063928', 'mp-1063726', 'mp-1063683', 'mp-1063709', 'mp-1063911', 'mp-1063795', 'mp-1065121', 'mp-1063725', 'mp-1064139', 'mp-1064165']",3.455e-05,"{'Fe': 2.0, 'Se': 2.0}",79.66398961559156,[],NM,False,129,0,"[0, 0, 0, 0]",8.673931638803586e-07,3.455e-05,0,6.91e-05,MP,data/source/MP/cleaned/cifs/MP-mp-20311.cif,True,,data/final/MP/graphs/Fe1Se0.99-MP-mp-20311-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Al0.5B2Mg0.5,1,0.0,2.0,False,Al1B4Mg1,Al1B4Mg1,12.9,Other,True,Al16.667B66.667Mg16.667,Al-B-Mg,3,Supercon,Mg0.5Al0.5B2,MP-mp-1207086,Mg1Al1B4,Al-B-Mg,Al16.667B66.667Mg16.667,P 6/m m m,hexagonal,3.0390800030457754,3.03908045,6.743851,data/final/MP/cifs/Al0.5B2Mg0.5-MP-mp-1207086.cif,data/source/MP/raw/cifs/mp-1207086.cif,mp-1207086,0.0,,2019-01-12 10:15:58.939000,2.9100354640166017,,,,0.0,7.97438235,520.0,-32.93890018,-5.489816696666666,"{'tags': ['MgAlB4', 'MgAlB4 rt', 'AlB2 family']}",-32.93890018,-5.489816696666666,-0.1459128694444433,[],False,[],True,2021-05-12 11:00:19.396000,NM,6,3,mp-1207086,,MgAlB4,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Al', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Al': 1.0, 'B': 4.0}",GGA,mp-1207086,"['mp-1207086', 'mp-1420258', 'mp-1781830']",0.0064715,"{'Mg': 1.0, 'Al': 1.0, 'B': 4.0}",53.94149118560149,[],NM,False,191,0,"[0, 0, 0, 0, 0, 0]",0.0001199725824733,0.0064715,0,0.0064715,MP,data/source/MP/cleaned/cifs/MP-mp-1207086.cif,False,,data/final/MP/graphs/Al0.5B2Mg0.5-MP-mp-1207086.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
La1Rh1O3,1,0.0,4.0,False,La4Rh4O12,La4Rh4O12,0.0,Oxide,True,La20Rh20O60,La-Rh-O,3,Supercon,La1Rh1O3,MP-mp-5163,La4Rh4O12,La-Rh-O,La20Rh20O60,P n m a,orthorhombic,5.52133,5.878627,7.945444,data/final/MP/cifs/La1Rh1O3-MP-mp-5163.cif,data/source/MP/raw/cifs/mp-5163.cif,mp-5163,0.5966000000000005,,2011-05-17 17:12:22,7.464202806132534,10.17188/1263117,"@misc{osti_1263117,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaRhO3 (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1263117"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1669959'}},0.0,6.96122652,520.0,-151.23299048,-7.561649524000001,{'tags': ['Lanthanum rhodium trioxide']},-151.23299048,-7.561649524000001,-2.545009926000001,"['xas', 'elasticity', 'bandstructure']",True,"[172347, 172353]",True,2021-05-12 10:56:20.740000,NM,20,8,mp-5163,oxide,LaRhO3,"{'functional': 'PBE', 'labels': ['La', 'Rh_pv', 'O'], 'pot_type': 'paw'}","{'La': 1.0, 'Rh': 1.0, 'O': 3.0}",GGA,mp-5163,"['mp-678721', 'mp-663626', 'mp-5163', 'mp-1418173', 'mp-1669959', 'mp-1864388', 'mp-1603172', 'mp-699951']",0.0001943,"{'La': 4.0, 'Rh': 4.0, 'O': 12.0}",257.8919470133035,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.0136652539984423e-06,0.0001943,0,0.0007772,MP,data/source/MP/cleaned/cifs/MP-mp-5163.cif,False,,data/final/MP/graphs/La1Rh1O3-MP-mp-5163.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Pd34Se11,3,0.0888888888888888,0.1818208556149732,False,Pd6.182Se2,Pd8Se2,2.66,Other,True,Pd75.556Se24.444,Pd-Se,2,Supercon,Pd34Se11,MP-mp-7818,Pd8Se2,Pd-Se,Pd80Se20,P -4 21 c,tetragonal,5.314807,5.314807,5.762397,data/final/MP/cifs/Pd34Se11-MP-mp-7818-synth_doped.cif,data/source/MP/raw/cifs/mp-7818.cif,mp-7818,0.0,,2011-05-30 06:45:10,10.29633329731544,10.17188/1307580,"@misc{osti_1307580,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Pd4Se (SG:114) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1307580"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696479'}},0.0,5.07601896,520.0,-50.03404921,-5.003404921,{'tags': ['Palladium selenide (4/1)']},-50.03404921,-5.003404921,-0.2547171774687499,"['bandstructure', 'elasticity']",True,[23864],True,2021-05-12 10:56:31.128000,NM,10,8,mp-7818,,Pd4Se,"{'functional': 'PBE', 'labels': ['Pd', 'Se'], 'pot_type': 'paw'}","{'Pd': 4.0, 'Se': 1.0}",GGA,mp-7818,"['mp-913043', 'mp-7818', 'mp-929268', 'mp-930128', 'mp-1429762', 'mp-1696479', 'mp-1779253', 'mp-1601294']",9.195e-05,"{'Pd': 8.0, 'Se': 2.0}",162.7714275309073,[],NM,False,114,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.1298051678331617e-06,9.195e-05,0,0.0001839,MP,data/source/MP/cleaned/cifs/MP-mp-7818.cif,True,,data/final/MP/graphs/Pd34Se11-MP-mp-7818-synth_doped.json,0,True,-42m,0,0,0,0,6,0,0,1,0,0,0,1.0,False
Mo6S8Sn0.875,2,0.0156862745098038,1.0,True,Mo6S8Sn0.875,Mo6S8Sn1,14.048,Chevrel,True,Mo40.336S53.782Sn5.882,Mo-S-Sn,3,Supercon,Sn0.875Mo6S8,MP-mp-5336,Sn1Mo6S8,Mo-S-Sn,Mo40S53.333Sn6.667,R -3,trigonal,6.58066409,6.58066409,6.58066353,data/final/MP/cifs/Mo6S8Sn0.875-MP-mp-5336-synth_doped.cif,data/source/MP/raw/cifs/mp-5336.cif,mp-5336,0.0,,2011-05-15 17:45:00,5.541219299874331,10.17188/1263487,"@misc{osti_1263487,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sn(Mo3S4)2 (SG:148) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1263487"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700085'}},0.0527309536666669,6.12708465,520.0,-111.77875897,-7.451917264666666,"{'tags': ['Tin(IV) octathiomolybdate(II)', 'Molybdenum tin sulfide (6/1/8)', 'Tin molybdenum sulfide (1/6/8)', 'Tin(IV) molybdenum(II) sulfide  (1/6/8)']}",-111.77875897,-7.451917264666666,-0.9085153333333332,"['xas', 'bandstructure']",True,"[644277, 644289, 200814, 644281, 200672, 600722, 644284]",True,2021-05-12 10:57:10.838000,NM,15,13,mp-5336,,Sn(Mo3S4)2,"{'functional': 'PBE', 'labels': ['Sn_d', 'Mo_pv', 'S'], 'pot_type': 'paw'}","{'Sn': 1.0, 'Mo': 6.0, 'S': 8.0}",GGA,mp-5336,"['mp-909482', 'mp-925170', 'mp-924598', 'mp-5336', 'mp-1103971', 'mp-1104002', 'mp-1104482', 'mp-1104917', 'mp-1237423', 'mp-1504237', 'mp-1700085', 'mp-1874112', 'mp-1598244']",0.0018094,"{'Sn': 1.0, 'Mo': 6.0, 'S': 8.0}",284.9475353364468,[],NM,False,148,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.349940868460514e-06,0.0018094,0,0.0018094,MP,data/source/MP/cleaned/cifs/MP-mp-5336.cif,True,,data/final/MP/graphs/Mo6S8Sn0.875-MP-mp-5336-synth_doped.json,0,True,-3,0,0,0,0,0,0,2,1,0,0,0,1.0,False
Th0.2Zr0.8,3,0.1,8.0,False,Th1.6Zr6.4,Th2Zr6,3.3,Other,True,Th20Zr80,Th-Zr,2,Supercon,Th0.2Zr0.8,MP-mp-1187462,Th2Zr6,Th-Zr,Th25Zr75,P 63/m m c,hexagonal,5.391709,6.650577994733422,6.65057843,data/final/MP/cifs/Th0.2Zr0.8-MP-mp-1187462-synth_doped.cif,data/source/MP/raw/cifs/mp-1187462.cif,mp-1187462,0.0,,2019-01-11 15:06:18.148000,8.132138926883359,,,{'GGA': {'task_id': 'mp-1754720'}},0.0787794274999988,5.3170662,520.0,-65.48368486,-8.1854606075,{'tags': []},-65.48368486,-8.1854606075,0.0787794274999988,['bandstructure'],True,[],True,2021-05-12 10:58:31.620000,NM,8,5,mp-1187462,,ThZr3,"{'functional': 'PBE', 'labels': ['Th', 'Zr_sv'], 'pot_type': 'paw'}","{'Th': 1.0, 'Zr': 3.0}",GGA,mp-1187462,"['mp-1187462', 'mp-1383128', 'mp-1754720', 'mp-1831363', 'mp-1621035']",0.01315685,"{'Th': 2.0, 'Zr': 6.0}",206.52655311299864,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.000127410735343,0.01315685,0,0.0263137,MP,data/source/MP/cleaned/cifs/MP-mp-1187462.cif,True,,data/final/MP/graphs/Th0.2Zr0.8-MP-mp-1187462-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Nb1P1Ru1,1,0.0,4.0,False,Nb4P4Ru4,Nb4P4Ru4,0.0,Other,True,Nb33.333P33.333Ru33.333,Nb-P-Ru,3,Supercon,Nb1Ru1P1,MP-mp-1103310,Nb4P4Ru4,Nb-P-Ru,Nb33.333P33.333Ru33.333,P n m a,orthorhombic,3.758887,6.363436,7.209499,data/final/MP/cifs/Nb1P1Ru1-MP-mp-1103310.cif,data/source/MP/raw/cifs/mp-1103310.cif,mp-1103310,0.0,,2018-07-18 18:03:43,8.664416561999223,,,{'GGA': {'task_id': 'mp-1676174'}},0.0,8.67667238,520.0,-109.21590631,-9.101325525833332,"{'tags': ['NbRuP', 'AlB2 family', 'Niobium ruthenium phosphide (1/1/1)', 'TiNiSi']}",-109.21590631,-9.101325525833332,-0.8383264586111103,['bandstructure'],True,[645175],True,2021-05-12 10:58:20.361000,NM,12,5,mp-1103310,,NbPRu,"{'functional': 'PBE', 'labels': ['Nb_pv', 'P', 'Ru_pv'], 'pot_type': 'paw'}","{'Nb': 1.0, 'P': 1.0, 'Ru': 1.0}",GGA,mp-1103310,"['mp-1103310', 'mp-1381032', 'mp-1676174', 'mp-1779326', 'mp-1599588']",7.2675e-05,"{'Nb': 4.0, 'P': 4.0, 'Ru': 4.0}",172.44715609196302,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.685733801518738e-06,7.2675e-05,0,0.0002907,MP,data/source/MP/cleaned/cifs/MP-mp-1103310.cif,False,,data/final/MP/graphs/Nb1P1Ru1-MP-mp-1103310.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
B2Be1,1,0.0,1.0,True,B2Be1,B2Be1,0.0,Other,True,B66.667Be33.333,B-Be,2,Supercon,B2Be1,MP-mp-1009823,Be1B2,B-Be,B66.667Be33.333,P 6/m m m,hexagonal,2.877335,2.9296900037269635,2.9296909,data/final/MP/cifs/B2Be1-MP-mp-1009823.cif,data/source/MP/raw/cifs/mp-1009823.cif,mp-1009823,0.0,,2016-09-24 05:25:07,2.3784323923271464,10.17188/1326305,"@misc{osti_1326305,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BeB2 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1326305"",
    place = ""United States"",
    year = ""2016"",
    month = ""9"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1674797'}},0.1271937300694361,6.32451761,520.0,-16.73751164,-5.579170546666667,{'tags': ['Beryllium boride (1/2)']},-16.73751164,-5.579170546666667,0.1202282555555551,"['xas', 'elasticity', 'bandstructure']",True,"[237009, 186762]",True,2021-05-12 10:56:08.727000,NM,3,16,mp-1009823,,BeB2,"{'functional': 'PBE', 'labels': ['Be_sv', 'B'], 'pot_type': 'paw'}","{'Be': 1.0, 'B': 2.0}",GGA,mp-1009823,"['mp-1062549', 'mp-1062568', 'mp-1062595', 'mp-1062904', 'mp-1062933', 'mp-1062972', 'mp-1009823', 'mp-1009840', 'mp-1009858', 'mp-1435964', 'mp-1674797', 'mp-1794406', 'mp-1009886', 'mp-1606570', 'mp-1062578', 'mp-1062952']",0.0004941,"{'Be': 1.0, 'B': 2.0}",21.387724178513288,[],NM,False,191,0,"[0, 0, 0]",2.3102037218919573e-05,0.0004941,0,0.0004941,MP,data/source/MP/cleaned/cifs/MP-mp-1009823.cif,False,,data/final/MP/graphs/B2Be1-MP-mp-1009823.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ca1P2Ru2,1,0.0,1.0,True,Ca1P2Ru2,Ca1P2Ru2,0.0,Other,True,Ca20P40Ru40,Ca-P-Ru,3,Supercon,Ca1Ru2P2,MP-mp-5157,Ca1P2Ru2,Ca-P-Ru,Ca20P40Ru40,I 4/m m m,tetragonal,4.079411999726806,4.079411999726806,5.70948416,data/final/MP/cifs/Ca1P2Ru2-MP-mp-5157.cif,data/source/MP/raw/cifs/mp-5157.cif,mp-5157,0.0,,2011-05-13 02:59:34,6.159745735428599,10.17188/1263111,"@misc{osti_1263111,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ca(PRu)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1263111"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704438'}},0.0,7.49682497,520.0,-36.01372209,-7.202744418,"{'tags': ['Calcium ruthenium phosphide (1/2/2)', 'Calcium diruthenium diphosphide']}",-36.01372209,-7.202744418,-0.9265475773333336,"['xas', 'elasticity', 'bandstructure']",True,"[61125, 602125]",True,2021-05-12 10:56:20.740000,NM,5,8,mp-5157,,Ca(PRu)2,"{'functional': 'PBE', 'labels': ['Ca_sv', 'P', 'Ru_pv'], 'pot_type': 'paw'}","{'Ca': 1.0, 'P': 2.0, 'Ru': 2.0}",GGA,mp-5157,"['mp-922284', 'mp-922021', 'mp-907687', 'mp-5157', 'mp-1438355', 'mp-1704438', 'mp-1801583', 'mp-1592001']",4.5e-06,"{'Ca': 1.0, 'P': 2.0, 'Ru': 2.0}",81.99668574139874,[],NM,False,139,0,"[0, 0, 0, 0, 0]",5.4880266919471686e-08,4.5e-06,0,4.5e-06,MP,data/source/MP/cleaned/cifs/MP-mp-5157.cif,False,,data/final/MP/graphs/Ca1P2Ru2-MP-mp-5157.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Be17Ta2,1,0.0,1.0,True,Be17Ta2,Be17Ta2,0.0,Other,True,Be89.474Ta10.526,Be-Ta,2,Supercon,Be17Ta2,MP-mp-1189402,Ta2Be17,Be-Ta,Be89.474Ta10.526,R -3 m,trigonal,5.55553076,5.555530759999999,5.55553133,data/final/MP/cifs/Be17Ta2-MP-mp-1189402.cif,data/source/MP/raw/cifs/mp-1189402.cif,mp-1189402,0.0,,2019-01-11 20:10:03.927000,5.097220737965369,,,{'GGA': {'task_id': 'mp-1708323'}},0.0,4.84056199,520.0,-90.7506292,-4.776348905263158,{'tags': ['Tantalum beryllium (2/17)']},-90.7506292,-4.776348905263158,-0.1823713281578951,['bandstructure'],True,"[616427, 616430]",True,2021-05-12 10:58:33.577000,NM,19,5,mp-1189402,,Ta2Be17,"{'functional': 'PBE', 'labels': ['Ta_pv', 'Be_sv'], 'pot_type': 'paw'}","{'Ta': 2.0, 'Be': 17.0}",GGA,mp-1189402,"['mp-1189402', 'mp-1413310', 'mp-1708323', 'mp-1780942', 'mp-1604511']",4.57e-05,"{'Ta': 2.0, 'Be': 17.0}",167.80682186535657,[],NM,False,166,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.723369615847226e-07,4.57e-05,0,4.57e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1189402.cif,False,,data/final/MP/graphs/Be17Ta2-MP-mp-1189402.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ce0.029La0.971Sn3,2,0.0145,1.0,True,Ce0.029La0.971Sn3,La1Sn3,3.47,Other,True,Ce0.725La24.275Sn75,Ce-La-Sn,3,Supercon,La0.9709Ce0.0291Sn3,MP-mp-633,La1Sn3,La-Sn,La25Sn75,P m -3 m,cubic,4.820061,4.820061,4.820061,data/final/MP/cifs/Ce0.029La0.971Sn3-MP-mp-633-synth_doped.cif,data/source/MP/raw/cifs/mp-633.cif,mp-633,0.0,,2011-05-13 04:30:54,7.340536659909055,10.17188/1279358,"@misc{osti_1279358,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaSn3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1279358"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688008'}},0.0,8.68748013,520.0,-19.26482408,-4.81620602,"{'tags': ['Lanthanum stannide (1/3)', 'Lanthanum tin (1/3)']}",-19.26482408,-4.81620602,-0.5750253525,"['xas', 'bandstructure']",True,"[641991, 104721, 641986, 261870, 104720, 151359, 642000, 641998, 191074]",True,2021-05-12 10:57:30.779000,NM,4,12,mp-633,,LaSn3,"{'functional': 'PBE', 'labels': ['La', 'Sn_d'], 'pot_type': 'paw'}","{'La': 1.0, 'Sn': 3.0}",GGA,mp-633,"['mp-991111', 'mp-993073', 'mp-633', 'mp-1066557', 'mp-1066573', 'mp-1066594', 'mp-1442023', 'mp-1688008', 'mp-1787436', 'mp-994393', 'mp-1590336', 'mp-1066601']",0.0055557,"{'La': 1.0, 'Sn': 3.0}",111.98441958300587,[],NM,False,221,0,"[0, 0, 0, 0]",4.961136576577034e-05,0.0055557,0,0.0055557,MP,data/source/MP/cleaned/cifs/MP-mp-633.cif,True,,data/final/MP/graphs/Ce0.029La0.971Sn3-MP-mp-633-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Si2V5,3,0.0714285714285714,1.0,True,Si2V5,Si2V6,0.0,Other,True,Si28.571V71.429,Si-V,2,Supercon,Si2V5,MP-mp-2567,V6Si2,Si-V,Si25V75,P m -3 n,cubic,4.702381,4.702381,4.702381,data/final/MP/cifs/Si2V5-MP-mp-2567-synth_doped.cif,data/source/MP/raw/cifs/mp-2567.cif,mp-2567,0.0,,2011-05-13 19:15:43,5.778142190030859,10.17188/1200874,"@misc{osti_1200874,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Si (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1200874"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668672'}},0.0,7.30599425,520.0,-69.05773321,-8.63221665125,{'tags': ['Vanadium silicide (3/1)']},-69.05773321,-8.63221665125,-0.4452085937499994,"['xas', 'elasticity', 'bandstructure']",True,"[652491, 87328, 652522, 652502, 652510, 652520, 600518, 186003, 652507, 652513, 652497, 601150, 652514, 652487, 22412, 652509, 652529, 652532, 652499, 652539, 652537, 652533, 652512, 652538, 652490, 652493, 652494, 652511, 652519, 87329, 652526, 652500]",True,2021-05-12 10:56:18.721000,FM,8,13,mp-2567,,V3Si,"{'functional': 'PBE', 'labels': ['V_pv', 'Si'], 'pot_type': 'paw'}","{'V': 3.0, 'Si': 1.0}",GGA,mp-2567,"['mp-920081', 'mp-906309', 'mp-919083', 'mp-2567', 'mp-1078474', 'mp-1078852', 'mp-1138781', 'mp-1145907', 'mp-1440678', 'mp-1668672', 'mp-1795955', 'mp-1593554', 'mp-1596575']",0.8382519,"{'V': 6.0, 'Si': 2.0}",103.98086881866836,[],FM,True,131,1,"[0.2, 0.3, 0.3, 0.2, 0.3, 0.3, 0.0, 0.0]",0.0161231947669493,0.8382519,6,1.6765038,MP,data/source/MP/cleaned/cifs/MP-mp-2567.cif,True,,data/final/MP/graphs/Si2V5-MP-mp-2567-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
As2Co0.3Fe1.7Sr1,3,0.12,1.0,True,As2Co0.3Fe1.7Sr1,As2Fe2Sr1,13.2,Ferrite,True,As40Co6Fe34Sr20,As-Co-Fe-Sr,4,Supercon,Sr1Fe1.7Co0.3As2,MP-mp-4488,Sr1Fe2As2,As-Fe-Sr,As40Fe40Sr20,I 4/m m m,tetragonal,3.9729799997357778,3.9729799997357778,6.45523327,data/final/MP/cifs/As2Co0.3Fe1.7Sr1-MP-mp-4488-synth_doped.cif,data/source/MP/raw/cifs/mp-4488.cif,mp-4488,0.0,,2011-05-13 03:37:13,6.319998834487784,10.17188/1208187,"@misc{osti_1208187,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr(FeAs)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208187"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672865'}},0.0,5.13397273,520.0,-30.61898897,-6.123797794,"{'tags': ['Strontium diiron arsenide - HT', 'Strontium diiron arsenide', 'Strontium diiron diarsenide', 'Iron strontium arsenide (2/1/2)', 'Strontium diiron arsenide - LT']}",-30.61898897,-6.123797794,-0.5342483613333335,"['xas', 'elasticity', 'bandstructure']",True,"[182330, 181993, 610527, 163209, 163208, 163869]",True,2021-05-12 10:56:20.740000,NM,5,8,mp-4488,,Sr(FeAs)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Fe': 2.0, 'As': 2.0}",GGA,mp-4488,"['mp-906356', 'mp-920135', 'mp-919110', 'mp-4488', 'mp-1439153', 'mp-1672865', 'mp-1873948', 'mp-1592272']",0.0029206,"{'Sr': 1.0, 'Fe': 2.0, 'As': 2.0}",91.7377588211838,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",3.183640016422098e-05,0.0029206,0,0.0029206,MP,data/source/MP/cleaned/cifs/MP-mp-4488.cif,True,,data/final/MP/graphs/As2Co0.3Fe1.7Sr1-MP-mp-4488-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Re0.73W0.27,2,0.04,8.0,False,Re5.84W2.16,Re6W2,8.3,Other,True,Re73W27,Re-W,2,Supercon,Re0.73W0.27,MP-mp-974408,Re6W2,Re-W,Re75W25,P 63/m m c,hexagonal,4.551902,5.592164004382465,5.59216393,data/final/MP/cifs/Re0.73W0.27-MP-mp-974408-synth_doped.cif,data/source/MP/raw/cifs/mp-974408.cif,mp-974408,0.0,,2015-09-16 23:30:04,20.00181531858272,10.17188/1314483,"@misc{osti_1314483,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Re3W (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1314483"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1753563'}},0.130423158750002,7.03427154,520.0,-99.54003078,-12.4425038475,{'tags': []},-99.54003078,-12.4425038475,0.130423158750002,"['xas', 'bandstructure']",True,[],True,2021-05-12 10:57:55.580000,NM,8,8,mp-974408,,Re3W,"{'functional': 'PBE', 'labels': ['Re_pv', 'W_pv'], 'pot_type': 'paw'}","{'Re': 3.0, 'W': 1.0}",GGA,mp-974408,"['mp-974449', 'mp-974408', 'mp-974489', 'mp-1404689', 'mp-1753563', 'mp-1789838', 'mp-974542', 'mp-1618978']",0.0001131,"{'Re': 6.0, 'W': 2.0}",123.2773602085495,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.834886792005728e-06,0.0001131,0,0.0002262,MP,data/source/MP/cleaned/cifs/MP-mp-974408.cif,True,,data/final/MP/graphs/Re0.73W0.27-MP-mp-974408-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ru1Ti1,1,0.0,1.0,True,Ru1Ti1,Ru1Ti1,1.07,Other,True,Ru50Ti50,Ru-Ti,2,Supercon,Ru1Ti1,MP-mp-592,Ti1Ru1,Ru-Ti,Ru50Ti50,P m -3 m,cubic,3.085481,3.085481,3.085481,data/final/MP/cifs/Ru1Ti1-MP-mp-592.cif,data/source/MP/raw/cifs/mp-592.cif,mp-592,0.0,,2011-05-12 19:27:45,8.41943735464939,,,{'GGA': {'task_id': 'mp-1688658'}},0.0,7.59366033,520.0,-18.69611319,-9.348056595,"{'tags': ['Titanium ruthenium (1/1)', 'Ruthenium titanium (1/1)']}",-18.69611319,-9.348056595,-0.7631157591666664,"['xas', 'elasticity', 'bandstructure']",True,"[150936, 106004, 106005, 650738, 650737]",True,2021-05-12 10:56:27.046000,NM,2,8,mp-592,,TiRu,"{'functional': 'PBE', 'labels': ['Ti_pv', 'Ru_pv'], 'pot_type': 'paw'}","{'Ti': 1.0, 'Ru': 1.0}",GGA,mp-592,"['mp-657137', 'mp-657130', 'mp-592', 'mp-655431', 'mp-1442231', 'mp-1688658', 'mp-1792103', 'mp-1586312']",0.0028936,"{'Ti': 1.0, 'Ru': 1.0}",29.374374622032345,[],NM,False,221,0,"[0, 0]",9.85076290893916e-05,0.0028936,0,0.0028936,MP,data/source/MP/cleaned/cifs/MP-mp-592.cif,False,,data/final/MP/graphs/Ru1Ti1-MP-mp-592.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ga6Y1,1,0.0,2.0,False,Ga12Y2,Ga12Y2,2.0,Other,True,Ga85.714Y14.286,Ga-Y,2,Supercon,Ga6Y1,MP-mp-30681,Y2Ga12,Ga-Y,Ga85.714Y14.286,P 4/n b m,tetragonal,5.982577,5.982577,7.616821,data/final/MP/cifs/Ga6Y1-MP-mp-30681.cif,data/source/MP/raw/cifs/mp-30681.cif,mp-30681,0.0,,2014-02-26 12:21:38,6.1793890621791805,10.17188/1205050,"@misc{osti_1205050,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YGa6 (SG:125) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1205050"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1669406'}},0.0,3.89213023,520.0,-53.61710004,-3.82979286,{'tags': ['Gallium yttrium (6/1)']},-53.61710004,-3.82979286,-0.3105003959523803,"['xas', 'bandstructure']",True,[104033],True,2021-05-12 10:57:04.957000,NM,14,8,mp-30681,,YGa6,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ga_d'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ga': 6.0}",GGA,mp-30681,"['mp-928952', 'mp-30681', 'mp-912507', 'mp-929342', 'mp-510179', 'mp-1422373', 'mp-1669406', 'mp-1604944']",7.005e-05,"{'Y': 2.0, 'Ga': 12.0}",272.6153737018628,[],NM,False,125,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.139108557876708e-07,7.005e-05,0,0.0001401,MP,data/source/MP/cleaned/cifs/MP-mp-30681.cif,False,,data/final/MP/graphs/Ga6Y1-MP-mp-30681.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
C8Rb1,1,0.0,2.0,False,C16Rb2,C16Rb2,0.01205,Carbon,True,C88.889Rb11.111,C-Rb,2,Supercon,C8Rb1,MP-mp-568643,Rb2C16,C-Rb,C88.889Rb11.111,F d d d,orthorhombic,4.973286000857069,4.975341206815797,11.756342227753612,data/final/MP/cifs/C8Rb1-MP-mp-568643.cif,data/source/MP/raw/cifs/mp-568643.cif,mp-568643,0.0,,2014-02-24 17:59:11,2.4484623556758898,10.17188/1274623,"@misc{osti_1274623,
    author = ""Persson, Kristin"",
    title = ""Materials Data on RbC8 (SG:70) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1274623"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1669461'}},0.0,4.28249036,520.0,-150.35278035,-8.352932241666666,{'tags': ['Rubidium carbide (1/8)']},-150.35278035,-8.352932241666666,-0.0424011669444423,"['xas', 'bandstructure']",True,[200563],True,2021-05-12 10:57:24.969000,NM,18,8,mp-568643,,RbC8,"{'functional': 'PBE', 'labels': ['Rb_sv', 'C'], 'pot_type': 'paw'}","{'Rb': 1.0, 'C': 8.0}",GGA,mp-568643,"['mp-920928', 'mp-942393', 'mp-942783', 'mp-568643', 'mp-1504507', 'mp-1669461', 'mp-1775107', 'mp-1604039']",0.0126605,"{'Rb': 2.0, 'C': 16.0}",246.2578300827785,[],NM,False,70,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0001028231264422,0.0126605,0,0.025321,MP,data/source/MP/cleaned/cifs/MP-mp-568643.cif,False,,data/final/MP/graphs/C8Rb1-MP-mp-568643.json,0,True,mmm,0,0,0,7,0,0,0,0,0,0,1,1.0,False
La2Sn5,3,0.0714285714285714,0.5,False,La1Sn2.5,La1Sn3,5.4,Other,True,La28.571Sn71.429,La-Sn,2,Supercon,La2Sn5,MP-mp-633,La1Sn3,La-Sn,La25Sn75,P m -3 m,cubic,4.820061,4.820061,4.820061,data/final/MP/cifs/La2Sn5-MP-mp-633-synth_doped.cif,data/source/MP/raw/cifs/mp-633.cif,mp-633,0.0,,2011-05-13 04:30:54,7.340536659909055,10.17188/1279358,"@misc{osti_1279358,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaSn3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1279358"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688008'}},0.0,8.68748013,520.0,-19.26482408,-4.81620602,"{'tags': ['Lanthanum stannide (1/3)', 'Lanthanum tin (1/3)']}",-19.26482408,-4.81620602,-0.5750253525,"['xas', 'bandstructure']",True,"[641991, 104721, 641986, 261870, 104720, 151359, 642000, 641998, 191074]",True,2021-05-12 10:57:30.779000,NM,4,12,mp-633,,LaSn3,"{'functional': 'PBE', 'labels': ['La', 'Sn_d'], 'pot_type': 'paw'}","{'La': 1.0, 'Sn': 3.0}",GGA,mp-633,"['mp-991111', 'mp-993073', 'mp-633', 'mp-1066557', 'mp-1066573', 'mp-1066594', 'mp-1442023', 'mp-1688008', 'mp-1787436', 'mp-994393', 'mp-1590336', 'mp-1066601']",0.0055557,"{'La': 1.0, 'Sn': 3.0}",111.98441958300587,[],NM,False,221,0,"[0, 0, 0, 0]",4.961136576577034e-05,0.0055557,0,0.0055557,MP,data/source/MP/cleaned/cifs/MP-mp-633.cif,True,,data/final/MP/graphs/La2Sn5-MP-mp-633-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Co1Cu2Pr1O7.02,2,0.0014179369018078,0.9970301994301994,True,Ba1.994Co0.997Cu1.994Pr0.997O7,Ba2Co1Cu2Pr1O7,0.0,Cuprate,True,Ba15.361Co7.68Cu15.361Pr7.68O53.917050691244235,Ba-Co-Cu-Pr-O,5,Supercon,Pr1Ba2Cu2Co1O7.02,MP-mp-1214590,Ba2Pr1Co1Cu2O7,Ba-Co-Cu-Pr-O,Ba15.385Co7.692Cu15.385Pr7.692O53.84615384615385,P m m m,orthorhombic,3.924367,3.945862,11.95319,data/final/MP/cifs/Ba2Co1Cu2Pr1O7.02-MP-mp-1214590-synth_doped.cif,data/source/MP/raw/cifs/mp-1214590.cif,mp-1214590,0.0,,2019-01-12 16:24:29.366000,6.401740212584317,,,{'GGA+U': {'task_id': 'mp-1743256'}},0.0302664991025629,3.32999013,520.0,-80.54801208,-6.196000929230769,"{'tags': ['Ba2Cu2(Cu0.89Al0.11)YO7', 'high-Tc cuprate family', 'Ba2Cu2PrCoO7']}",-80.54801208,-6.196000929230769,-2.187208700384616,[],False,[],True,2021-05-12 11:00:37.845000,FM,13,4,mp-1214590,oxide,Ba2PrCoCu2O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Pr_3', 'Co', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Pr': 1.0, 'Co': 1.0, 'Cu': 2.0, 'O': 7.0}",GGA+U,mp-1214590,"['mp-1214590', 'mp-1400781', 'mp-1743256', 'mp-1831832']",2.4579545,"{'Ba': 2.0, 'Pr': 1.0, 'Co': 1.0, 'Cu': 2.0, 'O': 7.0}",185.09527408515603,[],FM,True,47,1,"[0.0, 0.0, 0.0, 2.2, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0132794017143256,2.4579545,1,2.4579545,MP,data/source/MP/cleaned/cifs/MP-mp-1214590.cif,True,,data/final/MP/graphs/Ba2Co1Cu2Pr1O7.02-MP-mp-1214590-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Re0.18Si1V2.82,3,0.09,2.0,False,Re0.36Si2V5.64,Si2V6,0.0,Other,True,Re4.5Si25V70.5,Re-Si-V,3,Supercon,Re0.18Si1V2.82,MP-mp-2567,V6Si2,Si-V,Si25V75,P m -3 n,cubic,4.702381,4.702381,4.702381,data/final/MP/cifs/Re0.18Si1V2.82-MP-mp-2567-synth_doped.cif,data/source/MP/raw/cifs/mp-2567.cif,mp-2567,0.0,,2011-05-13 19:15:43,5.778142190030859,10.17188/1200874,"@misc{osti_1200874,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Si (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1200874"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668672'}},0.0,7.30599425,520.0,-69.05773321,-8.63221665125,{'tags': ['Vanadium silicide (3/1)']},-69.05773321,-8.63221665125,-0.4452085937499994,"['xas', 'elasticity', 'bandstructure']",True,"[652491, 87328, 652522, 652502, 652510, 652520, 600518, 186003, 652507, 652513, 652497, 601150, 652514, 652487, 22412, 652509, 652529, 652532, 652499, 652539, 652537, 652533, 652512, 652538, 652490, 652493, 652494, 652511, 652519, 87329, 652526, 652500]",True,2021-05-12 10:56:18.721000,FM,8,13,mp-2567,,V3Si,"{'functional': 'PBE', 'labels': ['V_pv', 'Si'], 'pot_type': 'paw'}","{'V': 3.0, 'Si': 1.0}",GGA,mp-2567,"['mp-920081', 'mp-906309', 'mp-919083', 'mp-2567', 'mp-1078474', 'mp-1078852', 'mp-1138781', 'mp-1145907', 'mp-1440678', 'mp-1668672', 'mp-1795955', 'mp-1593554', 'mp-1596575']",0.8382519,"{'V': 6.0, 'Si': 2.0}",103.98086881866836,[],FM,True,131,1,"[0.2, 0.3, 0.3, 0.2, 0.3, 0.3, 0.0, 0.0]",0.0161231947669493,0.8382519,6,1.6765038,MP,data/source/MP/cleaned/cifs/MP-mp-2567.cif,True,,data/final/MP/graphs/Re0.18Si1V2.82-MP-mp-2567-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Cu3La0.4Pr0.6O7,2,0.0153846153846153,2.0,False,Ba4Cu6La0.8Pr1.2O14,Ba4Cu6La1Pr1O14,0.0,Cuprate,True,Ba15.385Cu23.077La3.077Pr4.615O53.84615384615385,Ba-Cu-La-Pr-O,5,Supercon,La0.4Pr0.6Ba2Cu3O7,MP-mp-1228253,Ba4La1Pr1Cu6O14,Ba-Cu-La-Pr-O,Ba15.385Cu23.077La3.846Pr3.846O53.84615384615385,P m m m,orthorhombic,3.905432,3.977981,23.854019,data/final/MP/cifs/Ba2Cu3La0.4Pr0.6O7-MP-mp-1228253-synth_doped.cif,data/source/MP/raw/cifs/mp-1228253.cif,mp-1228253,0.0,,2019-01-13 03:59:16.220000,6.427211818969123,,,{'GGA': {'task_id': 'mp-1681296'}},0.0269668878044804,3.53296398,520.0,-157.72373695,-6.066297574999999,{'tags': []},-157.72373695,-6.066297574999999,-2.1570097419230763,[],False,[],True,2021-05-12 11:00:59.151000,NM,26,4,mp-1228253,oxide,Ba4LaPr(Cu3O7)2,"{'functional': 'PBE', 'labels': ['Ba_sv', 'La', 'Pr_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 4.0, 'La': 1.0, 'Pr': 1.0, 'Cu': 6.0, 'O': 14.0}",GGA,mp-1228253,"['mp-1228253', 'mp-1346084', 'mp-1681296', 'mp-1844089']",0.0009849,"{'Ba': 4.0, 'La': 1.0, 'Pr': 1.0, 'Cu': 6.0, 'O': 14.0}",370.589700999212,[],NM,False,47,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.657656155431298e-06,0.0009849,0,0.0009849,MP,data/source/MP/cleaned/cifs/MP-mp-1228253.cif,True,,data/final/MP/graphs/Ba2Cu3La0.4Pr0.6O7-MP-mp-1228253-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
As2Co0.2Fe1.8Mg1Sr4Ti1O6,3,0.0249999999999999,1.0,True,As2Co0.2Fe1.8Mg1Sr4Ti1O6,As2Fe2Mg1Sr4Ti1O6,24.0,Ferrite,True,As12.5Co1.25Fe11.25Mg6.25Sr25Ti6.25O37.5,As-Co-Fe-Mg-Sr-Ti-O,7,Supercon,Fe1.8Co0.2As2Sr4Mg1Ti1O6,MP-mp-1218475,Sr4Mg1Ti1Fe2As2O6,As-Fe-Mg-Sr-Ti-O,As12.5Fe12.5Mg6.25Sr25Ti6.25O37.5,P 4 m m,tetragonal,4.015363,4.015363,16.837343,data/final/MP/cifs/As2Co0.2Fe1.8Mg1Sr4Ti1O6-MP-mp-1218475-synth_doped.cif,data/source/MP/raw/cifs/mp-1218475.cif,mp-1218475,0.0,,2019-01-12 19:38:13.106000,4.772232743847063,,,,0.596506169999997,3.61641349,520.0,-93.06331959,-5.816457474375,{'tags': []},-93.06331959,-5.816457474375,-1.8435971231250008,[],False,[],True,2021-05-12 11:00:42.526000,FM,16,3,mp-1218475,oxide,Sr4MgTiFe2(AsO3)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Mg_pv', 'Ti_pv', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Sr': 4.0, 'Mg': 1.0, 'Ti': 1.0, 'Fe': 2.0, 'As': 2.0, 'O': 6.0}",GGA+U,mp-1218475,"['mp-1218475', 'mp-1332338', 'mp-1770100']",0.1094594,"{'Sr': 4.0, 'Mg': 1.0, 'Ti': 1.0, 'Fe': 2.0, 'As': 2.0, 'O': 6.0}",271.4708387835521,[],FM,True,25,1,"[-0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, 0.1, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0004032086852881,0.1094594,1,0.1094594,MP,data/source/MP/cleaned/cifs/MP-mp-1218475.cif,True,,data/final/MP/graphs/As2Co0.2Fe1.8Mg1Sr4Ti1O6-MP-mp-1218475-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
Si2Ti1,1,0.0,2.0,False,Si4Ti2,Si4Ti2,0.0,Other,True,Si66.667Ti33.333,Si-Ti,2,Supercon,Si2Ti1,MP-mp-1077503,Ti2Si4,Si-Ti,Si66.667Ti33.333,C m c m,orthorhombic,3.559167999349692,3.571808,6.979711,data/final/MP/cifs/Si2Ti1-MP-mp-1077503.cif,data/source/MP/raw/cifs/mp-1077503.cif,mp-1077503,0.0,,2018-04-09 05:04:05,4.027104900936081,,,{'GGA': {'task_id': 'mp-1670891'}},0.0,9.4234946,520.0,-40.8605684,-6.810094733333333,"{'tags': ['Titanium silicide (1/2)', 'Silicon titanium (2/1) - Cmcm']}",-40.8605684,-6.810094733333333,-0.5140547144444447,['bandstructure'],True,"[168418, 652419]",True,2021-05-12 10:58:14.654000,NM,6,6,mp-1077503,,TiSi2,"{'functional': 'PBE', 'labels': ['Ti_pv', 'Si'], 'pot_type': 'paw'}","{'Ti': 1.0, 'Si': 2.0}",GGA,mp-1077503,"['mp-1077503', 'mp-1077754', 'mp-1300341', 'mp-1670891', 'mp-1801470', 'mp-1589567']",0.00216355,"{'Ti': 2.0, 'Si': 4.0}",85.79819381947253,[],NM,False,63,0,"[0, 0, 0, 0, 0, 0]",5.043346261000116e-05,0.00216355,0,0.0043271,MP,data/source/MP/cleaned/cifs/MP-mp-1077503.cif,False,,data/final/MP/graphs/Si2Ti1-MP-mp-1077503.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
C3Er0.1Th1.9,2,0.04,4.0,False,C12Er0.4Th7.6,C12Th8,6.8,Other,True,C60Er2Th38,C-Er-Th,3,Supercon,Th1.9Er0.1C3,MP-mp-1188514,Th8C12,C-Th,C60Th40,I -4 3 d,cubic,7.414620251643706,7.41462025,7.41462025,data/final/MP/cifs/C3Er0.1Th1.9-MP-mp-1188514-synth_doped.cif,data/source/MP/raw/cifs/mp-1188514.cif,mp-1188514,0.0,,2019-01-11 19:30:01.530000,10.585910862659652,,,{'GGA': {'task_id': 'mp-1669546'}},0.0,8.12401413,520.0,-175.32363419,-8.7661817095,"{'tags': ['Pu2C3', 'Th2C3 hp', 'Thorium carbide (2/3)']}",-175.32363419,-8.7661817095,-0.2645699894999992,['bandstructure'],True,[618903],True,2021-05-12 10:58:33.577000,NM,20,5,mp-1188514,,Th2C3,"{'functional': 'PBE', 'labels': ['Th', 'C'], 'pot_type': 'paw'}","{'Th': 2.0, 'C': 3.0}",GGA,mp-1188514,"['mp-1188514', 'mp-1415692', 'mp-1669546', 'mp-1811506', 'mp-1605961']",0.000101475,"{'Th': 8.0, 'C': 12.0}",313.7941543668512,[],NM,False,220,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.2935231404134748e-06,0.000101475,0,0.0004059,MP,data/source/MP/cleaned/cifs/MP-mp-1188514.cif,True,,data/final/MP/graphs/C3Er0.1Th1.9-MP-mp-1188514-synth_doped.json,0,True,-43m,5,0,0,0,0,0,0,0,0,1,0,1.0,False
La1Sn3,1,0.0,1.0,True,La1Sn3,La1Sn3,6.358285714,Other,True,La25Sn75,La-Sn,2,Supercon,La1Sn3,MP-mp-633,La1Sn3,La-Sn,La25Sn75,P m -3 m,cubic,4.820061,4.820061,4.820061,data/final/MP/cifs/La1Sn3-MP-mp-633.cif,data/source/MP/raw/cifs/mp-633.cif,mp-633,0.0,,2011-05-13 04:30:54,7.340536659909055,10.17188/1279358,"@misc{osti_1279358,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaSn3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1279358"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688008'}},0.0,8.68748013,520.0,-19.26482408,-4.81620602,"{'tags': ['Lanthanum stannide (1/3)', 'Lanthanum tin (1/3)']}",-19.26482408,-4.81620602,-0.5750253525,"['xas', 'bandstructure']",True,"[641991, 104721, 641986, 261870, 104720, 151359, 642000, 641998, 191074]",True,2021-05-12 10:57:30.779000,NM,4,12,mp-633,,LaSn3,"{'functional': 'PBE', 'labels': ['La', 'Sn_d'], 'pot_type': 'paw'}","{'La': 1.0, 'Sn': 3.0}",GGA,mp-633,"['mp-991111', 'mp-993073', 'mp-633', 'mp-1066557', 'mp-1066573', 'mp-1066594', 'mp-1442023', 'mp-1688008', 'mp-1787436', 'mp-994393', 'mp-1590336', 'mp-1066601']",0.0055557,"{'La': 1.0, 'Sn': 3.0}",111.98441958300587,[],NM,False,221,0,"[0, 0, 0, 0]",4.961136576577034e-05,0.0055557,0,0.0055557,MP,data/source/MP/cleaned/cifs/MP-mp-633.cif,False,,data/final/MP/graphs/La1Sn3-MP-mp-633.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ir1Si1Ta1,1,0.0,4.0,False,Ir4Si4Ta4,Ir4Si4Ta4,0.5,Other,True,Ir33.333Si33.333Ta33.333,Ir-Si-Ta,3,Supercon,Ta1Ir1Si1,MP-mp-21316,Ta4Si4Ir4,Ir-Si-Ta,Ir33.333Si33.333Ta33.333,P n m a,orthorhombic,3.814279,6.431281,7.327521,data/final/MP/cifs/Ir1Si1Ta1-MP-mp-21316.cif,data/source/MP/raw/cifs/mp-21316.cif,mp-21316,0.0,,2014-02-22 08:13:45,14.82714488672876,10.17188/1196738,"@misc{osti_1196738,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TaSiIr (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196738"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699744'}},0.0,9.04057685,520.0,-114.3283356,-9.5273613,{'tags': ['Tantalum iridium silicide (1/1/1)']},-114.3283356,-9.5273613,-0.8201872766666677,"['xas', 'elasticity', 'bandstructure']",True,[411884],True,2021-05-12 10:56:16.728000,NM,12,9,mp-21316,,TaSiIr,"{'functional': 'PBE', 'labels': ['Ta_pv', 'Si', 'Ir'], 'pot_type': 'paw'}","{'Ta': 1.0, 'Si': 1.0, 'Ir': 1.0}",GGA,mp-21316,"['mp-910928', 'mp-927096', 'mp-926559', 'mp-21316', 'mp-1144382', 'mp-1417104', 'mp-1699744', 'mp-1831631', 'mp-1598883']",1.48e-05,"{'Ta': 4.0, 'Si': 4.0, 'Ir': 4.0}",179.74921984460246,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.293477437686786e-07,1.48e-05,0,5.92e-05,MP,data/source/MP/cleaned/cifs/MP-mp-21316.cif,False,,data/final/MP/graphs/Ir1Si1Ta1-MP-mp-21316.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ce1Co0.9In5Ru0.1,2,0.0285714285714285,1.0,True,Ce1Co0.9In5Ru0.1,Ce1Co1In5,2.25,Heavy_fermion,True,Ce14.286Co12.857In71.429Ru1.429,Ce-Co-In-Ru,4,Supercon,Ce1Co0.9Ru0.1In5,MP-mp-19961,Ce1In5Co1,Ce-Co-In,Ce14.286Co14.286In71.429,P 4/m m m,tetragonal,4.635989,4.635989,7.564124,data/final/MP/cifs/Ce1Co0.9In5Ru0.1-MP-mp-19961-synth_doped.cif,data/source/MP/raw/cifs/mp-19961.cif,mp-19961,0.0,,2014-02-21 14:08:25,7.897022127398995,10.17188/1195145,"@misc{osti_1195145,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeIn5Co (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195145"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701944'}},0.0,7.80626318,520.0,-28.52795357,-4.075421938571429,{'tags': ['Cerium cobalt indium (1/1/5)']},-28.52795357,-4.075421938571429,-0.2468754242857146,"['xas', 'bandstructure']",True,[102108],True,2021-05-12 10:56:57.051000,FM,7,8,mp-19961,,CeIn5Co,"{'functional': 'PBE', 'labels': ['Ce', 'In_d', 'Co'], 'pot_type': 'paw'}","{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",GGA,mp-19961,"['mp-928775', 'mp-912209', 'mp-928270', 'mp-19961', 'mp-1504062', 'mp-1701944', 'mp-1785253', 'mp-1593180']",0.9310323,"{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",162.57113333428427,[],FM,True,123,1,"[0.7, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0057269226147644,0.9310323,1,0.9310323,MP,data/source/MP/cleaned/cifs/MP-mp-19961.cif,True,,data/final/MP/graphs/Ce1Co0.9In5Ru0.1-MP-mp-19961-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ba2Ca1Cu2Tl1O8,3,0.0659340659340659,0.875,True,Ba1.75Ca0.875Cu1.75Tl0.875O7,Ba2Ca1Cu2Tl1O7,105.9816667,Cuprate,True,Ba14.286Ca7.143Cu14.286Tl7.143O57.142857142857146,Ba-Ca-Cu-Tl-O,5,Supercon,Tl1Ba2Ca1Cu2O8,MP-mp-632802,Ba2Ca1Tl1Cu2O7,Ba-Ca-Cu-Tl-O,Ba15.385Ca7.692Cu15.385Tl7.692O53.84615384615385,P 4/m m m,tetragonal,3.840502,3.840502,13.048748,data/final/MP/cifs/Ba2Ca1Cu2Tl1O8-MP-mp-632802-synth_doped.cif,data/source/MP/raw/cifs/mp-632802.cif,mp-632802,0.0,,2013-06-21 12:28:47,6.541687864051921,10.17188/1279349,"@misc{osti_1279349,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2CaTlCu2O7 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1279349"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1742071'}},0.0444125982158123,2.89241018,520.0,-71.95529719,-5.535022860769231,{'tags': ['Thallium(III) calcium barium copper oxide (1/1/2/2/7)']},-71.95529719,-5.535022860769231,-1.978767086794871,"['xas', 'bandstructure']",True,[67128],True,2021-05-12 10:57:30.779000,NM,13,10,mp-632802,oxide,Ba2CaTlCu2O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ca_sv', 'Tl_d', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Ca': 1.0, 'Tl': 1.0, 'Cu': 2.0, 'O': 7.0}",GGA,mp-632802,"['mp-699409', 'mp-632802', 'mp-732256', 'mp-743134', 'mp-1182322', 'mp-1394572', 'mp-1742071', 'mp-1785618', 'mp-1654627', 'mp-749845']",0.0282595,"{'Ba': 2.0, 'Ca': 1.0, 'Tl': 1.0, 'Cu': 2.0, 'O': 7.0}",192.461929418226,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.000146831636186,0.0282595,0,0.0282595,MP,data/source/MP/cleaned/cifs/MP-mp-632802.cif,True,,data/final/MP/graphs/Ba2Ca1Cu2Tl1O8-MP-mp-632802-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Re2Th1,1,0.0,4.0,False,Re8Th4,Re8Th4,5.025,Other,True,Re66.667Th33.333,Re-Th,2,Supercon,Re2Th1,MP-mp-1659,Th4Re8,Re-Th,Re66.667Th33.333,P 63/m m c,hexagonal,5.412790003196384,5.41279031,9.429472,data/final/MP/cifs/Re2Th1-MP-mp-1659.cif,data/source/MP/raw/cifs/mp-1659.cif,mp-1659,0.0,,2011-05-16 10:51:03,16.78071860572601,10.17188/1182267,"@misc{osti_1182267,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ThRe2 (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1182267"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704165'}},0.0,7.74509522,520.0,-130.36813549,-10.864011290833332,"{'tags': ['Rhenium thorium (2/1)', 'Thorium rhenium (1/2)']}",-130.36813549,-10.864011290833332,-0.0963737508333319,"['xas', 'elasticity', 'bandstructure']",True,"[650166, 109247, 601404, 109249, 650165]",True,2021-05-12 10:56:14.760000,NM,12,10,mp-1659,,ThRe2,"{'functional': 'PBE', 'labels': ['Th', 'Re_pv'], 'pot_type': 'paw'}","{'Th': 1.0, 'Re': 2.0}",GGA,mp-1659,"['mp-905015', 'mp-919373', 'mp-918375', 'mp-1659', 'mp-1102697', 'mp-1103216', 'mp-1427897', 'mp-1704165', 'mp-1777631', 'mp-1600687']",0.000446325,"{'Th': 4.0, 'Re': 8.0}",239.2546548451992,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",7.461923786415408e-06,0.000446325,0,0.0017853,MP,data/source/MP/cleaned/cifs/MP-mp-1659.cif,False,,data/final/MP/graphs/Re2Th1-MP-mp-1659.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
B2Os1Y1,1,0.0,4.0,False,B8Os4Y4,B8Os4Y4,2.22,Other,True,B50Os25Y25,B-Os-Y,3,Supercon,Y1Os1B2,MP-mp-1106229,Y4B8Os4,B-Os-Y,B50Os25Y25,P n m a,orthorhombic,5.332899,5.914657,6.391182,data/final/MP/cifs/B2Os1Y1-MP-mp-1106229.cif,data/source/MP/raw/cifs/mp-1106229.cif,mp-1106229,0.0,,2018-07-19 09:41:34,9.909504801003193,,,,0.0,6.4198959,520.0,-133.23503463,-8.327189664375,"{'tags': ['LuRuB2', 'Yttrium osmium boride (1/1/2)', 'YOsB2']}",-133.23503463,-8.327189664375,-0.5640344368749997,[],False,[615149],True,2021-05-12 10:59:33.162000,NM,16,3,mp-1106229,,YB2Os,"{'functional': 'PBE', 'labels': ['Y_sv', 'B', 'Os_pv'], 'pot_type': 'paw'}","{'Y': 1.0, 'B': 2.0, 'Os': 1.0}",GGA,mp-1106229,"['mp-1106229', 'mp-1830937', 'mp-1981540']",0.00540595,"{'Y': 4.0, 'B': 8.0, 'Os': 4.0}",201.5923780413584,[],NM,False,62,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001072649681009,0.00540595,0,0.0216238,MP,data/source/MP/cleaned/cifs/MP-mp-1106229.cif,False,,data/final/MP/graphs/B2Os1Y1-MP-mp-1106229.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Bi2Ca0.3Cu2Pr0.7Sr2O8,3,0.04,1.0,True,Bi2Ca0.3Cu2Pr0.7Sr2O8,Bi2Cu2Pr1Sr2O8,0.0,Cuprate,True,Bi13.333Ca2Cu13.333Pr4.667Sr13.333O53.333333333333336,Bi-Ca-Cu-Pr-Sr-O,6,Supercon,Bi2Sr2Ca0.3Pr0.7Cu2O8,MP-mp-1208752,Sr2Pr1Cu2Bi2O8,Bi-Cu-Pr-Sr-O,Bi13.333Cu13.333Pr6.667Sr13.333O53.333333333333336,I 4/m m m,tetragonal,3.834136000030565,3.834136000030565,15.612086169999998,data/final/MP/cifs/Bi2Ca0.3Cu2Pr0.7Sr2O8-MP-mp-1208752-synth_doped.cif,data/source/MP/raw/cifs/mp-1208752.cif,mp-1208752,0.0,,2019-01-12 11:36:34.547000,7.267491513783425,,,{'GGA': {'task_id': 'mp-1737201'}},0.1119466963333302,5.05599766,520.0,-89.97734715,-5.99848981,"{'tags': ['Ba2CaCu2Tl2O8', 'high-Tc cuprate family', 'Sr2Cu2PrBi2O8']}",-89.97734715,-5.99848981,-2.1167527398888883,[],False,[],True,2021-05-12 11:00:21.818000,NM,15,4,mp-1208752,oxide,Sr2PrCu2(BiO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Pr_3', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Pr': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",GGA,mp-1208752,"['mp-1208752', 'mp-1390177', 'mp-1737201', 'mp-1934574']",0.0020197,"{'Sr': 2.0, 'Pr': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",226.019943500512,[],NM,False,139,0,"[0.0, 0.0, 0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",8.935937106786441e-06,0.0020197,0,0.0020197,MP,data/source/MP/cleaned/cifs/MP-mp-1208752.cif,True,,data/final/MP/graphs/Bi2Ca0.3Cu2Pr0.7Sr2O8-MP-mp-1208752-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B2Mg0.95Ti0.05,2,0.0333333333333333,1.0,True,B2Mg0.95Ti0.05,B2Mg1,38.5,Other,True,B66.667Mg31.667Ti1.667,B-Mg-Ti,3,Supercon,Mg0.95Ti0.05B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B2Mg0.95Ti0.05-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B2Mg0.95Ti0.05-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ge1.96La1Pd2Sn0.04,2,0.016,1.0,True,Ge1.96La1Pd2Sn0.04,Ge2La1Pd2,0.82,Other,True,Ge39.2La20Pd40Sn0.8,Ge-La-Pd-Sn,4,Supercon,La1Pd2Ge1.96Sn0.04,MP-mp-21033,La1Ge2Pd2,Ge-La-Pd,Ge40La20Pd40,I 4/m m m,tetragonal,4.421290001597606,4.421290001597606,5.97061441,data/final/MP/cifs/Ge1.96La1Pd2Sn0.04-MP-mp-21033-synth_doped.cif,data/source/MP/raw/cifs/mp-21033.cif,mp-21033,0.0,,2014-02-21 11:30:39,8.300326005582953,10.17188/1196295,"@misc{osti_1196295,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La(GePd)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196295"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701817'}},0.0,6.14890347,520.0,-28.82817588,-5.765635176,{'tags': ['Lanthanum palladium germanide (1/2/2)']},-28.82817588,-5.765635176,-0.8572698889999998,"['xas', 'bandstructure']",True,"[81760, 53662]",True,2021-05-12 10:56:57.051000,NM,5,8,mp-21033,,La(GePd)2,"{'functional': 'PBE', 'labels': ['La', 'Ge_d', 'Pd'], 'pot_type': 'paw'}","{'La': 1.0, 'Ge': 2.0, 'Pd': 2.0}",GGA,mp-21033,"['mp-990571', 'mp-992631', 'mp-21033', 'mp-1438097', 'mp-1701817', 'mp-1796178', 'mp-994077', 'mp-1596763']",0.0004025,"{'La': 1.0, 'Ge': 2.0, 'Pd': 2.0}",99.4334691764027,[],NM,False,139,0,"[0, 0, 0, 0, 0]",4.047932786956611e-06,0.0004025,0,0.0004025,MP,data/source/MP/cleaned/cifs/MP-mp-21033.cif,True,,data/final/MP/graphs/Ge1.96La1Pd2Sn0.04-MP-mp-21033-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As1Ru1Ti1,1,0.0,6.0,False,As6Ru6Ti6,As6Ru6Ti6,0.0,Other,True,As33.333Ru33.333Ti33.333,As-Ru-Ti,3,Supercon,Ti1Ru1As1,MP-mp-1208217,Ti6As6Ru6,As-Ru-Ti,As33.333Ru33.333Ti33.333,I m a 2,orthorhombic,6.557321997370876,7.497116639968726,7.35776199659985,data/final/MP/cifs/As1Ru1Ti1-MP-mp-1208217.cif,data/source/MP/raw/cifs/mp-1208217.cif,mp-1208217,0.0,,2019-01-12 11:10:35.596000,8.181825428663004,,,{'GGA': {'task_id': 'mp-1670825'}},0.0,8.15085098,520.0,-143.87931718,-7.993295398888888,"{'tags': ['TiFeSi', 'Ruthenium titanium arsenide (1/1/1)', 'TiRuAs']}",-143.87931718,-7.993295398888888,-0.7169620399999985,['bandstructure'],True,[611300],True,2021-05-12 10:58:39.488000,NM,18,4,mp-1208217,,TiAsRu,"{'functional': 'PBE', 'labels': ['Ti_pv', 'As', 'Ru_pv'], 'pot_type': 'paw'}","{'Ti': 1.0, 'As': 1.0, 'Ru': 1.0}",GGA,mp-1208217,"['mp-1208217', 'mp-1475441', 'mp-1670825', 'mp-1604394']",0.0005221666666666,"{'Ti': 6.0, 'As': 6.0, 'Ru': 6.0}",272.5987890615212,[],NM,False,46,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.1493081135048371e-05,0.0005221666666666,0,0.003133,MP,data/source/MP/cleaned/cifs/MP-mp-1208217.cif,False,,data/final/MP/graphs/As1Ru1Ti1-MP-mp-1208217.json,0,True,mm2,0,0,0,6,0,0,0,0,0,1,0,1.0,False
Ce0.91La0.09Ru2,3,0.0599999999999999,2.0,False,Ce1.82La0.18Ru4,Ce2Ru4,5.91,Heavy_fermion,True,Ce30.333La3Ru66.667,Ce-La-Ru,3,Supercon,Ce0.91La0.09Ru2,MP-mp-607,Ce2Ru4,Ce-Ru,Ce33.333Ru66.667,F d -3 m,cubic,5.35903077,5.35903077,5.35903077,data/final/MP/cifs/Ce0.91La0.09Ru2-MP-mp-607-synth_doped.cif,data/source/MP/raw/cifs/mp-607.cif,mp-607,0.0,,2011-05-13 22:34:26,10.444470046690055,10.17188/1277529,"@misc{osti_1277529,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeRu2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277529"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686879'}},0.0,8.61419203,520.0,-50.66413619,-8.444022698333333,"{'tags': ['Cerium ruthenium (1/2)', 'Cerium ruthenium hydride (1/2/4)']}",-50.66413619,-8.444022698333333,-0.2833998766666663,"['xas', 'elasticity', 'bandstructure']",True,"[621326, 656077, 621978, 621973, 621980, 621984, 102277, 621972, 621976, 621979, 604113, 621977, 621982, 621983, 102276, 656078]",True,2021-05-12 10:56:27.046000,NM,6,14,mp-607,,CeRu2,"{'functional': 'PBE', 'labels': ['Ce', 'Ru_pv'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Ru': 2.0}",GGA,mp-607,"['mp-928203', 'mp-912221', 'mp-928809', 'mp-607', 'mp-1071462', 'mp-1071593', 'mp-1071613', 'mp-1077792', 'mp-1440763', 'mp-1686879', 'mp-1803198', 'mp-1591928', 'mp-1591642', 'mp-1071635']",1.005e-05,"{'Ce': 2.0, 'Ru': 4.0}",108.82877852828122,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",1.846937939745105e-07,1.005e-05,0,2.01e-05,MP,data/source/MP/cleaned/cifs/MP-mp-607.cif,True,,data/final/MP/graphs/Ce0.91La0.09Ru2-MP-mp-607-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ga0.05Nb3Sn0.95,2,0.025,2.0,False,Ga0.1Nb6Sn1.9,Nb6Sn2,18.3,Other,True,Ga1.25Nb75Sn23.75,Ga-Nb-Sn,3,Supercon,Nb3Ga0.05Sn0.95,MP-mp-1326,Nb6Sn2,Nb-Sn,Nb75Sn25,P m -3 n,cubic,5.334611,5.334611,5.334611,data/final/MP/cifs/Ga0.05Nb3Sn0.95-MP-mp-1326-synth_doped.cif,data/source/MP/raw/cifs/mp-1326.cif,mp-1326,0.0,,2011-05-14 09:51:48,8.694218121896231,10.17188/1189484,"@misc{osti_1189484,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Sn (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189484"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668415'}},0.0,6.59372491,520.0,-69.93787048,-8.74223381,{'tags': ['Niobium tin (3/1)']},-69.93787048,-8.74223381,-0.163862066250001,"['xas', 'elasticity', 'bandstructure']",True,"[105230, 645503, 645489, 105231, 645498, 645485, 645474, 645496, 645480, 645488, 645482, 645487, 645500, 645493, 645477, 645484, 645502, 645483, 150878, 645479, 645481, 645486, 645473]",True,2021-05-12 10:56:12.755000,NM,8,9,mp-1326,,Nb3Sn,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Sn_d'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Sn': 1.0}",GGA,mp-1326,"['mp-930046', 'mp-913770', 'mp-930577', 'mp-1326', 'mp-1440651', 'mp-1668415', 'mp-1880085', 'mp-1594093', 'mp-1594507']",0.62023085,"{'Nb': 6.0, 'Sn': 2.0}",151.81275738025872,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0081709977567491,0.62023085,0,1.2404617,MP,data/source/MP/cleaned/cifs/MP-mp-1326.cif,True,,data/final/MP/graphs/Ga0.05Nb3Sn0.95-MP-mp-1326-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ca0.1Fe1La0.9P1O1,2,0.0499999999999999,2.0,False,Ca0.2Fe2La1.8P2O2,Fe2La2P2O2,5.67,Ferrite,True,Ca2.5Fe25La22.5P25O25,Ca-Fe-La-P-O,5,Supercon,La0.9Ca0.1Fe1P1O1,MP-mp-510668,La2Fe2P2O2,Fe-La-P-O,Fe25La25P25O25,P 4/n m m,tetragonal,4.068879,4.068879,9.084981,data/final/MP/cifs/Ca0.1Fe1La0.9P1O1-MP-mp-510668-synth_doped.cif,data/source/MP/raw/cifs/mp-510668.cif,mp-510668,0.0,,2014-02-26 04:17:37,5.337337070142887,,,{'GGA+U': {'task_id': 'mp-1704083'}},0.3903949226041714,6.29241646,520.0,-55.52669053,-6.94083631625,{'tags': []},-55.52669053,-6.94083631625,-1.734766549583334,"['xas', 'bandstructure']",True,"[162724, 420381, 391428]",True,2021-05-12 10:57:15.388000,FM,8,7,mp-510668,oxide,LaFePO,"{'functional': 'PBE', 'labels': ['La', 'Fe_pv', 'P', 'O'], 'pot_type': 'paw'}","{'La': 1.0, 'Fe': 1.0, 'P': 1.0, 'O': 1.0}",GGA+U,mp-510668,"['mp-542977', 'mp-510668', 'mp-1422599', 'mp-1704083', 'mp-1768909', 'mp-1779846', 'mp-1595432']",3.95130975,"{'La': 2.0, 'Fe': 2.0, 'P': 2.0, 'O': 2.0}",150.40891327693348,[],FM,True,129,1,"[0.0, 0.0, 3.7, 3.7, 0.0, 0.0, 0.0, 0.0]",0.0525408988591631,3.95130975,2,7.9026195,MP,data/source/MP/cleaned/cifs/MP-mp-510668.cif,True,,data/final/MP/graphs/Ca0.1Fe1La0.9P1O1-MP-mp-510668-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Fe2P2Sc2Sr4O6,1,0.0,1.0,True,Fe2P2Sc2Sr4O6,Fe2P2Sc2Sr4O6,15.25,Ferrite,True,Fe12.5P12.5Sc12.5Sr25O37.5,Fe-P-Sc-Sr-O,5,Supercon,Fe2P2Sr4Sc2O6,MP-mp-1189114,Sr4Sc2Fe2P2O6,Fe-P-Sc-Sr-O,Fe12.5P12.5Sc12.5Sr25O37.5,P 4/n m m,tetragonal,4.081757,4.081757,16.068628,data/final/MP/cifs/Fe2P2Sc2Sr4O6-MP-mp-1189114.cif,data/source/MP/raw/cifs/mp-1189114.cif,mp-1189114,0.0,,2019-01-11 19:57:03.286000,4.404028354366671,,,,0.1841585957812501,4.05015305,520.0,-107.89165238,-6.74322827375,{'tags': []},-107.89165238,-6.74322827375,-2.478022025833333,[],False,[168586],True,2021-05-12 10:59:54.607000,FM,16,3,mp-1189114,oxide,Sr2ScFePO3,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Sc_sv', 'Fe_pv', 'P', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Sc': 1.0, 'Fe': 1.0, 'P': 1.0, 'O': 3.0}",GGA+U,mp-1189114,"['mp-1189114', 'mp-1871527', 'mp-1987226']",3.95447755,"{'Sr': 4.0, 'Sc': 2.0, 'Fe': 2.0, 'P': 2.0, 'O': 6.0}",267.7152365917133,[],FM,True,129,1,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 3.6, 3.6, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0295424167884093,3.95447755,2,7.9089551,MP,data/source/MP/cleaned/cifs/MP-mp-1189114.cif,False,,data/final/MP/graphs/Fe2P2Sc2Sr4O6-MP-mp-1189114.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
As1F0.18Fe1Sm1O0.82,3,0.09,2.0,False,As2F0.36Fe2Sm2O1.64,As2Fe2Sm2O2,45.0,Ferrite,True,As25F4.5Fe25Sm25O20.5,As-F-Fe-Sm-O,5,Supercon,Sm1Fe1As1F0.18O0.82,MP-mp-20349,Sm2Fe2As2O2,As-Fe-Sm-O,As25Fe25Sm25O25,P 4/n m m,tetragonal,4.026492,4.026492,9.046755,data/final/MP/cifs/As1F0.18Fe1Sm1O0.82-MP-mp-20349-synth_doped.cif,data/source/MP/raw/cifs/mp-20349.cif,mp-20349,0.0,,2014-02-19 11:24:42,6.727802583283198,,,{'GGA+U': {'task_id': 'mp-1695938'}},0.3015723809374986,3.77685593,520.0,-52.73407138,-6.5917589225,{'tags': ['Samarium iron arsenic oxide (1/1/1/1)']},-52.73407138,-6.5917589225,-1.6285904237499995,"['xas', 'elasticity', 'bandstructure']",True,"[236652, 236653, 422002, 163457, 163458]",True,2021-05-12 10:56:16.728000,FM,8,10,mp-20349,oxide,SmFeAsO,"{'functional': 'PBE', 'labels': ['Sm_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Sm': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-20349,"['mp-24944', 'mp-1078897', 'mp-1079866', 'mp-1173321', 'mp-20349', 'mp-1425472', 'mp-1695938', 'mp-1772503', 'mp-1789694', 'mp-1588381']",3.75729895,"{'Sm': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",146.67176231613362,[],FM,True,129,1,"[0.0, 0.0, 3.5, 3.5, -0.0, -0.0, -0.0, -0.0]",0.0512341147425717,3.75729895,2,7.5145979,MP,data/source/MP/cleaned/cifs/MP-mp-20349.cif,True,,data/final/MP/graphs/As1F0.18Fe1Sm1O0.82-MP-mp-20349-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
As2Fe1.75Rh0.25Sr1,3,0.1,1.0,True,As2Fe1.75Rh0.25Sr1,As2Fe2Sr1,21.9,Ferrite,True,As40Fe35Rh5Sr20,As-Fe-Rh-Sr,4,Supercon,Sr1Fe1.75Rh0.25As2,MP-mp-4488,Sr1Fe2As2,As-Fe-Sr,As40Fe40Sr20,I 4/m m m,tetragonal,3.9729799997357778,3.9729799997357778,6.45523327,data/final/MP/cifs/As2Fe1.75Rh0.25Sr1-MP-mp-4488-synth_doped.cif,data/source/MP/raw/cifs/mp-4488.cif,mp-4488,0.0,,2011-05-13 03:37:13,6.319998834487784,10.17188/1208187,"@misc{osti_1208187,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr(FeAs)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208187"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672865'}},0.0,5.13397273,520.0,-30.61898897,-6.123797794,"{'tags': ['Strontium diiron arsenide - HT', 'Strontium diiron arsenide', 'Strontium diiron diarsenide', 'Iron strontium arsenide (2/1/2)', 'Strontium diiron arsenide - LT']}",-30.61898897,-6.123797794,-0.5342483613333335,"['xas', 'elasticity', 'bandstructure']",True,"[182330, 181993, 610527, 163209, 163208, 163869]",True,2021-05-12 10:56:20.740000,NM,5,8,mp-4488,,Sr(FeAs)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Fe': 2.0, 'As': 2.0}",GGA,mp-4488,"['mp-906356', 'mp-920135', 'mp-919110', 'mp-4488', 'mp-1439153', 'mp-1672865', 'mp-1873948', 'mp-1592272']",0.0029206,"{'Sr': 1.0, 'Fe': 2.0, 'As': 2.0}",91.7377588211838,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",3.183640016422098e-05,0.0029206,0,0.0029206,MP,data/source/MP/cleaned/cifs/MP-mp-4488.cif,True,,data/final/MP/graphs/As2Fe1.75Rh0.25Sr1-MP-mp-4488-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B0.8Nb5Si2.2,3,0.1388888888888888,2.0,False,B1.6Nb10Si4.4,B2Nb10Si6,6.6,Other,True,B10Nb62.5Si27.5,B-Nb-Si,3,Supercon,Nb5Si2.2B0.8,MP-mp-1106165,Nb10Si6B2,B-Nb-Si,B11.111Nb55.556Si33.333,P 63/m c m,hexagonal,5.310039,7.673267999856193,7.67326885,data/final/MP/cifs/B0.8Nb5Si2.2-MP-mp-1106165-synth_doped.cif,data/source/MP/raw/cifs/mp-1106165.cif,mp-1106165,0.0,,2018-07-19 08:44:17,6.863840658405542,,,{'GGA': {'task_id': 'mp-1708629'}},0.0,7.30893094,520.0,-159.35464851,-8.853036028333333,{'tags': ['Niobium silicide boride (5/3/1)']},-159.35464851,-8.853036028333333,-0.6669405804629633,['bandstructure'],True,[614916],True,2021-05-12 10:58:22.271000,NM,18,5,mp-1106165,,Nb5Si3B,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Si', 'B'], 'pot_type': 'paw'}","{'Nb': 5.0, 'Si': 3.0, 'B': 1.0}",GGA,mp-1106165,"['mp-1106165', 'mp-1415924', 'mp-1708629', 'mp-1938688', 'mp-1604572']",0.00120275,"{'Nb': 10.0, 'Si': 6.0, 'B': 2.0}",270.7628896390436,[],NM,False,193,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",8.884156921233901e-06,0.00120275,0,0.0024055,MP,data/source/MP/cleaned/cifs/MP-mp-1106165.cif,True,,data/final/MP/graphs/B0.8Nb5Si2.2-MP-mp-1106165-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ce0.13Cu1La1.87O4,2,0.0371428571428571,1.0,True,Ce0.13Cu1La1.87O4,Cu1La2O4,21.83333333,Cuprate,True,Ce1.857Cu14.286La26.714O57.142857142857146,Ce-Cu-La-O,4,Supercon,La1.87Ce0.13Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ce0.13Cu1La1.87O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ce0.13Cu1La1.87O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ba2Cs0.15Cu3Y0.85O6.5,2,0.024,2.0,False,Ba4Cs0.3Cu6Y1.7O13,Ba4Cu6Y2O13,90.4,Cuprate,True,Ba16Cs1.2Cu24Y6.8O52,Ba-Cs-Cu-Y-O,5,Supercon,Y0.85Cs0.15Ba2Cu3O6.5,MP-mp-20897,Ba4Y2Cu6O13,Ba-Cu-Y-O,Ba16Cu24Y8O52,P m m m,orthorhombic,3.909175,7.72064,11.972045,data/final/MP/cifs/Ba2Cs0.15Cu3Y0.85O6.5-MP-mp-20897-synth_doped.cif,data/source/MP/raw/cifs/mp-20897.cif,mp-20897,0.0,,2014-02-25 20:12:33,6.049593917158658,10.17188/1196091,"@misc{osti_1196091,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba4Y2Cu6O13 (SG:47) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196091"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1669318'}},0.0223745503700012,3.31128034,520.0,-155.75476866,-6.2301907464,"{'tags': ['Yttrium barium copper oxide (1/2/3/6.5)', 'Yttrium barium copper oxide (2/4/6/13)']}",-155.75476866,-6.2301907464,-2.2063284011333337,"['xas', 'elasticity', 'bandstructure']",True,"[96019, 96018, 390001, 75697, 73896, 96020, 96017, 96016]",True,2021-05-12 10:56:14.760000,NM,25,8,mp-20897,oxide,Ba4Y2Cu6O13,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 4.0, 'Y': 2.0, 'Cu': 6.0, 'O': 13.0}",GGA,mp-20897,"['mp-993255', 'mp-991266', 'mp-20897', 'mp-1435084', 'mp-1669318', 'mp-1838426', 'mp-994634', 'mp-1584471']",0.0060136,"{'Ba': 4.0, 'Y': 2.0, 'Cu': 6.0, 'O': 13.0}",361.3322753035632,[],NM,False,47,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0, -0.0, -0.0, 0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",1.6642853160426486e-05,0.0060136,0,0.0060136,MP,data/source/MP/cleaned/cifs/MP-mp-20897.cif,True,,data/final/MP/graphs/Ba2Cs0.15Cu3Y0.85O6.5-MP-mp-20897-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Al1.825La1Si0.175,3,0.1166666666666666,2.0,False,Al3.65La2Si0.35,Al4La2,0.0,Other,True,Al60.833La33.333Si5.833,Al-La-Si,3,Supercon,La1Al1.825Si0.175,MP-mp-2694,La2Al4,Al-La,Al66.667La33.333,F d -3 m,cubic,5.75810346,5.75810346,5.75810346,data/final/MP/cifs/Al1.825La1Si0.175-MP-mp-2694-synth_doped.cif,data/source/MP/raw/cifs/mp-2694.cif,mp-2694,0.0,,2011-05-12 21:07:48,4.744791242841679,10.17188/1201263,"@misc{osti_1201263,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaAl2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201263"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686658'}},0.0,8.10972418,520.0,-27.8605497,-4.64342495,{'tags': ['Aluminium lanthanum (2/1)']},-27.8605497,-4.64342495,-0.5010386950000001,"['xas', 'elasticity', 'bandstructure']",True,"[608275, 608277, 608265, 608290, 608288, 57933, 608270, 608269, 603920, 608272, 608286, 608273, 608289, 604450, 608266]",True,2021-05-12 10:56:18.721000,NM,6,10,mp-2694,,LaAl2,"{'functional': 'PBE', 'labels': ['La', 'Al'], 'pot_type': 'paw'}","{'La': 1.0, 'Al': 2.0}",GGA,mp-2694,"['mp-940230', 'mp-925817', 'mp-940644', 'mp-2694', 'mp-1258643', 'mp-1440554', 'mp-1686658', 'mp-1787219', 'mp-1596037', 'mp-1594760']",0.0008869,"{'La': 2.0, 'Al': 4.0}",134.99677475891534,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",1.3139573172527638e-05,0.0008869,0,0.0017738,MP,data/source/MP/cleaned/cifs/MP-mp-2694.cif,True,,data/final/MP/graphs/Al1.825La1Si0.175-MP-mp-2694-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Co0.02Nb3Rh0.98,2,0.01,2.0,False,Co0.04Nb6Rh1.96,Nb6Rh2,2.28,Other,True,Co0.5Nb75Rh24.5,Co-Nb-Rh,3,Supercon,Co0.02Nb3Rh0.98,MP-mp-1545,Nb6Rh2,Nb-Rh,Nb75Rh25,P m -3 n,cubic,5.186072,5.186072,5.186072,data/final/MP/cifs/Co0.02Nb3Rh0.98-MP-mp-1545-synth_doped.cif,data/source/MP/raw/cifs/mp-1545.cif,mp-1545,0.0,,2011-05-14 11:20:25,9.086567873234834,10.17188/1191190,"@misc{osti_1191190,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Rh (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191190"",
    place = ""United States"",
    year = ""2015"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700041'}},0.0,5.48706495,520.0,-77.37430008,-9.67178751,{'tags': ['Niobium rhodium (3/1)']},-77.37430008,-9.67178751,-0.2547317625000005,"['xas', 'elasticity', 'bandstructure']",True,"[105216, 645269]",True,2021-05-12 10:56:12.755000,NM,8,8,mp-1545,,Nb3Rh,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Rh_pv'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Rh': 1.0}",GGA,mp-1545,"['mp-942004', 'mp-943019', 'mp-935201', 'mp-1545', 'mp-1433570', 'mp-1700041', 'mp-1786474', 'mp-1591392']",0.00021655,"{'Nb': 6.0, 'Rh': 2.0}",139.48118416938905,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",3.1050783127424102e-06,0.00021655,0,0.0004331,MP,data/source/MP/cleaned/cifs/MP-mp-1545.cif,True,,data/final/MP/graphs/Co0.02Nb3Rh0.98-MP-mp-1545-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ga3Ti1,1,0.0,1.0,True,Ga3Ti1,Ga3Ti1,0.0,Other,True,Ga75Ti25,Ga-Ti,2,Supercon,Ga3Ti1,MP-mp-2731,Ti1Ga3,Ga-Ti,Ga75Ti25,I 4/m m m,tetragonal,3.80578599649882,3.80578599649882,5.16503618,data/final/MP/cifs/Ga3Ti1-MP-mp-2731.cif,data/source/MP/raw/cifs/mp-2731.cif,mp-2731,0.0,,2011-05-13 02:51:22,6.6842917921890725,10.17188/1201518,"@misc{osti_1201518,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TiGa3 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201518"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-993526'}},0.0,5.03373431,520.0,-18.47402953,-4.6185073825,"{'tags': ['Gallium titanium (3/1)', 'Titanium gallium (1/3)']}",-18.47402953,-4.6185073825,-0.3735623614583332,"['xas', 'elasticity', 'bandstructure']",True,"[103994, 103993, 98937]",True,2021-05-12 10:56:18.721000,NM,4,7,mp-2731,,TiGa3,"{'functional': 'PBE', 'labels': ['Ti_pv', 'Ga_d'], 'pot_type': 'paw'}","{'Ti': 1.0, 'Ga': 3.0}",GGA,mp-2731,"['mp-993526', 'mp-991602', 'mp-2731', 'mp-1439702', 'mp-1792205', 'mp-994835', 'mp-1596166']",0.0007998,"{'Ti': 1.0, 'Ga': 3.0}",63.85393289104404,[],NM,False,139,0,"[0, 0, 0, 0]",1.2525461843747724e-05,0.0007998,0,0.0007998,MP,data/source/MP/cleaned/cifs/MP-mp-2731.cif,False,,data/final/MP/graphs/Ga3Ti1-MP-mp-2731.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ga1Mo3,1,0.0,2.0,False,Ga2Mo6,Ga2Mo6,0.76,Other,True,Ga25Mo75,Ga-Mo,2,Supercon,Ga1Mo3,MP-mp-2377,Ga2Mo6,Ga-Mo,Ga25Mo75,P m -3 n,cubic,4.976645,4.976645,4.976645,data/final/MP/cifs/Ga1Mo3-MP-mp-2377.cif,data/source/MP/raw/cifs/mp-2377.cif,mp-2377,0.0,,2011-05-14 13:41:04,9.633794681143335,10.17188/1199715,"@misc{osti_1199715,
    author = ""Persson, Kristin"",
    title = ""Materials Data on GaMo3 (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199715"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699761'}},0.0,7.63671205,520.0,-72.46971579,-9.05871447375,{'tags': ['Gallium molybdenum (1/3)']},-72.46971579,-9.05871447375,-0.1674581956249987,"['xas', 'bandstructure']",True,"[634695, 634697, 103816]",True,2021-05-12 10:56:59.077000,NM,8,8,mp-2377,,GaMo3,"{'functional': 'PBE', 'labels': ['Ga_d', 'Mo_pv'], 'pot_type': 'paw'}","{'Ga': 1.0, 'Mo': 3.0}",GGA,mp-2377,"['mp-941638', 'mp-934893', 'mp-941323', 'mp-2377', 'mp-1434595', 'mp-1699761', 'mp-1803954', 'mp-1590026']",0.0062048,"{'Ga': 2.0, 'Mo': 6.0}",123.25654410124956,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0001006810639588,0.0062048,0,0.0124096,MP,data/source/MP/cleaned/cifs/MP-mp-2377.cif,False,,data/final/MP/graphs/Ga1Mo3-MP-mp-2377.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba0.54Bi1K0.46O3,3,0.0506666666666666,3.0,False,Ba1.62Bi3K1.38O9,Ba2Bi3K1O9,20.0,Oxide,True,Ba10.8Bi20K9.2O60,Ba-Bi-K-O,4,Supercon,Ba0.54K0.46Bi1O3,MP-mp-1223518,K1Ba2Bi3O9,Ba-Bi-K-O,Ba13.333Bi20K6.667O60,P -3 m 1,trigonal,6.18756400330999,6.187564340000001,7.581401,data/final/MP/cifs/Ba0.54Bi1K0.46O3-MP-mp-1223518-synth_doped.cif,data/source/MP/raw/cifs/mp-1223518.cif,mp-1223518,0.0,,2019-01-12 23:54:06.965000,7.16530091201999,,,{'GGA': {'task_id': 'mp-1729135'}},0.001551682833333,3.46143017,520.0,-85.22271396,-5.681514264,{'tags': []},-85.22271396,-5.681514264,-2.0170414252000004,[],False,[],True,2021-05-12 11:00:52.054000,NM,15,4,mp-1223518,oxide,KBa2(BiO3)3,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Bi', 'O'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 2.0, 'Bi': 3.0, 'O': 9.0}",GGA,mp-1223518,"['mp-1223518', 'mp-1391182', 'mp-1729135', 'mp-1775199']",4.99e-05,"{'K': 1.0, 'Ba': 2.0, 'Bi': 3.0, 'O': 9.0}",251.37352739849624,[],NM,False,164,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.9850936777799505e-07,4.99e-05,0,4.99e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1223518.cif,True,,data/final/MP/graphs/Ba0.54Bi1K0.46O3-MP-mp-1223518-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Au2In1Yb1,1,0.0,1.0,True,Au2In1Yb1,Au2In1Yb1,0.0,Heavy_fermion,True,Au50In25Yb25,Au-In-Yb,3,Supercon,Au2In1Yb1,MP-mp-568537,Yb1In1Au2,Au-In-Yb,Au50In25Yb25,F m -3 m,cubic,4.95895824,4.95895824,4.95895824,data/final/MP/cifs/Au2In1Yb1-MP-mp-568537.cif,data/source/MP/raw/cifs/mp-568537.cif,mp-568537,0.0,,2014-02-16 08:45:55,13.129376237408415,10.17188/1274485,"@misc{osti_1274485,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YbInAu2 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1274485"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703176'}},0.0,5.2044823,520.0,-13.61296856,-3.40324214,{'tags': ['Gold indium ytterbium (2/1/1)']},-13.61296856,-3.40324214,-0.6934783675,"['xas', 'elasticity', 'bandstructure']",True,[58516],True,2021-05-12 10:56:22.739000,NM,4,8,mp-568537,,YbInAu2,"{'functional': 'PBE', 'labels': ['Yb_2', 'In_d', 'Au'], 'pot_type': 'paw'}","{'Yb': 1.0, 'In': 1.0, 'Au': 2.0}",GGA,mp-568537,"['mp-1001572', 'mp-1003682', 'mp-568537', 'mp-1438249', 'mp-1703176', 'mp-1801158', 'mp-1008981', 'mp-1594064']",0.0010436,"{'Yb': 1.0, 'In': 1.0, 'Au': 2.0}",86.2295968551011,[],NM,False,225,0,"[0, 0, 0, 0]",1.2102573107858192e-05,0.0010436,0,0.0010436,MP,data/source/MP/cleaned/cifs/MP-mp-568537.cif,False,,data/final/MP/graphs/Au2In1Yb1-MP-mp-568537.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Nb3Os0.05Rh0.95,2,0.025,2.0,False,Nb6Os0.1Rh1.9,Nb6Rh2,2.39,Other,True,Nb75Os1.25Rh23.75,Nb-Os-Rh,3,Supercon,Nb3Rh0.95Os0.05,MP-mp-1545,Nb6Rh2,Nb-Rh,Nb75Rh25,P m -3 n,cubic,5.186072,5.186072,5.186072,data/final/MP/cifs/Nb3Os0.05Rh0.95-MP-mp-1545-synth_doped.cif,data/source/MP/raw/cifs/mp-1545.cif,mp-1545,0.0,,2011-05-14 11:20:25,9.086567873234834,10.17188/1191190,"@misc{osti_1191190,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Rh (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191190"",
    place = ""United States"",
    year = ""2015"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700041'}},0.0,5.48706495,520.0,-77.37430008,-9.67178751,{'tags': ['Niobium rhodium (3/1)']},-77.37430008,-9.67178751,-0.2547317625000005,"['xas', 'elasticity', 'bandstructure']",True,"[105216, 645269]",True,2021-05-12 10:56:12.755000,NM,8,8,mp-1545,,Nb3Rh,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Rh_pv'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Rh': 1.0}",GGA,mp-1545,"['mp-942004', 'mp-943019', 'mp-935201', 'mp-1545', 'mp-1433570', 'mp-1700041', 'mp-1786474', 'mp-1591392']",0.00021655,"{'Nb': 6.0, 'Rh': 2.0}",139.48118416938905,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",3.1050783127424102e-06,0.00021655,0,0.0004331,MP,data/source/MP/cleaned/cifs/MP-mp-1545.cif,True,,data/final/MP/graphs/Nb3Os0.05Rh0.95-MP-mp-1545-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
As1Hf1Ru1,1,0.0,3.0,False,As3Hf3Ru3,As3Hf3Ru3,3.193333333,Other,True,As33.333Hf33.333Ru33.333,As-Hf-Ru,3,Supercon,Hf1Ru1As1,MP-mp-1079079,Hf3As3Ru3,As-Hf-Ru,As33.333Hf33.333Ru33.333,P -6 2 m,hexagonal,3.920126,6.602171995593371,6.60217228,data/final/MP/cifs/As1Hf1Ru1-MP-mp-1079079.cif,data/source/MP/raw/cifs/mp-1079079.cif,mp-1079079,0.0,,2018-04-14 00:28:26,11.933276341899154,,,{'GGA': {'task_id': 'mp-1699512'}},0.0,7.66061356,520.0,-78.77262088,-8.752513431111112,"{'tags': ['ZrNiAl', 'Hafnium ruthenium arsenide (1/1/1)', 'HfRuAs ht']}",-78.77262088,-8.752513431111112,-0.7889477944444442,['bandstructure'],True,"[604605, 610654]",True,2021-05-12 10:58:16.596000,NM,9,6,mp-1079079,,HfAsRu,"{'functional': 'PBE', 'labels': ['Hf_pv', 'As', 'Ru_pv'], 'pot_type': 'paw'}","{'Hf': 1.0, 'As': 1.0, 'Ru': 1.0}",GGA,mp-1079079,"['mp-1079079', 'mp-1079899', 'mp-1413913', 'mp-1699512', 'mp-1871522', 'mp-1593929']",0.0065651666666666,"{'Hf': 3.0, 'As': 3.0, 'Ru': 3.0}",147.9804527254906,[],NM,False,189,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0001330952814189,0.0065651666666666,0,0.0196955,MP,data/source/MP/cleaned/cifs/MP-mp-1079079.cif,False,,data/final/MP/graphs/As1Hf1Ru1-MP-mp-1079079.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Ag1Be2,1,0.0,2.0,False,Ag2Be4,Ag2Be4,0.0,Other,True,Ag33.333Be66.667,Ag-Be,2,Supercon,Ag1Be2,MP-mp-603,Be4Ag2,Ag-Be,Ag33.333Be66.667,F d -3 m,cubic,4.53949401,4.539494009999999,4.53949401,data/final/MP/cifs/Ag1Be2-MP-mp-603.cif,data/source/MP/raw/cifs/mp-603.cif,mp-603,0.0,,2011-05-12 22:03:03,6.320796766408729,10.17188/1277351,"@misc{osti_1277351,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Be2Ag (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277351"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702890'}},0.0262600461111111,4.43383223,520.0,-20.46520319,-3.4108671983333334,{'tags': ['Silver beryllium (1/2)']},-20.46520319,-3.4108671983333334,0.0262600461111108,"['xas', 'elasticity', 'bandstructure']",True,"[604819, 57347]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-603,,Be2Ag,"{'functional': 'PBE', 'labels': ['Be_sv', 'Ag'], 'pot_type': 'paw'}","{'Be': 2.0, 'Ag': 1.0}",GGA,mp-603,"['mp-933167', 'mp-943511', 'mp-943362', 'mp-603', 'mp-1441097', 'mp-1702890', 'mp-1783727', 'mp-1590210']",8.56e-05,"{'Be': 4.0, 'Ag': 2.0}",66.14657247877813,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",2.588191550740233e-06,8.56e-05,0,0.0001712,MP,data/source/MP/cleaned/cifs/MP-mp-603.cif,False,,data/final/MP/graphs/Ag1Be2-MP-mp-603.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ge1V1Zr1,1,0.0,2.0,False,Ge2V2Zr2,Ge2V2Zr2,6.0,Other,True,Ge33.333V33.333Zr33.333,Ge-V-Zr,3,Supercon,Zr1V1Ge1,MP-mp-10311,Zr2V2Ge2,Ge-V-Zr,Ge33.333V33.333Zr33.333,I 4/m m m,tetragonal,3.7532020015557146,3.7532020015557146,7.75956624,data/final/MP/cifs/Ge1V1Zr1-MP-mp-10311.cif,data/source/MP/raw/cifs/mp-10311.cif,mp-10311,0.0,,2011-05-29 05:26:19,6.945396775110266,10.17188/1186953,"@misc{osti_1186953,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrVGe (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1186953"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701053'}},0.0,5.02275931,520.0,-48.47867374,-8.079778956666667,{'tags': ['Zirconium vanadium germanide (1/1/1)']},-48.47867374,-8.079778956666667,-0.6615674383333333,"['xas', 'elasticity', 'bandstructure']",True,[88210],True,2021-05-12 10:56:10.715000,NM,6,8,mp-10311,,ZrVGe,"{'functional': 'PBE', 'labels': ['Zr_sv', 'V_pv', 'Ge_d'], 'pot_type': 'paw'}","{'Zr': 1.0, 'V': 1.0, 'Ge': 1.0}",GGA,mp-10311,"['mp-926335', 'mp-910581', 'mp-926881', 'mp-10311', 'mp-1428017', 'mp-1701053', 'mp-1797359', 'mp-1592546']",0.0001049,"{'Zr': 2.0, 'V': 2.0, 'Ge': 2.0}",102.71347657164868,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",2.042575200476757e-06,0.0001049,0,0.0002098,MP,data/source/MP/cleaned/cifs/MP-mp-10311.cif,False,,data/final/MP/graphs/Ge1V1Zr1-MP-mp-10311.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ba8Si46,1,0.0,1.0,True,Ba8Si46,Ba8Si46,8.1425,Other,True,Ba14.815Si85.185,Ba-Si,2,Supercon,Ba8Si46,MP-mp-640551,Ba8Si46,Ba-Si,Ba14.815Si85.185,P m -3 n,cubic,10.404287,10.404287,10.404287,data/final/MP/cifs/Ba8Si46-MP-mp-640551.cif,data/source/MP/raw/cifs/mp-640551.cif,mp-640551,0.0,,2013-06-25 09:26:27,3.524599511242846,10.17188/1279943,"@misc{osti_1279943,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba4Si23 (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1279943"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-977968'}},0.0862504638888888,6.74595255,520.0,-271.0342216,-5.019152251851852,"{'tags': ['Barium silicon (8/46)', 'Barium silicide (8/46)']}",-271.0342216,-5.019152251851852,-0.0528150007407404,"['xas', 'bandstructure']",True,"[196332, 90093, 153685, 191764, 186545]",True,2021-05-12 10:57:30.779000,NM,54,10,mp-640551,,Ba4Si23,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Si'], 'pot_type': 'paw'}","{'Ba': 4.0, 'Si': 23.0}",GGA,mp-640551,"['mp-914659', 'mp-977968', 'mp-640551', 'mp-1172468', 'mp-1194566', 'mp-1203038', 'mp-1203432', 'mp-1248569', 'mp-1360713', 'mp-978201']",8.55e-06,"{'Ba': 8.0, 'Si': 46.0}",1126.255619243901,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.5183054102300413e-08,8.55e-06,0,1.71e-05,MP,data/source/MP/cleaned/cifs/MP-mp-640551.cif,False,,data/final/MP/graphs/Ba8Si46-MP-mp-640551.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Pd1,1,0.0,4.0,False,Pd4,Pd4,0.0,Other,True,Pd100,Pd,1,Supercon,Pd1,MP-mp-1186427,Pd4,Pd,Pd100,P 63/m m c,hexagonal,2.797697997696235,2.7976975300000007,9.148043,data/final/MP/cifs/Pd1-MP-mp-1186427.cif,data/source/MP/raw/cifs/mp-1186427.cif,mp-1186427,0.0,,2019-01-11 14:19:02.695000,11.399136295945397,,,{'GGA': {'task_id': 'mp-1731839'}},0.0067209850000002,3.7676712,520.0,-20.6926433,-5.173160825,{'tags': []},-20.6926433,-5.173160825,0.0067209850000002,['bandstructure'],True,[],True,2021-05-12 10:58:29.672000,NM,4,5,mp-1186427,,Pd,"{'functional': 'PBE', 'labels': ['Pd'], 'pot_type': 'paw'}",{'Pd': 1.0},GGA,mp-1186427,"['mp-1186427', 'mp-1428492', 'mp-1731839', 'mp-1783514', 'mp-1617196']",0.000856575,{'Pd': 4.0},62.0098094731715,[],NM,False,194,0,"[0, 0, 0, 0]",5.525416106112028e-05,0.000856575,0,0.0034263,MP,data/source/MP/cleaned/cifs/MP-mp-1186427.cif,False,,data/final/MP/graphs/Pd1-MP-mp-1186427.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
In0.5Pb0.5,1,0.0,2.0,False,In1Pb1,In1Pb1,5.0525,Other,True,In50Pb50,In-Pb,2,Supercon,In0.5Pb0.5,MP-mp-1223654,In1Pb1,In-Pb,In50Pb50,R -3 m,trigonal,3.511616386066623,3.511616386066623,6.02845204,data/final/MP/cifs/In0.5Pb0.5-MP-mp-1223654.cif,data/source/MP/raw/cifs/mp-1223654.cif,mp-1223654,0.0,,2019-01-13 00:01:10.481000,8.81947142577353,,,{'GGA': {'task_id': 'mp-1735316'}},0.0242910866666665,6.68029603,520.0,-6.41809862,-3.20904931,{'tags': []},-6.41809862,-3.20904931,0.0231160899999998,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,2,5,mp-1223654,,InPb,"{'functional': 'PBE', 'labels': ['In_d', 'Pb_d'], 'pot_type': 'paw'}","{'In': 1.0, 'Pb': 1.0}",GGA,mp-1223654,"['mp-1223654', 'mp-1420829', 'mp-1735316', 'mp-1782917', 'mp-1609734']",0.0046548,"{'In': 1.0, 'Pb': 1.0}",60.62987715859624,[],NM,False,166,0,"[0, 0]",7.67740298701897e-05,0.0046548,0,0.0046548,MP,data/source/MP/cleaned/cifs/MP-mp-1223654.cif,False,,data/final/MP/graphs/In0.5Pb0.5-MP-mp-1223654.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Rh4Sn13Sr3,1,0.0,2.0,False,Rh8Sn26Sr6,Rh8Sn26Sr6,4.216666667,Other,True,Rh20Sn65Sr15,Rh-Sn-Sr,3,Supercon,Sr3Rh4Sn13,MP-mp-30517,Sr6Sn26Rh8,Rh-Sn-Sr,Rh20Sn65Sr15,P m -3 n,cubic,9.942976,9.942976,9.942976,data/final/MP/cifs/Rh4Sn13Sr3-MP-mp-30517.cif,data/source/MP/raw/cifs/mp-30517.cif,mp-30517,0.0,,2014-02-15 09:26:24,7.492643445136223,10.17188/1204917,"@misc{osti_1204917,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr3Sn13Rh4 (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1204917"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1679090'}},0.0,7.2506427,520.0,-193.91607355,-4.84790183875,"{'tags': ['Strontium rhodium tin (3/4/13)', 'Strontium rhodium stannide (3/4/13)']}",-193.91607355,-4.84790183875,-0.5153945409999998,"['xas', 'bandstructure']",True,"[102359, 650390, 650389]",True,2021-05-12 10:57:04.957000,NM,40,7,mp-30517,,Sr3Sn13Rh4,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Sn_d', 'Rh_pv'], 'pot_type': 'paw'}","{'Sr': 3.0, 'Sn': 13.0, 'Rh': 4.0}",GGA,mp-30517,"['mp-941532', 'mp-941159', 'mp-934662', 'mp-30517', 'mp-1200308', 'mp-1346689', 'mp-1679090']",0.00074225,"{'Sr': 6.0, 'Sn': 26.0, 'Rh': 8.0}",982.9901666702534,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.510188046975631e-06,0.00074225,0,0.0014845,MP,data/source/MP/cleaned/cifs/MP-mp-30517.cif,False,,data/final/MP/graphs/Rh4Sn13Sr3-MP-mp-30517.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ca0.7Cu2Pb0.5Sr2Tl0.5Y0.3O7,3,0.0461538461538461,2.0,False,Ca1.4Cu4Pb1Sr4Tl1Y0.6O14,Ca2Cu4Pb1Sr4Tl1O14,0.0,Cuprate,True,Ca5.385Cu15.385Pb3.846Sr15.385Tl3.846Y2.308O53.84615384615385,Ca-Cu-Pb-Sr-Tl-Y-O,7,Supercon,Tl0.5Pb0.5Sr2Ca0.7Y0.3Cu2O7,MP-mp-1173221,Sr4Ca2Tl1Cu4Pb1O14,Ca-Cu-Pb-Sr-Tl-O,Ca7.692Cu15.385Pb3.846Sr15.385Tl3.846O53.84615384615385,I 4/m m m,tetragonal,5.374731999708263,5.374731999708263,12.82905816,data/final/MP/cifs/Ca0.7Cu2Pb0.5Sr2Tl0.5Y0.3O7-MP-mp-1173221-synth_doped.cif,data/source/MP/raw/cifs/mp-1173221.cif,mp-1173221,0.0,,2019-01-11 01:27:33.089000,6.194266073733895,,,,0.0254255932211506,3.8256747,520.0,-146.89191057,-5.649688868076923,{'tags': []},-146.89191057,-5.649688868076923,-2.0768140780769224,[],False,[],True,2021-05-12 10:59:37.456000,NM,26,4,mp-1173221,oxide,Sr4Ca2TlCu4PbO14,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Tl_d', 'Cu_pv', 'Pb_d', 'O'], 'pot_type': 'paw'}","{'Sr': 4.0, 'Ca': 2.0, 'Tl': 1.0, 'Cu': 4.0, 'Pb': 1.0, 'O': 14.0}",GGA,mp-1173221,"['mp-1173221', 'mp-1218598', 'mp-1366452', 'mp-1839546']",0.0074263,"{'Sr': 4.0, 'Ca': 2.0, 'Tl': 1.0, 'Cu': 4.0, 'Pb': 1.0, 'O': 14.0}",353.9672478853857,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",2.098018967677097e-05,0.0074263,0,0.0074263,MP,data/source/MP/cleaned/cifs/MP-mp-1173221.cif,True,,data/final/MP/graphs/Ca0.7Cu2Pb0.5Sr2Tl0.5Y0.3O7-MP-mp-1173221-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
In0.8La3Sn0.2,3,0.0999999999999999,1.0,True,In0.8La3Sn0.2,In1La3,7.8,Other,True,In20La75Sn5,In-La-Sn,3,Supercon,In0.8La3Sn0.2,MP-mp-20909,La3In1,In-La,In25La75,P m -3 m,cubic,5.076766,5.076766,5.076766,data/final/MP/cifs/In0.8La3Sn0.2-MP-mp-20909-synth_doped.cif,data/source/MP/raw/cifs/mp-20909.cif,mp-20909,0.0,,2014-02-21 06:52:52,6.7455760598452565,10.17188/1196104,"@misc{osti_1196104,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La3In (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196104"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671685'}},0.0,8.16935076,520.0,-18.73796121,-4.6844903025,"{'tags': ['Indium lanthanum (1/3)', 'Lanthanum indium (3/1)']}",-18.73796121,-4.6844903025,-0.2945640412500001,"['xas', 'bandstructure']",True,"[639844, 51950, 639851, 639840, 603208, 107019]",True,2021-05-12 10:56:57.051000,NM,4,8,mp-20909,,La3In,"{'functional': 'PBE', 'labels': ['La', 'In_d'], 'pot_type': 'paw'}","{'La': 3.0, 'In': 1.0}",GGA,mp-20909,"['mp-906743', 'mp-921394', 'mp-920373', 'mp-20909', 'mp-1476042', 'mp-1671685', 'mp-1778647', 'mp-1590323']",0.0489742,"{'La': 3.0, 'In': 1.0}",130.84629766481785,[],NM,False,221,0,"[0, 0, 0, 0]",0.0003742880071811,0.0489742,0,0.0489742,MP,data/source/MP/cleaned/cifs/MP-mp-20909.cif,True,,data/final/MP/graphs/In0.8La3Sn0.2-MP-mp-20909-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Pd0.3Zr0.7,3,0.0666666666666666,3.0,False,Pd0.9Zr2.1,Pd1Zr2,2.53,Other,True,Pd30Zr70,Pd-Zr,2,Supercon,Pd0.3Zr0.7,MP-mp-266,Zr2Pd1,Pd-Zr,Pd33.333Zr66.667,I 4/m m m,tetragonal,3.3580019980484703,3.3580019980484703,5.91909309,data/final/MP/cifs/Pd0.3Zr0.7-MP-mp-266-synth_doped.cif,data/source/MP/raw/cifs/mp-266.cif,mp-266,0.0,,2011-05-12 21:30:36,7.845685271874635,10.17188/1201202,"@misc{osti_1201202,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Zr2Pd (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201202"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688097'}},0.0,4.68790204,520.0,-23.73938079,-7.91312693,"{'tags': ['Palladium zirconium (1/2)', 'Palladium zironium hydride (1/2/2)']}",-23.73938079,-7.91312693,-0.4880325733333326,"['xas', 'elasticity', 'bandstructure']",True,"[601954, 649146, 105758, 186412, 649158, 109133]",True,2021-05-12 10:56:18.721000,NM,3,12,mp-266,,Zr2Pd,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Pd'], 'pot_type': 'paw'}","{'Zr': 2.0, 'Pd': 1.0}",GGA,mp-266,"['mp-914366', 'mp-977842', 'mp-266', 'mp-1062819', 'mp-1062894', 'mp-1062980', 'mp-1442272', 'mp-1688097', 'mp-1784401', 'mp-992491', 'mp-1591765', 'mp-1062949']",0.0017364,"{'Zr': 2.0, 'Pd': 1.0}",61.13890405598638,[],NM,False,139,0,"[0, 0, 0]",2.8400901632288605e-05,0.0017364,0,0.0017364,MP,data/source/MP/cleaned/cifs/MP-mp-266.cif,True,,data/final/MP/graphs/Pd0.3Zr0.7-MP-mp-266-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
C0.9Nb1,3,0.0526315789473684,1.0,True,C0.9Nb1,C1Nb1,5.0,Other,True,C47.368Nb52.632,C-Nb,2,Supercon,C0.9Nb1,MP-mp-910,Nb1C1,C-Nb,C50Nb50,F m -3 m,cubic,3.18634336,3.1863433599999995,3.1863433599999995,data/final/MP/cifs/C0.9Nb1-MP-mp-910-synth_doped.cif,data/source/MP/raw/cifs/mp-910.cif,mp-910,0.0,,2011-05-12 17:28:40,7.616098778357742,10.17188/1282001,"@misc{osti_1282001,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbC (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1282001"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686610'}},0.0408750508333302,7.39992982,520.0,-20.24633413,-10.123167065,"{'tags': ['Niobium carbide (1/1)', 'Niobium carbide (1/1) - RS-type']}",-20.24633413,-10.123167065,-0.4591241950000011,"['xas', 'elasticity', 'bandstructure']",True,"[618465, 77214, 187077, 618456, 181792, 618453, 94449, 618472, 183163, 237582, 618457, 159872, 618480, 618475, 618482, 618469, 155164, 618466, 44355, 618450, 618458, 618449, 44496, 618463, 618462, 618460, 618481, 618471, 618476, 181052, 601142, 618448, 189089, 618478, 26955, 618473, 618484, 618483]",True,2021-05-12 10:56:35.166000,NM,2,25,mp-910,,NbC,"{'functional': 'PBE', 'labels': ['Nb_pv', 'C'], 'pot_type': 'paw'}","{'Nb': 1.0, 'C': 1.0}",GGA,mp-910,"['mp-1000444', 'mp-1001333', 'mp-910', 'mp-1057158', 'mp-1057178', 'mp-1057130', 'mp-1057651', 'mp-1057669', 'mp-1057682', 'mp-1057771', 'mp-1057779', 'mp-1057802', 'mp-1060960', 'mp-1060978', 'mp-1061015', 'mp-1440938', 'mp-1686610', 'mp-1805660', 'mp-1007673', 'mp-1593845', 'mp-1596940', 'mp-1061007', 'mp-1057677', 'mp-1057792', 'mp-1057174']",3.33e-05,"{'Nb': 1.0, 'C': 1.0}",22.87508541625878,[],NM,False,225,0,"[0, 0]",1.4557322691495426e-06,3.33e-05,0,3.33e-05,MP,data/source/MP/cleaned/cifs/MP-mp-910.cif,True,,data/final/MP/graphs/C0.9Nb1-MP-mp-910-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ce0.28La0.72Ru2,3,0.1466666666666666,2.0,False,Ce0.56La1.44Ru4,Ce1La1Ru4,1.278,Other,True,Ce9.333La24Ru66.667,Ce-La-Ru,3,Supercon,La0.72Ce0.28Ru2,MP-mp-1222913,La1Ce1Ru4,Ce-La-Ru,Ce16.667La16.667Ru66.667,F -4 3 m,cubic,5.407204540000001,5.40720454,5.40720454,data/final/MP/cifs/Ce0.28La0.72Ru2-MP-mp-1222913-synth_doped.cif,data/source/MP/raw/cifs/mp-1222913.cif,mp-1222913,0.0,,2019-01-12 23:22:50.626000,10.149813335401207,,,{'GGA': {'task_id': 'mp-1717130'}},0.0,8.64426336,520.0,-49.23252279,-8.205420465,{'tags': []},-49.23252279,-8.205420465,-0.2109779849999995,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,6,5,mp-1222913,,LaCeRu4,"{'functional': 'PBE', 'labels': ['La', 'Ce', 'Ru_pv'], 'pot_type': 'paw'}","{'La': 1.0, 'Ce': 1.0, 'Ru': 4.0}",GGA,mp-1222913,"['mp-1222913', 'mp-1394759', 'mp-1717130', 'mp-1804881', 'mp-1626317']",0.0208777,"{'La': 1.0, 'Ce': 1.0, 'Ru': 4.0}",111.79011354255184,[],NM,False,216,0,"[0.0, -0.0, 0.0, 0.0, 0.0, 0.0]",0.0001867580176672,0.0208777,0,0.0208777,MP,data/source/MP/cleaned/cifs/MP-mp-1222913.cif,True,,data/final/MP/graphs/Ce0.28La0.72Ru2-MP-mp-1222913-synth_doped.json,0,True,-43m,5,0,0,0,0,0,0,0,0,0,1,1.0,False
Fe1P1,1,0.0,4.0,False,Fe4P4,Fe4P4,0.0,Ferrite,True,Fe50P50,Fe-P,2,Supercon,Fe1P1,MP-mp-1005,Fe4P4,Fe-P,Fe50P50,P n m a,orthorhombic,3.05259,5.148002,5.759138,data/final/MP/cifs/Fe1P1-MP-mp-1005.cif,data/source/MP/raw/cifs/mp-1005.cif,mp-1005,0.0,,2011-05-13 19:36:27,6.371739444433107,10.17188/1185082,"@misc{osti_1185082,
    author = ""Persson, Kristin"",
    title = ""Materials Data on FeP (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1185082"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677526'}},0.0,9.18015634,520.0,-60.32067852,-7.540084815,"{'tags': ['Iron phosphide (1/1)', 'Iron phosphide', 'Iron(III) phosphide']}",-60.32067852,-7.540084815,-0.5984293366666673,"['xas', 'elasticity', 'bandstructure']",True,"[62607, 633056, 633050, 633046, 43248, 43400]",True,2021-05-12 10:56:08.727000,FM,8,9,mp-1005,,FeP,"{'functional': 'PBE', 'labels': ['Fe_pv', 'P'], 'pot_type': 'paw'}","{'Fe': 1.0, 'P': 1.0}",GGA,mp-1005,"['mp-922345', 'mp-923113', 'mp-907790', 'mp-1005', 'mp-22241', 'mp-1437665', 'mp-1677526', 'mp-1796426', 'mp-1589063']",0.397902875,"{'Fe': 4.0, 'P': 4.0}",90.50335298365228,[],FM,True,62,1,"[0.4, 0.4, 0.4, 0.4, 0.0, 0.0, 0.0, 0.0]",0.0175862158420527,0.397902875,4,1.5916115,MP,data/source/MP/cleaned/cifs/MP-mp-1005.cif,False,,data/final/MP/graphs/Fe1P1-MP-mp-1005.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Co0.9Ni0.1Zr2,3,0.0666666666666666,2.0,False,Co1.8Ni0.2Zr4,Co2Zr4,5.94,Other,True,Co30Ni3.333Zr66.667,Co-Ni-Zr,3,Supercon,Zr2Co0.9Ni0.1,MP-mp-628,Zr4Co2,Co-Zr,Co33.333Zr66.667,I 4/m c m,tetragonal,5.27792884001752,5.27792884,5.277928840000001,data/final/MP/cifs/Co0.9Ni0.1Zr2-MP-mp-628-synth_doped.cif,data/source/MP/raw/cifs/mp-628.cif,mp-628,0.0,,2011-05-13 12:16:44,7.17077101131263,10.17188/1278899,"@misc{osti_1278899,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Zr2Co (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278899"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677545'}},0.0,4.51380976,520.0,-49.95120762,-8.325201269999999,"{'tags': ['Cobalt zirconium (1/2)', 'Zirconium cobalt (2/1)']}",-49.95120762,-8.325201269999999,-0.2572949183333328,"['xas', 'elasticity', 'bandstructure']",True,"[625671, 191386, 625688, 102740, 625665]",True,2021-05-12 10:56:27.046000,NM,6,20,mp-628,,Zr2Co,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Co'], 'pot_type': 'paw'}","{'Zr': 2.0, 'Co': 1.0}",GGA,mp-628,"['mp-928347', 'mp-912327', 'mp-928866', 'mp-628', 'mp-1071352', 'mp-1071381', 'mp-1071431', 'mp-1071762', 'mp-1071803', 'mp-1071859', 'mp-1071883', 'mp-1071742', 'mp-1071925', 'mp-1441633', 'mp-1677545', 'mp-1802810', 'mp-1591799', 'mp-1071792', 'mp-1071416', 'mp-1071915']",0.0001226,"{'Zr': 4.0, 'Co': 2.0}",111.79353060019714,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0]",2.1933290654975308e-06,0.0001226,0,0.0002452,MP,data/source/MP/cleaned/cifs/MP-mp-628.cif,True,,data/final/MP/graphs/Co0.9Ni0.1Zr2-MP-mp-628-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ti1O1,1,0.0,3.0,False,Ti3O3,Ti3O3,0.72,Oxide,True,Ti50O50,Ti-O,2,Supercon,O1Ti1,MP-mp-1071163,Ti3O3,Ti-O,Ti50O50,P -6 2 m,hexagonal,2.882,5.018533996843054,5.01853492,data/final/MP/cifs/Ti1O1-MP-mp-1071163.cif,data/source/MP/raw/cifs/mp-1071163.cif,mp-1071163,0.0,,2018-03-22 04:46:02,5.061326249939046,,,{'GGA': {'task_id': 'mp-1671500'}},0.0,8.43623776,520.0,-53.91709674,-8.986182789999999,{'tags': ['Titanium oxide']},-53.91709674,-8.986182789999999,-2.9079562791666667,['bandstructure'],True,[196273],True,2021-05-12 10:58:14.654000,NM,6,8,mp-1071163,oxide,TiO,"{'functional': 'PBE', 'labels': ['Ti_pv', 'O'], 'pot_type': 'paw'}","{'Ti': 1.0, 'O': 1.0}",GGA,mp-1071163,"['mp-1071163', 'mp-1071204', 'mp-1071247', 'mp-1301050', 'mp-1671500', 'mp-1792807', 'mp-1588087', 'mp-1071237']",1.07e-05,"{'Ti': 3.0, 'O': 3.0}",62.86059048913085,[],NM,False,189,0,"[0, 0, 0, 0, 0, 0]",5.106538094889576e-07,1.07e-05,0,3.21e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1071163.cif,False,,data/final/MP/graphs/Ti1O1-MP-mp-1071163.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Cr3Si1,1,0.0,2.0,False,Cr6Si2,Cr6Si2,0.0,Other,True,Cr75Si25,Cr-Si,2,Supercon,Cr3Si1,MP-mp-729,Cr6Si2,Cr-Si,Cr75Si25,P m -3 n,cubic,4.518832,4.518832,4.518832,data/final/MP/cifs/Cr3Si1-MP-mp-729.cif,data/source/MP/raw/cifs/mp-729.cif,mp-729,0.0,,2011-05-13 22:31:38,6.625100709326577,10.17188/1282247,"@misc{osti_1282247,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Cr3Si (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1282247"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686672'}},0.0,8.60460275,520.0,-71.49414825,-8.93676853125,"{'tags': ['Chromium silicon (3/1)', 'Chromium silicide (3/1)', 'Chromium silicide (3/1) - beta']}",-71.49414825,-8.93676853125,-0.3229044237499998,"['bandstructure', 'elasticity']",True,"[626777, 626771, 626786, 186001, 626767, 626797, 626775, 32509, 626780, 626764, 626779, 16835, 626761, 53218, 626790]",True,2021-05-12 10:56:29.056000,NM,8,12,mp-729,,Cr3Si,"{'functional': 'PBE', 'labels': ['Cr_pv', 'Si'], 'pot_type': 'paw'}","{'Cr': 3.0, 'Si': 1.0}",GGA,mp-729,"['mp-921765', 'mp-920723', 'mp-907285', 'mp-729', 'mp-1079503', 'mp-1124868', 'mp-1132793', 'mp-1440933', 'mp-1686672', 'mp-1782012', 'mp-1594057', 'mp-1589361']",0.00050125,"{'Cr': 6.0, 'Si': 2.0}",92.273838375684,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.0864401195910137e-05,0.00050125,0,0.0010025,MP,data/source/MP/cleaned/cifs/MP-mp-729.cif,False,,data/final/MP/graphs/Cr3Si1-MP-mp-729.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Nb3Pt1,1,0.0,2.0,False,Nb6Pt2,Nb6Pt2,9.516428571,Other,True,Nb75Pt25,Nb-Pt,2,Supercon,Nb3Pt1,MP-mp-2663,Nb6Pt2,Nb-Pt,Nb75Pt25,P m -3 n,cubic,5.206284,5.206284,5.206284,data/final/MP/cifs/Nb3Pt1-MP-mp-2663.cif,data/source/MP/raw/cifs/mp-2663.cif,mp-2663,0.0,,2011-05-14 02:42:41,11.150477426700435,10.17188/1201206,"@misc{osti_1201206,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Pt (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201206"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1667983'}},0.0,5.9039275,520.0,-75.80228808,-9.47528601,{'tags': ['Niobium platinum (3/1)']},-75.80228808,-9.47528601,-0.3815803024999997,"['xas', 'elasticity', 'bandstructure']",True,"[645231, 645226, 645216, 645227, 105203, 645228, 645218, 645236, 645224]",True,2021-05-12 10:56:18.721000,NM,8,8,mp-2663,,Nb3Pt,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Pt'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Pt': 1.0}",GGA,mp-2663,"['mp-929425', 'mp-912670', 'mp-929036', 'mp-2663', 'mp-1438686', 'mp-1667983', 'mp-1778280', 'mp-1593946']",0.0004491,"{'Nb': 6.0, 'Pt': 2.0}",141.11837435118034,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",6.364869239244375e-06,0.0004491,0,0.0008982,MP,data/source/MP/cleaned/cifs/MP-mp-2663.cif,False,,data/final/MP/graphs/Nb3Pt1-MP-mp-2663.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Cu1La2O4.017,2,0.0020765895071154,0.9959226620197494,True,Cu0.996La1.992O4,Cu1La2O4,34.7,Cuprate,True,Cu14.251La28.502O57.24668661821291,Cu-La-O,3,Supercon,La2Cu1O4.017,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La2O4.017-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La2O4.017-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Cu1La1.89Na0.11O4,2,0.0314285714285714,1.0,True,Cu1La1.89Na0.11O4,Cu1La2O4,16.0,Cuprate,True,Cu14.286La27Na1.571O57.142857142857146,Cu-La-Na-O,4,Supercon,La1.89Na0.11Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La1.89Na0.11O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La1.89Na0.11O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ba2Ca0.2Cu3Y0.8O7,3,0.0307692307692307,1.0,True,Ba2Ca0.2Cu3Y0.8O7,Ba2Cu3Y1O7,71.6,Cuprate,True,Ba15.385Ca1.538Cu23.077Y6.154O53.84615384615385,Ba-Ca-Cu-Y-O,5,Supercon,Y0.8Ca0.2Ba2Cu3O7,MP-mp-20674,Ba2Y1Cu3O7,Ba-Cu-Y-O,Ba15.385Cu23.077Y7.692O53.84615384615385,P m m m,orthorhombic,3.844668,3.926152,11.823664,data/final/MP/cifs/Ba2Ca0.2Cu3Y0.8O7-MP-mp-20674-synth_doped.cif,data/source/MP/raw/cifs/mp-20674.cif,mp-20674,0.0,,2014-02-22 18:23:22,6.198285186087997,10.17188/1195834,"@misc{osti_1195834,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2YCu3O7 (SG:47) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195834"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686609'}},0.0313759126602519,3.28295453,520.0,-80.7708035,-6.213138730769231,"{'tags': ['Yttrium barium copper oxide (1/2/3/7)', 'Dibarium yttrium dicopper copper(III) oxide', 'Yttrium barium copper oxide (1/2/3/6.93)', 'Dibarium yttrium copper(III) dicopper oxide', 'High pressure experimental phase', 'Yttrium dibarium dicopper copper(III) oxide']}",-80.7708035,-6.213138730769231,-2.180157206282052,"['xas', 'elasticity', 'bandstructure']",True,"[196266, 196264, 196265, 71423, 66620, 63483, 66621, 164530, 56507, 63487, 66602, 66601, 68394, 63486, 63485, 202774, 62466, 62465, 41646, 65224, 202773, 66600, 63335, 66611, 78598, 66617, 81175, 66610, 66619, 66615, 63484, 86958, 262809, 66609, 184677, 202775, 66616, 63488, 66618, 66623, 202771, 66622, 202772, 77737, 202770, 62928, 77745]",True,2021-05-12 10:56:14.760000,NM,13,14,mp-20674,oxide,Ba2YCu3O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Cu': 3.0, 'O': 7.0}",GGA,mp-20674,"['mp-923155', 'mp-917354', 'mp-922372', 'mp-20674', 'mp-1103385', 'mp-1103741', 'mp-1103748', 'mp-1104329', 'mp-1104589', 'mp-1440689', 'mp-1686609', 'mp-1832558', 'mp-1596594', 'mp-1592890']",0.0001806,"{'Ba': 2.0, 'Y': 1.0, 'Cu': 3.0, 'O': 7.0}",178.47526348558395,[],NM,False,47,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.0119049355799813e-06,0.0001806,0,0.0001806,MP,data/source/MP/cleaned/cifs/MP-mp-20674.cif,True,,data/final/MP/graphs/Ba2Ca0.2Cu3Y0.8O7-MP-mp-20674-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Cu2Nb1Sm1Sr2O8,1,0.0,2.0,False,Cu4Nb2Sm2Sr4O16,Cu4Nb2Sm2Sr4O16,0.0,Cuprate,True,Cu14.286Nb7.143Sm7.143Sr14.286O57.142857142857146,Cu-Nb-Sm-Sr-O,5,Supercon,Nb1Sr2Sm1Cu2O8,MP-mp-18490,Sr4Sm2Nb2Cu4O16,Cu-Nb-Sm-Sr-O,Cu14.286Nb7.143Sm7.143Sr14.286O57.142857142857146,I 4/m c m,tetragonal,5.520823999123331,5.52082399912333,12.458230469999998,data/final/MP/cifs/Cu2Nb1Sm1Sr2O8-MP-mp-18490.cif,data/source/MP/raw/cifs/mp-18490.cif,mp-18490,0.0,,2014-02-14 16:48:49,6.203763383854236,10.17188/1193132,"@misc{osti_1193132,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr2SmNb(CuO4)2 (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1193132"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1733159'}},0.0143995550446556,3.87749178,520.0,-196.7307529,-7.026098317857143,{'tags': ['Distrontium samarium niobium dicopper oxide']},-196.7307529,-7.026098317857143,-2.705742642023809,"['xas', 'bandstructure']",True,[41627],True,2021-05-12 10:56:55.092000,NM,28,8,mp-18490,oxide,Sr2SmNb(CuO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Sm_3', 'Nb_pv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Sm': 1.0, 'Nb': 1.0, 'Cu': 2.0, 'O': 8.0}",GGA,mp-18490,"['mp-916075', 'mp-932569', 'mp-931514', 'mp-18490', 'mp-1393301', 'mp-1733159', 'mp-1844153', 'mp-1616239']",0.0270036,"{'Sr': 4.0, 'Sm': 2.0, 'Nb': 2.0, 'Cu': 4.0, 'O': 16.0}",360.5967492287044,[],NM,False,140,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.000149771732872,0.0270036,0,0.0540072,MP,data/source/MP/cleaned/cifs/MP-mp-18490.cif,False,,data/final/MP/graphs/Cu2Nb1Sm1Sr2O8-MP-mp-18490.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Cu1Se2,1,0.0,2.0,False,Cu2Se4,Cu2Se4,2.22375,Other,True,Cu33.333Se66.667,Cu-Se,2,Supercon,Cu1Se2,MP-mp-2000,Cu2Se4,Cu-Se,Cu33.333Se66.667,P n n m,orthorhombic,3.810957,5.042092,6.218563,data/final/MP/cifs/Cu1Se2-MP-mp-2000.cif,data/source/MP/raw/cifs/mp-2000.cif,mp-2000,0.0,,2011-05-13 07:33:00,6.155329443959485,10.17188/1195176,"@misc{osti_1195176,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CuSe2 (SG:58) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195176"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677388'}},0.0,4.65801852,520.0,-22.68152542,-3.7802542366666665,"{'tags': ['Copper selenide (1/2)', 'Copper perselenide']}",-22.68152542,-3.7802542366666665,-0.3979110282291659,"['xas', 'elasticity', 'bandstructure']",True,"[25717, 629028, 629033, 242, 42118]",True,2021-05-12 10:56:14.760000,NM,6,8,mp-2000,,CuSe2,"{'functional': 'PBE', 'labels': ['Cu_pv', 'Se'], 'pot_type': 'paw'}","{'Cu': 1.0, 'Se': 2.0}",GGA,mp-2000,"['mp-927045', 'mp-926524', 'mp-917599', 'mp-2000', 'mp-1437988', 'mp-1677388', 'mp-1786066', 'mp-1594435']",0.0005509,"{'Cu': 2.0, 'Se': 4.0}",119.49090565234614,[],NM,False,58,0,"[0, 0, 0, 0, 0, 0]",9.22078541446193e-06,0.0005509,0,0.0011018,MP,data/source/MP/cleaned/cifs/MP-mp-2000.cif,False,,data/final/MP/graphs/Cu1Se2-MP-mp-2000.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ce1Ge3Ni1,1,0.0,2.0,False,Ce2Ge6Ni2,Ce2Ge6Ni2,0.455,Heavy_fermion,True,Ce20Ge60Ni20,Ce-Ge-Ni,3,Supercon,Ce1Ni1Ge3,MP-mp-1205748,Ce2Ni2Ge6,Ce-Ge-Ni,Ce20Ge60Ni20,C m m m,orthorhombic,4.152862,4.170156,11.10566145,data/final/MP/cifs/Ce1Ge3Ni1-MP-mp-1205748.cif,data/source/MP/raw/cifs/mp-1205748.cif,mp-1205748,0.0,,2019-01-12 09:12:03.199000,7.325139284795158,,,,0.0101168149999999,6.00046587,520.0,-56.87227568,-5.687227568,"{'tags': ['CeNiGe3', 'SmNiGe3']}",-56.87227568,-5.687227568,-0.5707656880000002,[],False,[],True,2021-05-12 11:00:17.126000,FM,10,2,mp-1205748,,CeNiGe3,"{'functional': 'PBE', 'labels': ['Ce', 'Ni_pv', 'Ge_d'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Ni': 1.0, 'Ge': 3.0}",GGA,mp-1205748,"['mp-1205748', 'mp-1827759']",0.27548565,"{'Ce': 2.0, 'Ni': 2.0, 'Ge': 6.0}",188.9371442634976,[],FM,True,38,1,"[0.2, 0.4, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0029161618915526,0.27548565,2,0.5509713,MP,data/source/MP/cleaned/cifs/MP-mp-1205748.cif,False,,data/final/MP/graphs/Ce1Ge3Ni1-MP-mp-1205748.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Cu0.8La2Li0.2O4,3,0.0571428571428571,1.0,True,Cu0.8La2Li0.2O4,Cu1La2O4,0.0,Cuprate,True,Cu11.429La28.571Li2.857O57.142857142857146,Cu-La-Li-O,4,Supercon,La2Cu0.8Li0.2O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu0.8La2Li0.2O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu0.8La2Li0.2O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ge2Ir2La1,1,0.0,2.0,False,Ge4Ir4La2,Ge4Ir4La2,1.5,Other,True,Ge40Ir40La20,Ge-Ir-La,3,Supercon,La1Ir2Ge2,MP-mp-1095046,La2Ge4Ir4,Ge-Ir-La,Ge40Ir40La20,P 4/n m m,tetragonal,4.308179,4.308179,10.289238,data/final/MP/cifs/Ge2Ir2La1-MP-mp-1095046.cif,data/source/MP/raw/cifs/mp-1095046.cif,mp-1095046,0.0,,2018-04-26 18:40:32,11.627528701697608,,,{'GGA': {'task_id': 'mp-1697474'}},0.0,7.51898016,520.0,-71.8242575,-7.18242575,{'tags': ['Lanthanum iridium germanide (1/2/2)']},-71.8242575,-7.18242575,-0.8106410190000005,['bandstructure'],True,[636699],True,2021-05-12 10:58:18.470000,NM,10,5,mp-1095046,,La(GeIr)2,"{'functional': 'PBE', 'labels': ['La', 'Ge_d', 'Ir'], 'pot_type': 'paw'}","{'La': 1.0, 'Ge': 2.0, 'Ir': 2.0}",GGA,mp-1095046,"['mp-1095046', 'mp-1418453', 'mp-1697474', 'mp-1787769', 'mp-1599840']",0.0002612,"{'La': 2.0, 'Ge': 4.0, 'Ir': 4.0}",190.97243775666428,[],NM,False,129,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.735473276335501e-06,0.0002612,0,0.0005224,MP,data/source/MP/cleaned/cifs/MP-mp-1095046.cif,False,,data/final/MP/graphs/Ge2Ir2La1-MP-mp-1095046.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Fe1.5K1S2,3,0.1333333333333333,1.0,True,Fe1.5K1S2,Fe2K1S2,0.0,Ferrite,True,Fe33.333K22.222S44.444,Fe-K-S,3,Supercon,K1Fe1.5S2,MP-mp-1070151,K1Fe2S2,Fe-K-S,Fe40K20S40,I 4/m m m,tetragonal,3.693185999471219,3.693185999471219,6.9328373,data/final/MP/cifs/Fe1.5K1S2-MP-mp-1070151-synth_doped.cif,data/source/MP/raw/cifs/mp-1070151.cif,mp-1070151,0.0,,2018-03-22 02:37:08,4.074154778309566,,,{'GGA': {'task_id': 'mp-1765722'}},0.0,5.25657246,520.0,-29.69471726,-5.938943452,{'tags': ['Potassium iron sulfide (1/2/2)']},-29.69471726,-5.938943452,-0.8754803358500005,['bandstructure'],True,[186572],True,2021-05-12 10:58:14.654000,NM,5,8,mp-1070151,,K(FeS)2,"{'functional': 'PBE', 'labels': ['K_sv', 'Fe_pv', 'S'], 'pot_type': 'paw'}","{'K': 1.0, 'Fe': 2.0, 'S': 2.0}",GGA,mp-1070151,"['mp-1070151', 'mp-1070182', 'mp-1070223', 'mp-1397127', 'mp-1765722', 'mp-1784065', 'mp-1616465', 'mp-1070209']",0.000208,"{'K': 1.0, 'Fe': 2.0, 'S': 2.0}",87.59614022944267,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",2.374533848810925e-06,0.000208,0,0.000208,MP,data/source/MP/cleaned/cifs/MP-mp-1070151.cif,True,,data/final/MP/graphs/Fe1.5K1S2-MP-mp-1070151-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B2Mg0.8Zn0.2,3,0.1333333333333333,1.0,True,B2Mg0.8Zn0.2,B2Mg1,38.4,Other,True,B66.667Mg26.667Zn6.667,B-Mg-Zn,3,Supercon,Mg0.8Zn0.2B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B2Mg0.8Zn0.2-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B2Mg0.8Zn0.2-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
C3Pr0.2Th1.8,3,0.0799999999999999,4.0,False,C12Pr0.8Th7.2,C12Th8,0.0,Other,True,C60Pr4Th36,C-Pr-Th,3,Supercon,Th1.8Pr0.2C3,MP-mp-1188514,Th8C12,C-Th,C60Th40,I -4 3 d,cubic,7.414620251643706,7.41462025,7.41462025,data/final/MP/cifs/C3Pr0.2Th1.8-MP-mp-1188514-synth_doped.cif,data/source/MP/raw/cifs/mp-1188514.cif,mp-1188514,0.0,,2019-01-11 19:30:01.530000,10.585910862659652,,,{'GGA': {'task_id': 'mp-1669546'}},0.0,8.12401413,520.0,-175.32363419,-8.7661817095,"{'tags': ['Pu2C3', 'Th2C3 hp', 'Thorium carbide (2/3)']}",-175.32363419,-8.7661817095,-0.2645699894999992,['bandstructure'],True,[618903],True,2021-05-12 10:58:33.577000,NM,20,5,mp-1188514,,Th2C3,"{'functional': 'PBE', 'labels': ['Th', 'C'], 'pot_type': 'paw'}","{'Th': 2.0, 'C': 3.0}",GGA,mp-1188514,"['mp-1188514', 'mp-1415692', 'mp-1669546', 'mp-1811506', 'mp-1605961']",0.000101475,"{'Th': 8.0, 'C': 12.0}",313.7941543668512,[],NM,False,220,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.2935231404134748e-06,0.000101475,0,0.0004059,MP,data/source/MP/cleaned/cifs/MP-mp-1188514.cif,True,,data/final/MP/graphs/C3Pr0.2Th1.8-MP-mp-1188514-synth_doped.json,0,True,-43m,5,0,0,0,0,0,0,0,0,1,0,1.0,False
Ni0.04S2Ta1,3,0.1275303643724696,4.0,False,Ni0.16S8Ta4,Ni1S8Ta4,4.095,Ferrite,True,Ni1.316S65.789Ta32.895,Ni-S-Ta,3,Supercon,Ni0.04Ta1S2,MP-mp-1218136,Ta4Ni1S8,Ni-S-Ta,Ni7.692S61.538Ta30.769,P -3 m 1,trigonal,3.369069999250622,3.36906982,24.425977,data/final/MP/cifs/Ni0.04S2Ta1-MP-mp-1218136-synth_doped.cif,data/source/MP/raw/cifs/mp-1218136.cif,mp-1218136,0.0,,2019-01-12 19:21:19.076000,7.185617374365983,,,{'GGA': {'task_id': 'mp-1746242'}},0.0414952845607894,5.36411464,520.0,-98.60879648,-7.585292036923077,{'tags': []},-98.60879648,-7.585292036923077,-1.2561500265384615,[],False,[],True,2021-05-12 11:00:42.526000,FM,13,4,mp-1218136,,Ta4NiS8,"{'functional': 'PBE', 'labels': ['Ta_pv', 'Ni_pv', 'S'], 'pot_type': 'paw'}","{'Ta': 4.0, 'Ni': 1.0, 'S': 8.0}",GGA,mp-1218136,"['mp-1218136', 'mp-1395464', 'mp-1746242', 'mp-1876649']",0.5894077,"{'Ta': 4.0, 'Ni': 1.0, 'S': 8.0}",240.1057793870966,[],FM,True,164,1,"[0.0, 0.0, 0.0, 0.0, 0.5, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.002454783477118,0.5894077,1,0.5894077,MP,data/source/MP/cleaned/cifs/MP-mp-1218136.cif,True,,data/final/MP/graphs/Ni0.04S2Ta1-MP-mp-1218136-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ba1.72Cu4La0.28Y1O8,3,0.0373333333333333,1.0,True,Ba1.72Cu4La0.28Y1O8,Ba2Cu4Y1O8,18.9,Cuprate,True,Ba11.467Cu26.667La1.867Y6.667O53.333333333333336,Ba-Cu-La-Y-O,5,Supercon,Y1Ba1.72La0.28Cu4O8,MP-mp-6790,Ba2Y1Cu4O8,Ba-Cu-Y-O,Ba13.333Cu26.667Y6.667O53.333333333333336,C m m m,orthorhombic,3.889922,3.899603999537882,13.88942687,data/final/MP/cifs/Ba1.72Cu4La0.28Y1O8-MP-mp-6790-synth_doped.cif,data/source/MP/raw/cifs/mp-6790.cif,mp-6790,0.0,,2011-05-16 03:21:24,5.936250568336678,10.17188/1283441,"@misc{osti_1283441,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Y(CuO2)4 (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1283441"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686864'}},0.0,3.31391536,520.0,-91.58381472,-6.105587648,"{'tags': ['Yttrium barium copper oxide (1/2/4/8)', 'High pressure experimental phase']}",-91.58381472,-6.105587648,-2.0529924817777783,"['xas', 'bandstructure']",True,"[72261, 85273, 74251, 400273, 85277, 85275, 400280, 67632, 85272, 67631, 83920, 66613, 85279, 400277, 75689, 74259, 85278, 85280, 66603, 94265, 400276, 88873, 71417, 75712, 97052, 66605, 72258, 85281, 85274, 400279, 66604, 69698]",True,2021-05-12 10:57:34.594000,NM,15,10,mp-6790,oxide,Ba2Y(CuO2)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-6790,"['mp-1000664', 'mp-6790', 'mp-1007136', 'mp-1237713', 'mp-1440937', 'mp-1686864', 'mp-1834179', 'mp-1011883', 'mp-1590064', 'mp-1590433']",0.0004643,"{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",208.60454115924333,[],NM,False,65,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.225742533790601e-06,0.0004643,0,0.0004643,MP,data/source/MP/cleaned/cifs/MP-mp-6790.cif,True,,data/final/MP/graphs/Ba1.72Cu4La0.28Y1O8-MP-mp-6790-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
In0.8Tl0.2,3,0.1,8.0,False,In6.4Tl1.6,In6Tl2,3.223,Other,True,In80Tl20,In-Tl,2,Supercon,In0.8Tl0.2,MP-mp-1187827,Tl2In6,In-Tl,In75Tl25,P 63/m m c,hexagonal,5.783429,6.828941998825169,6.82894178,data/final/MP/cifs/In0.8Tl0.2-MP-mp-1187827-synth_doped.cif,data/source/MP/raw/cifs/mp-1187827.cif,mp-1187827,0.0,,2019-01-11 15:22:55.539000,7.803687011739559,,,{'GGA': {'task_id': 'mp-1742935'}},0.0451075679166663,6.43460187,520.0,-20.87452813,-2.60931601625,{'tags': []},-20.87452813,-2.60931601625,0.0451075679166663,['bandstructure'],True,[],True,2021-05-12 10:58:31.620000,NM,8,5,mp-1187827,,TlIn3,"{'functional': 'PBE', 'labels': ['Tl_d', 'In_d'], 'pot_type': 'paw'}","{'Tl': 1.0, 'In': 3.0}",GGA,mp-1187827,"['mp-1187827', 'mp-1396913', 'mp-1742935', 'mp-1930688', 'mp-1637284']",0.0010443,"{'Tl': 2.0, 'In': 6.0}",233.57312421327032,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",8.94195343336225e-06,0.0010443,0,0.0020886,MP,data/source/MP/cleaned/cifs/MP-mp-1187827.cif,True,,data/final/MP/graphs/In0.8Tl0.2-MP-mp-1187827-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
B2C1Er1Fe0.07Ni1.93,2,0.0233333333333333,1.0,True,B2C1Er1Fe0.07Ni1.93,B2C1Er1Ni2,0.0,Other,True,B33.333C16.667Er16.667Fe1.167Ni32.167,B-C-Er-Fe-Ni,5,Supercon,Er1Ni1.93Fe0.07B2C1,MP-mp-6098,Er1Ni2B2C1,B-C-Er-Ni,B33.333C16.667Er16.667Ni33.333,I 4/m m m,tetragonal,3.5122880026935177,3.5122880026935173,5.77805085,data/final/MP/cifs/B2C1Er1Fe0.07Ni1.93-MP-mp-6098-synth_doped.cif,data/source/MP/raw/cifs/mp-6098.cif,mp-6098,0.0,,2011-05-13 04:24:02,8.212015229638553,10.17188/1277667,"@misc{osti_1277667,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ErNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277667"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700042'}},0.0,6.72687579,520.0,-41.84324782,-6.973874636666667,{'tags': []},-41.84324782,-6.973874636666667,-0.5216152347222227,"['xas', 'elasticity', 'bandstructure']",True,"[246431, 79576, 56651]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-6098,,ErNi2B2C,"{'functional': 'PBE', 'labels': ['Er_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Er': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6098,"['mp-1006980', 'mp-1000513', 'mp-6098', 'mp-1441533', 'mp-1700042', 'mp-1793903', 'mp-1011723', 'mp-1589040']",0.0020747,"{'Er': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",64.35860973581151,[],NM,False,139,0,"[0.0, -0.0, -0.0, 0.0, 0.0, 0.0]",3.2236557136900987e-05,0.0020747,0,0.0020747,MP,data/source/MP/cleaned/cifs/MP-mp-6098.cif,True,,data/final/MP/graphs/B2C1Er1Fe0.07Ni1.93-MP-mp-6098-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B2Mg0.9Zr0.1,3,0.0666666666666666,1.0,True,B2Mg0.9Zr0.1,B2Mg1,37.3,Other,True,B66.667Mg30Zr3.333,B-Mg-Zr,3,Supercon,Mg0.9Zr0.1B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B2Mg0.9Zr0.1-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B2Mg0.9Zr0.1-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ir1.8Ru0.2Th1,3,0.1333333333333333,2.0,False,Ir3.6Ru0.4Th2,Ir4Th2,4.86,Other,True,Ir60Ru6.667Th33.333,Ir-Ru-Th,3,Supercon,Th1Ir1.8Ru0.2,MP-mp-1187,Th2Ir4,Ir-Th,Ir66.667Th33.333,F d -3 m,cubic,5.45579126,5.45579126,5.45579126,data/final/MP/cifs/Ir1.8Ru0.2Th1-MP-mp-1187-synth_doped.cif,data/source/MP/raw/cifs/mp-1187.cif,mp-1187,0.0,,2011-05-13 08:24:56,17.82929828099463,10.17188/1188440,"@misc{osti_1188440,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ThIr2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188440"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1674377'}},0.0,9.20830531,520.0,-55.18109661,-9.196849435,"{'tags': ['Iridium thorium (2/1)', 'Thorium iridium (1/2)']}",-55.18109661,-9.196849435,-0.8332764049999994,"['xas', 'elasticity', 'bandstructure']",True,"[104572, 641099, 641106, 104571, 641094, 150742, 641102]",True,2021-05-12 10:56:12.755000,NM,6,8,mp-1187,,ThIr2,"{'functional': 'PBE', 'labels': ['Th', 'Ir'], 'pot_type': 'paw'}","{'Th': 1.0, 'Ir': 2.0}",GGA,mp-1187,"['mp-990623', 'mp-1187', 'mp-914552', 'mp-1439466', 'mp-1674377', 'mp-1803101', 'mp-992717', 'mp-1597100']",0.00093205,"{'Th': 2.0, 'Ir': 4.0}",114.83076035455412,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",1.6233455166928805e-05,0.00093205,0,0.0018641,MP,data/source/MP/cleaned/cifs/MP-mp-1187.cif,True,,data/final/MP/graphs/Ir1.8Ru0.2Th1-MP-mp-1187-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Co2Lu1,1,0.0,2.0,False,Co4Lu2,Co4Lu2,0.0,Other,True,Co66.667Lu33.333,Co-Lu,2,Supercon,Co2Lu1,MP-mp-2206,Lu2Co4,Co-Lu,Co66.667Lu33.333,F d -3 m,cubic,5.000294289999999,5.000294289999999,5.000294289999999,data/final/MP/cifs/Co2Lu1-MP-mp-2206.cif,data/source/MP/raw/cifs/mp-2206.cif,mp-2206,0.0,,2011-05-13 05:53:39,11.00089426267747,10.17188/1197321,"@misc{osti_1197321,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LuCo2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197321"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688500'}},0.0,4.39759595,520.0,-39.04889677,-6.508149461666666,"{'tags': ['Cobalt lutetium (2/1)', 'Cobalt lutetium hydride (2/1/3)']}",-39.04889677,-6.508149461666666,-0.2622874250000002,"['xas', 'elasticity', 'bandstructure']",True,"[603221, 624049, 624048, 623708, 624045, 603225, 624042, 624055, 624047, 102520, 624044]",True,2021-05-12 10:56:16.728000,NM,6,12,mp-2206,,LuCo2,"{'functional': 'PBE', 'labels': ['Lu_3', 'Co'], 'pot_type': 'paw'}","{'Lu': 1.0, 'Co': 2.0}",GGA,mp-2206,"['mp-988124', 'mp-987886', 'mp-2206', 'mp-1071554', 'mp-1071719', 'mp-1071764', 'mp-1442151', 'mp-1688500', 'mp-1924170', 'mp-988765', 'mp-1588859', 'mp-1071774']",0.0134927,"{'Lu': 2.0, 'Co': 4.0}",88.40395562197946,[],NM,False,227,0,"[0.0, 0.0, -0.0, -0.0, -0.0, -0.0]",0.000305251046858,0.0134927,0,0.0269854,MP,data/source/MP/cleaned/cifs/MP-mp-2206.cif,False,,data/final/MP/graphs/Co2Lu1-MP-mp-2206.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
B1,1,0.0,12.0,False,B12,B12,5.0,Other,True,B100,B,1,Supercon,B1,MP-mp-160,B12,B,B100,R -3 m,trigonal,4.899977394733537,4.899977394733537,5.05037462,data/final/MP/cifs/B1-MP-mp-160.cif,data/source/MP/raw/cifs/mp-160.cif,mp-160,1.5219000000000005,,2011-05-12 21:30:32,2.476400292715375,10.17188/1191505,"@misc{osti_1191505,
    author = ""Persson, Kristin"",
    title = ""Materials Data on B (SG:166) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191505"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699562'}},0.0,6.03991887,700.0,-80.15270125,-6.679391770833334,"{'tags': ['Boron (12) - alpha', 'High pressure experimental phase', 'Boron', 'Boron - alpha']}",-80.15270125,-6.679391770833334,0.0,"['surfaces', 'eos', 'xas', 'bandstructure', 'diel', 'phonons', 'elasticity']",True,"[94429, 26487, 62747, 181823, 108026, 56992, 659240, 426926]",True,2021-05-12 10:56:12.755000,NM,12,12,mp-160,,B,"{'functional': 'PBE', 'labels': ['B'], 'pot_type': 'paw'}",{'B': 1.0},GGA,mp-160,"['mp-669850', 'mp-660143', 'mp-656737', 'mp-160', 'mp-1102221', 'mp-1103329', 'mp-1440446', 'mp-1539219', 'mp-1542694', 'mp-1699562', 'mp-1800479', 'mp-1591475']",2.38e-05,{'B': 12.0},86.99120849801606,[],NM,False,166,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.283090382708196e-06,2.38e-05,0,0.0002856,MP,data/source/MP/cleaned/cifs/MP-mp-160.cif,False,,data/final/MP/graphs/B1-MP-mp-160.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Co0.02Sn0.98Ta3,2,0.01,2.0,False,Co0.04Sn1.96Ta6,Sn2Ta6,4.0,Other,True,Co0.5Sn24.5Ta75,Co-Sn-Ta,3,Supercon,Co0.02Sn0.98Ta3,MP-mp-30871,Ta6Sn2,Sn-Ta,Sn25Ta75,P m -3 n,cubic,5.325375,5.325375,5.325375,data/final/MP/cifs/Co0.02Sn0.98Ta3-MP-mp-30871-synth_doped.cif,data/source/MP/raw/cifs/mp-30871.cif,mp-30871,0.0,,2014-02-24 02:29:24,14.54767435761192,10.17188/1205224,"@misc{osti_1205224,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ta3Sn (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1205224"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696644'}},0.0,7.11922506,520.0,-79.42493136,-9.92811642,{'tags': ['Tin tantalum (1/3)']},-79.42493136,-9.92811642,-0.0323902337500019,"['xas', 'elasticity', 'bandstructure']",True,[106076],True,2021-05-12 10:56:18.721000,NM,8,8,mp-30871,,Ta3Sn,"{'functional': 'PBE', 'labels': ['Ta_pv', 'Sn_d'], 'pot_type': 'paw'}","{'Ta': 3.0, 'Sn': 1.0}",GGA,mp-30871,"['mp-942099', 'mp-932839', 'mp-943103', 'mp-30871', 'mp-1428765', 'mp-1696644', 'mp-1780640', 'mp-1588383']",0.000628,"{'Ta': 6.0, 'Sn': 2.0}",151.02560544966212,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",8.316470549880586e-06,0.000628,0,0.001256,MP,data/source/MP/cleaned/cifs/MP-mp-30871.cif,True,,data/final/MP/graphs/Co0.02Sn0.98Ta3-MP-mp-30871-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Pd2.8Se1,3,0.1263157894736842,2.0,False,Pd5.6Se2,Pd8Se2,2.3,Other,True,Pd73.684Se26.316,Pd-Se,2,Supercon,Pd2.8Se1,MP-mp-7818,Pd8Se2,Pd-Se,Pd80Se20,P -4 21 c,tetragonal,5.314807,5.314807,5.762397,data/final/MP/cifs/Pd2.8Se1-MP-mp-7818-synth_doped.cif,data/source/MP/raw/cifs/mp-7818.cif,mp-7818,0.0,,2011-05-30 06:45:10,10.29633329731544,10.17188/1307580,"@misc{osti_1307580,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Pd4Se (SG:114) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1307580"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696479'}},0.0,5.07601896,520.0,-50.03404921,-5.003404921,{'tags': ['Palladium selenide (4/1)']},-50.03404921,-5.003404921,-0.2547171774687499,"['bandstructure', 'elasticity']",True,[23864],True,2021-05-12 10:56:31.128000,NM,10,8,mp-7818,,Pd4Se,"{'functional': 'PBE', 'labels': ['Pd', 'Se'], 'pot_type': 'paw'}","{'Pd': 4.0, 'Se': 1.0}",GGA,mp-7818,"['mp-913043', 'mp-7818', 'mp-929268', 'mp-930128', 'mp-1429762', 'mp-1696479', 'mp-1779253', 'mp-1601294']",9.195e-05,"{'Pd': 8.0, 'Se': 2.0}",162.7714275309073,[],NM,False,114,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.1298051678331617e-06,9.195e-05,0,0.0001839,MP,data/source/MP/cleaned/cifs/MP-mp-7818.cif,True,,data/final/MP/graphs/Pd2.8Se1-MP-mp-7818-synth_doped.json,0,True,-42m,0,0,0,0,6,0,0,1,0,0,0,1.0,False
B2C1Co0.06Ni1.94Y1,2,0.02,1.0,True,B2C1Co0.06Ni1.94Y1,B2C1Ni2Y1,11.8,Other,True,B33.333C16.667Co1Ni32.333Y16.667,B-C-Co-Ni-Y,5,Supercon,Y1Ni1.94Co0.06B2C1,MP-mp-6576,Y1Ni2B2C1,B-C-Ni-Y,B33.333C16.667Ni33.333Y16.667,I 4/m m m,tetragonal,3.548790000501972,3.548790000501972,5.76144136,data/final/MP/cifs/B2C1Co0.06Ni1.94Y1-MP-mp-6576-synth_doped.cif,data/source/MP/raw/cifs/mp-6576.cif,mp-6576,0.0,,2011-05-13 05:21:43,6.099730998852292,10.17188/1281366,"@misc{osti_1281366,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281366"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688230'}},0.0,6.81083016,520.0,-43.677878,-7.279646333333333,{'tags': []},-43.677878,-7.279646333333333,-0.5109282141666659,"['xas', 'bandstructure']",True,"[75816, 89142, 83231, 79574, 41549]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6576,,YNi2B2C,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6576,"['mp-6576', 'mp-1007054', 'mp-1000583', 'mp-1439516', 'mp-1688230', 'mp-1794280', 'mp-1011792', 'mp-1597064']",0.0006603,"{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.3152437079014,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",1.010943177297096e-05,0.0006603,0,0.0006603,MP,data/source/MP/cleaned/cifs/MP-mp-6576.cif,True,,data/final/MP/graphs/B2C1Co0.06Ni1.94Y1-MP-mp-6576-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Cu1O1,1,0.0,2.0,False,Cu2O2,Cu2O2,0.0,Oxide,True,Cu50O50,Cu-O,2,Supercon,Cu1O1,MP-mp-1692,Cu2O2,Cu-O,Cu50O50,P 42/m m c,tetragonal,2.93311,2.93311,5.133987,data/final/MP/cifs/Cu1O1-MP-mp-1692.cif,data/source/MP/raw/cifs/mp-1692.cif,mp-1692,0.0,,2011-05-13 02:32:52,5.981122501077556,10.17188/1192239,"@misc{osti_1192239,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CuO (SG:131) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1192239"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668165'}},0.0,4.63604986,520.0,-20.49151512,-5.12287878,"{'tags': ['High pressure experimental phase', 'Copper oxide (1/1)', 'Tenorite', 'Copper oxide']}",-20.49151512,-5.12287878,-0.9427949424999992,"['xas', 'elasticity', 'bandstructure']",True,"[291390, 291387, 67850, 16025, 653723, 31059, 43180, 69094, 628618, 92368, 43179, 628614, 43181, 87125, 87123, 26715, 92366, 628615, 92367, 92365, 160630, 87122, 628616, 87124, 628612, 92364]",True,2021-05-12 10:56:14.760000,NM,4,26,mp-1692,oxide,CuO,"{'functional': 'PBE', 'labels': ['Cu_pv', 'O'], 'pot_type': 'paw'}","{'Cu': 1.0, 'O': 1.0}",GGA,mp-1692,"['mp-878296', 'mp-870921', 'mp-879330', 'mp-704581', 'mp-870442', 'mp-1692', 'mp-1838', 'mp-1064232', 'mp-1064275', 'mp-1064462', 'mp-1065191', 'mp-1065138', 'mp-1065270', 'mp-1066542', 'mp-1066580', 'mp-1066736', 'mp-1440567', 'mp-1668165', 'mp-1783463', 'mp-889655', 'mp-1595437', 'mp-871110', 'mp-1595209', 'mp-1065226', 'mp-1066602', 'mp-1064294']",0.0004602,"{'Cu': 2.0, 'O': 2.0}",44.16837951221586,[],NM,False,131,0,"[0, 0, 0, 0]",2.083843713907232e-05,0.0004602,0,0.0009204,MP,data/source/MP/cleaned/cifs/MP-mp-1692.cif,False,,data/final/MP/graphs/Cu1O1-MP-mp-1692.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Fe1Se0.4Te0.6,3,0.0999999999999999,2.0,False,Fe2Se0.8Te1.2,Fe2Se1Te1,13.733333335,Ferrite,True,Fe50Se20Te30,Fe-Se-Te,3,Supercon,Fe1Se0.4Te0.6,MP-mp-1225136,Fe2Te1Se1,Fe-Se-Te,Fe50Se25Te25,P 4 m m,tetragonal,3.755398,3.755398,5.937717,data/final/MP/cifs/Fe1Se0.4Te0.6-MP-mp-1225136-synth_doped.cif,data/source/MP/raw/cifs/mp-1225136.cif,mp-1225136,0.0,,2019-01-13 01:17:25.998000,6.310824077785493,,,{'GGA': {'task_id': 'mp-1764167'}},0.0802741556250001,4.86336573,520.0,-24.0729629,-6.018240725,{'tags': []},-24.0729629,-6.018240725,-0.3469333980859375,['bandstructure'],True,[],True,2021-05-12 10:58:45.495000,FM,4,5,mp-1225136,,Fe2TeSe,"{'functional': 'PBE', 'labels': ['Fe_pv', 'Te', 'Se'], 'pot_type': 'paw'}","{'Fe': 2.0, 'Te': 1.0, 'Se': 1.0}",GGA,mp-1225136,"['mp-1225136', 'mp-1425562', 'mp-1764167', 'mp-1784460', 'mp-1615275']",0.1061773,"{'Fe': 2.0, 'Te': 1.0, 'Se': 1.0}",83.73970680084179,[],FM,True,99,1,"[0.1, 0.1, -0.0, -0.0]",0.0012679444920021,0.1061773,2,0.1061773,MP,data/source/MP/cleaned/cifs/MP-mp-1225136.cif,True,,data/final/MP/graphs/Fe1Se0.4Te0.6-MP-mp-1225136-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
Co0.5Fe0.5Ti1,1,0.0,2.0,False,Co1Fe1Ti2,Co1Fe1Ti2,3.3,Other,True,Co25Fe25Ti50,Co-Fe-Ti,3,Supercon,Co0.5Fe0.5Ti1,MP-mp-1187429,Ti2Fe1Co1,Co-Fe-Ti,Co25Fe25Ti50,F m -3 m,cubic,4.20256187,4.202561869999999,4.202561869999999,data/final/MP/cifs/Co0.5Fe0.5Ti1-MP-mp-1187429.cif,data/source/MP/raw/cifs/mp-1187429.cif,mp-1187429,0.0,,2019-01-11 15:04:49.215000,6.660379968421784,,,{'GGA': {'task_id': 'mp-1766875'}},0.0045226449999997,6.5092184,520.0,-32.99392686,-8.248481715,{'tags': []},-32.99392686,-8.248481715,-0.4061541454166679,['bandstructure'],True,[],True,2021-05-12 10:58:31.620000,FM,4,5,mp-1187429,,Ti2FeCo,"{'functional': 'PBE', 'labels': ['Ti_pv', 'Fe_pv', 'Co'], 'pot_type': 'paw'}","{'Ti': 2.0, 'Fe': 1.0, 'Co': 1.0}",GGA,mp-1187429,"['mp-1187429', 'mp-1424183', 'mp-1766875', 'mp-1791722', 'mp-1611013']",1.0038178,"{'Ti': 2.0, 'Fe': 1.0, 'Co': 1.0}",52.48405127794059,[],FM,True,225,2,"[0.0, 0.0, 0.5, 0.9]",0.0191261492883631,1.0038178,2,1.0038178,MP,data/source/MP/cleaned/cifs/MP-mp-1187429.cif,False,,data/final/MP/graphs/Co0.5Fe0.5Ti1-MP-mp-1187429.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Os0.81Re0.19,3,0.12,8.0,False,Os6.48Re1.52,Os6Re2,0.73,Other,True,Os81Re19,Os-Re,2,Supercon,Os0.81Re0.19,MP-mp-867141,Re2Os6,Os-Re,Os75Re25,P 63/m m c,hexagonal,4.369407,5.537107995712844,5.53710783,data/final/MP/cifs/Os0.81Re0.19-MP-mp-867141-synth_doped.cif,data/source/MP/raw/cifs/mp-867141.cif,mp-867141,0.0,,2014-10-15 17:46:38,21.66689974227436,10.17188/1311788,"@misc{osti_1311788,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ReOs3 (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1311788"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1754864'}},0.0,8.29738654,520.0,-92.93589693,-11.61698711625,{'tags': []},-92.93589693,-11.61698711625,-0.0853306287500004,"['xas', 'bandstructure']",True,[],True,2021-05-12 10:57:53.781000,NM,8,8,mp-867141,,ReOs3,"{'functional': 'PBE', 'labels': ['Re_pv', 'Os_pv'], 'pot_type': 'paw'}","{'Re': 1.0, 'Os': 3.0}",GGA,mp-867141,"['mp-867141', 'mp-1054734', 'mp-1054761', 'mp-1397001', 'mp-1754864', 'mp-1802803', 'mp-1619968', 'mp-1054762']",0.00038735,"{'Re': 2.0, 'Os': 6.0}",116.0163247019676,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",6.677508548819435e-06,0.00038735,0,0.0007747,MP,data/source/MP/cleaned/cifs/MP-mp-867141.cif,True,,data/final/MP/graphs/Os0.81Re0.19-MP-mp-867141-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
B2Cr1,1,0.0,1.0,True,B2Cr1,B2Cr1,0.0,Other,True,B66.667Cr33.333,B-Cr,2,Supercon,B2Cr1,MP-mp-374,Cr1B2,B-Cr,B66.667Cr33.333,P 6/m m m,hexagonal,2.9592880008210805,2.95928836,3.031871,data/final/MP/cifs/B2Cr1-MP-mp-374.cif,data/source/MP/raw/cifs/mp-374.cif,mp-374,0.0,,2011-05-12 18:10:03,5.316402027319826,10.17188/1207357,"@misc{osti_1207357,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CrB2 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207357"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668725'}},0.0668396283333319,8.95783163,520.0,-24.03145434,-8.01048478,"{'tags': ['Chromium boride (1/2)', 'Chromium diboride', 'Chromium boride (1/2) - theta']}",-24.03145434,-8.01048478,-0.3398744427777771,"['xas', 'elasticity', 'bandstructure']",True,"[239595, 30416, 613482, 613460, 613477, 613486, 44194]",True,2021-05-12 10:56:20.740000,FM,3,13,mp-374,,CrB2,"{'functional': 'PBE', 'labels': ['Cr_pv', 'B'], 'pot_type': 'paw'}","{'Cr': 1.0, 'B': 2.0}",GGA,mp-374,"['mp-921683', 'mp-907195', 'mp-920675', 'mp-374', 'mp-1061765', 'mp-1061820', 'mp-1061685', 'mp-1442325', 'mp-1668725', 'mp-1794547', 'mp-1586178', 'mp-1595513', 'mp-1061790']",1.0049079,"{'Cr': 1.0, 'B': 2.0}",22.994072011610747,[],FM,True,191,1,"[1.0, 0.0, 0.0]",0.0437029117544981,1.0049079,1,1.0049079,MP,data/source/MP/cleaned/cifs/MP-mp-374.cif,False,,data/final/MP/graphs/B2Cr1-MP-mp-374.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Au2Na1,1,0.0,2.0,False,Au4Na2,Au4Na2,0.0,Other,True,Au66.667Na33.333,Au-Na,2,Supercon,Au2Na1,MP-mp-1052,Na2Au4,Au-Na,Au66.667Na33.333,F d -3 m,cubic,5.63362438,5.63362438,5.63362438,data/final/MP/cifs/Au2Na1-MP-mp-1052.cif,data/source/MP/raw/cifs/mp-1052.cif,mp-1052,0.0,,2011-05-13 07:21:32,10.9518172321153,10.17188/1187175,"@misc{osti_1187175,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NaAu2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187175"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696192'}},0.0,3.27482321,520.0,-18.03805321,-3.006342201666667,{'tags': ['Gold sodium (2/1)']},-18.03805321,-3.006342201666667,-0.3829127438505748,"['xas', 'elasticity', 'bandstructure']",True,"[612178, 108001, 58553]",True,2021-05-12 10:56:10.715000,NM,6,8,mp-1052,,NaAu2,"{'functional': 'PBE', 'labels': ['Na_pv', 'Au'], 'pot_type': 'paw'}","{'Na': 1.0, 'Au': 2.0}",GGA,mp-1052,"['mp-912093', 'mp-928690', 'mp-928162', 'mp-1052', 'mp-1432979', 'mp-1696192', 'mp-1785306', 'mp-1592728']",0.00299385,"{'Na': 2.0, 'Au': 4.0}",126.42957065951168,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",4.735996467254892e-05,0.00299385,0,0.0059877,MP,data/source/MP/cleaned/cifs/MP-mp-1052.cif,False,,data/final/MP/graphs/Au2Na1-MP-mp-1052.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Cu70Sn30,3,0.1,0.0666690476190476,False,Cu4.667Sn2,Cu6Sn2,1.2,Other,True,Cu70Sn30,Cu-Sn,2,Supercon,Cu70Sn30,MP-mp-13138,Cu6Sn2,Cu-Sn,Cu75Sn25,P 63/m m c,hexagonal,4.349665,5.540460003793306,5.54045991,data/final/MP/cifs/Cu70Sn30-MP-mp-13138-synth_doped.cif,data/source/MP/raw/cifs/mp-13138.cif,mp-13138,0.0,,2011-06-04 08:14:21,8.88481370954905,10.17188/1189408,"@misc{osti_1189408,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Cu3Sn (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189408"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701654'}},0.0119013687500002,8.51612743,520.0,-32.61241801,-4.07655225125,{'tags': ['Copper tin (3/1)']},-32.61241801,-4.07655225125,0.0002457150000001,"['xas', 'elasticity', 'bandstructure']",True,[162569],True,2021-05-12 10:56:12.755000,NM,8,8,mp-13138,,Cu3Sn,"{'functional': 'PBE', 'labels': ['Cu_pv', 'Sn_d'], 'pot_type': 'paw'}","{'Cu': 3.0, 'Sn': 1.0}",GGA,mp-13138,"['mp-920121', 'mp-919081', 'mp-906310', 'mp-13138', 'mp-1420922', 'mp-1701654', 'mp-1925297', 'mp-1588029']",0.0004278,"{'Cu': 6.0, 'Sn': 2.0}",115.63201119737352,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",7.399335107469221e-06,0.0004278,0,0.0008556,MP,data/source/MP/cleaned/cifs/MP-mp-13138.cif,True,,data/final/MP/graphs/Cu70Sn30-MP-mp-13138-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ba0.644Bi1K0.356O3,2,0.0090666666666666,3.0,False,Ba1.932Bi3K1.068O9,Ba2Bi3K1O9,29.0,Oxide,True,Ba12.88Bi20K7.12O60,Ba-Bi-K-O,4,Supercon,Ba0.644K0.356Bi1O3,MP-mp-1223518,K1Ba2Bi3O9,Ba-Bi-K-O,Ba13.333Bi20K6.667O60,P -3 m 1,trigonal,6.18756400330999,6.187564340000001,7.581401,data/final/MP/cifs/Ba0.644Bi1K0.356O3-MP-mp-1223518-synth_doped.cif,data/source/MP/raw/cifs/mp-1223518.cif,mp-1223518,0.0,,2019-01-12 23:54:06.965000,7.16530091201999,,,{'GGA': {'task_id': 'mp-1729135'}},0.001551682833333,3.46143017,520.0,-85.22271396,-5.681514264,{'tags': []},-85.22271396,-5.681514264,-2.0170414252000004,[],False,[],True,2021-05-12 11:00:52.054000,NM,15,4,mp-1223518,oxide,KBa2(BiO3)3,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Bi', 'O'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 2.0, 'Bi': 3.0, 'O': 9.0}",GGA,mp-1223518,"['mp-1223518', 'mp-1391182', 'mp-1729135', 'mp-1775199']",4.99e-05,"{'K': 1.0, 'Ba': 2.0, 'Bi': 3.0, 'O': 9.0}",251.37352739849624,[],NM,False,164,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.9850936777799505e-07,4.99e-05,0,4.99e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1223518.cif,True,,data/final/MP/graphs/Ba0.644Bi1K0.356O3-MP-mp-1223518-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Cu1La1.834Sr0.166O4,3,0.0474285714285714,1.0,True,Cu1La1.834Sr0.166O4,Cu1La2O4,35.0,Cuprate,True,Cu14.286La26.2Sr2.371O57.142857142857146,Cu-La-Sr-O,4,Supercon,La1.834Sr0.166Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La1.834Sr0.166O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La1.834Sr0.166O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ba0.52Bi1K0.48O3,3,0.0586666666666666,3.0,False,Ba1.56Bi3K1.44O9,Ba2Bi3K1O9,18.7,Oxide,True,Ba10.4Bi20K9.6O60,Ba-Bi-K-O,4,Supercon,Ba0.52K0.48Bi1O3,MP-mp-1223518,K1Ba2Bi3O9,Ba-Bi-K-O,Ba13.333Bi20K6.667O60,P -3 m 1,trigonal,6.18756400330999,6.187564340000001,7.581401,data/final/MP/cifs/Ba0.52Bi1K0.48O3-MP-mp-1223518-synth_doped.cif,data/source/MP/raw/cifs/mp-1223518.cif,mp-1223518,0.0,,2019-01-12 23:54:06.965000,7.16530091201999,,,{'GGA': {'task_id': 'mp-1729135'}},0.001551682833333,3.46143017,520.0,-85.22271396,-5.681514264,{'tags': []},-85.22271396,-5.681514264,-2.0170414252000004,[],False,[],True,2021-05-12 11:00:52.054000,NM,15,4,mp-1223518,oxide,KBa2(BiO3)3,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Bi', 'O'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 2.0, 'Bi': 3.0, 'O': 9.0}",GGA,mp-1223518,"['mp-1223518', 'mp-1391182', 'mp-1729135', 'mp-1775199']",4.99e-05,"{'K': 1.0, 'Ba': 2.0, 'Bi': 3.0, 'O': 9.0}",251.37352739849624,[],NM,False,164,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.9850936777799505e-07,4.99e-05,0,4.99e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1223518.cif,True,,data/final/MP/graphs/Ba0.52Bi1K0.48O3-MP-mp-1223518-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
B2Er1Ir3,1,0.0,1.0,True,B2Er1Ir3,B2Er1Ir3,0.0,Other,True,B33.333Er16.667Ir50,B-Er-Ir,3,Supercon,Er1Ir3B2,MP-mp-5197,Er1B2Ir3,B-Er-Ir,B33.333Er16.667Ir50,P 6/m m m,hexagonal,3.136094,5.463474004040632,5.46347463,data/final/MP/cifs/B2Er1Ir3-MP-mp-5197.cif,data/source/MP/raw/cifs/mp-5197.cif,mp-5197,0.0,,2011-05-13 00:22:48,15.680319799379513,10.17188/1263140,"@misc{osti_1263140,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ErB2Ir3 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1263140"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696330'}},0.0,7.8173417,520.0,-48.61929316,-8.103215526666666,{'tags': ['Erbium iridium boride (1/3/2)']},-48.61929316,-8.103215526666666,-0.6962499247222217,"['xas', 'elasticity', 'bandstructure']",True,[44230],True,2021-05-12 10:56:22.739000,NM,6,8,mp-5197,,ErB2Ir3,"{'functional': 'PBE', 'labels': ['Er_3', 'B', 'Ir'], 'pot_type': 'paw'}","{'Er': 1.0, 'B': 2.0, 'Ir': 3.0}",GGA,mp-5197,"['mp-909406', 'mp-925099', 'mp-5197', 'mp-924394', 'mp-1420866', 'mp-1696330', 'mp-1799487', 'mp-1596200']",0.0007932,"{'Er': 1.0, 'B': 2.0, 'Ir': 3.0}",81.06950680831994,[],NM,False,191,0,"[0, 0, 0, 0, 0, 0]",9.784196687854973e-06,0.0007932,0,0.0007932,MP,data/source/MP/cleaned/cifs/MP-mp-5197.cif,False,,data/final/MP/graphs/B2Er1Ir3-MP-mp-5197.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
C1Mo0.8Ta0.2,3,0.1333333333333333,3.0,False,C3Mo2.4Ta0.6,C3Mo2Ta1,9.6,Other,True,C50Mo40Ta10,C-Mo-Ta,3,Supercon,C1Mo0.8Ta0.2,MP-mp-1217903,Ta1Mo2C3,C-Mo-Ta,C50Mo33.333Ta16.667,P -3 m 1,trigonal,3.116635997131777,3.11663604,7.686316,data/final/MP/cifs/C1Mo0.8Ta0.2-MP-mp-1217903-synth_doped.cif,data/source/MP/raw/cifs/mp-1217903.cif,mp-1217903,0.0,,2019-01-12 19:09:43.831000,10.5003230315958,,,{'GGA': {'task_id': 'mp-1760076'}},0.1970839783333335,9.22941997,520.0,-61.53899175,-10.256498625,{'tags': []},-61.53899175,-10.256498625,-0.0515976599999999,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,6,5,mp-1217903,,TaMo2C3,"{'functional': 'PBE', 'labels': ['Ta_pv', 'Mo_pv', 'C'], 'pot_type': 'paw'}","{'Ta': 1.0, 'Mo': 2.0, 'C': 3.0}",GGA,mp-1217903,"['mp-1217903', 'mp-1390242', 'mp-1760076', 'mp-1783296', 'mp-1626393']",0.0018701,"{'Ta': 1.0, 'Mo': 2.0, 'C': 3.0}",64.65781743250938,[],NM,False,164,0,"[0, 0, 0, 0, 0, 0]",2.892303010308125e-05,0.0018701,0,0.0018701,MP,data/source/MP/cleaned/cifs/MP-mp-1217903.cif,True,,data/final/MP/graphs/C1Mo0.8Ta0.2-MP-mp-1217903-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ag0.2Ba1Si1.8,3,0.1333333333333333,4.0,False,Ag0.8Ba4Si7.2,Ba4Si8,3.2,Other,True,Ag6.667Ba33.333Si60,Ag-Ba-Si,3,Supercon,Ba1Ag0.2Si1.8,MP-mp-7275,Ba4Si8,Ba-Si,Ba33.333Si66.667,P 43 3 2,cubic,6.771439,6.771439,6.771439,data/final/MP/cifs/Ag0.2Ba1Si1.8-MP-mp-7275-synth_doped.cif,data/source/MP/raw/cifs/mp-7275.cif,mp-7275,0.0153999999999996,,2011-05-29 01:48:04,4.139450158250275,10.17188/1287630,"@misc{osti_1287630,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BaSi2 (SG:212) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1287630"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1670265'}},0.0134410304166667,5.20254346,520.0,-55.23987066,-4.603322555,{'tags': ['Barium silicide (1/2)']},-55.23987066,-4.603322555,-0.2994562650000005,"['bandstructure', 'elasticity']",True,"[2218, 602228]",True,2021-05-12 10:56:29.056000,NM,12,11,mp-7275,,BaSi2,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Si'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Si': 2.0}",GGA,mp-7275,"['mp-908584', 'mp-923646', 'mp-922864', 'mp-7275', 'mp-1125089', 'mp-1145782', 'mp-1255475', 'mp-1432707', 'mp-1670265', 'mp-1808748', 'mp-1599442']",0.0,"{'Ba': 4.0, 'Si': 8.0}",310.48663568862327,[],NM,False,212,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0,0.0,0,0.0,MP,data/source/MP/cleaned/cifs/MP-mp-7275.cif,True,,data/final/MP/graphs/Ag0.2Ba1Si1.8-MP-mp-7275-synth_doped.json,0,True,432,4,0,0,0,0,0,0,1,0,0,0,1.0,False
Cu1Zn3,1,0.0,2.0,False,Cu2Zn6,Cu2Zn6,0.0,Other,True,Cu25Zn75,Cu-Zn,2,Supercon,Cu1Zn3,MP-mp-972042,Zn6Cu2,Cu-Zn,Cu25Zn75,P 63/m m c,hexagonal,4.318859,5.422468003603836,5.42246797,data/final/MP/cifs/Cu1Zn3-MP-mp-972042.cif,data/source/MP/raw/cifs/mp-972042.cif,mp-972042,0.0,,2015-09-15 21:50:19,7.844756248090171,10.17188/1313698,"@misc{osti_1313698,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Zn3Cu (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1313698"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1752136'}},0.0,4.20140655,520.0,-16.4039131,-2.0504891375,{'tags': []},-16.4039131,-2.0504891375,-0.0808797625000001,"['xas', 'elasticity', 'bandstructure']",True,[],True,2021-05-12 10:56:35.166000,NM,8,8,mp-972042,,Zn3Cu,"{'functional': 'PBE', 'labels': ['Zn', 'Cu_pv'], 'pot_type': 'paw'}","{'Zn': 3.0, 'Cu': 1.0}",GGA,mp-972042,"['mp-972094', 'mp-972065', 'mp-972042', 'mp-1403051', 'mp-1752136', 'mp-1803315', 'mp-972146', 'mp-1621928']",0.00056195,"{'Zn': 6.0, 'Cu': 2.0}",109.97491860958674,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.021960292591685e-05,0.00056195,0,0.0011239,MP,data/source/MP/cleaned/cifs/MP-mp-972042.cif,False,,data/final/MP/graphs/Cu1Zn3-MP-mp-972042.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Co0.5Ni0.5V3,1,0.0,2.0,False,Co1Ni1V6,Co1Ni1V6,0.0,Other,True,Co12.5Ni12.5V75,Co-Ni-V,3,Supercon,Co0.5Ni0.5V3,MP-mp-1216439,V6Co1Ni1,Co-Ni-V,Co12.5Ni12.5V75,P m -3,cubic,4.651148,4.651148,4.651148,data/final/MP/cifs/Co0.5Ni0.5V3-MP-mp-1216439.cif,data/source/MP/raw/cifs/mp-1216439.cif,mp-1216439,0.0,,2019-01-12 17:56:54.415000,6.985409158564066,,,{'GGA': {'task_id': 'mp-1753585'}},0.0005113562500014,6.44180271,520.0,-68.79759804,-8.599699755,{'tags': []},-68.79759804,-8.599699755,-0.1757133931249992,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,8,5,mp-1216439,,V6CoNi,"{'functional': 'PBE', 'labels': ['V_pv', 'Co', 'Ni_pv'], 'pot_type': 'paw'}","{'V': 6.0, 'Co': 1.0, 'Ni': 1.0}",GGA,mp-1216439,"['mp-1216439', 'mp-1391205', 'mp-1753585', 'mp-1795738', 'mp-1622025']",0.0004681,"{'V': 6.0, 'Co': 1.0, 'Ni': 1.0}",100.61911127627376,[],NM,False,200,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, 0.0]",4.652197719325107e-06,0.0004681,0,0.0004681,MP,data/source/MP/cleaned/cifs/MP-mp-1216439.cif,False,,data/final/MP/graphs/Co0.5Ni0.5V3-MP-mp-1216439.json,0,True,m-3,2,0,0,0,0,0,0,1,0,0,0,1.0,False
Nb5Te4,1,0.0,1.0,True,Nb5Te4,Nb5Te4,0.0,Other,True,Nb55.556Te44.444,Nb-Te,2,Supercon,Nb5Te4,MP-mp-30797,Nb5Te4,Nb-Te,Nb55.556Te44.444,I 4/m,tetragonal,3.689598000106823,7.606702398758027,7.6067024,data/final/MP/cifs/Nb5Te4-MP-mp-30797.cif,data/source/MP/raw/cifs/mp-30797.cif,mp-30797,0.0,,2014-02-19 21:09:08,8.057077706954408,10.17188/1205158,"@misc{osti_1205158,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb5Te4 (SG:87) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1205158"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699030'}},0.0049919933333315,7.54532613,520.0,-66.26768087,-7.363075652222223,{'tags': ['Niobium telluride (5/4)']},-66.26768087,-7.363075652222223,-0.5417724388888898,"['xas', 'elasticity', 'bandstructure']",True,"[645538, 105245]",True,2021-05-12 10:56:18.721000,NM,9,9,mp-30797,,Nb5Te4,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Te'], 'pot_type': 'paw'}","{'Nb': 5.0, 'Te': 4.0}",GGA,mp-30797,"['mp-993712', 'mp-992019', 'mp-30797', 'mp-1079226', 'mp-1415825', 'mp-1699030', 'mp-1832504', 'mp-995021', 'mp-1602620']",0.0093815,"{'Nb': 5.0, 'Te': 4.0}",200.93048200679647,[],NM,False,87,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0]",4.6690277683615294e-05,0.0093815,0,0.0093815,MP,data/source/MP/cleaned/cifs/MP-mp-30797.cif,False,,data/final/MP/graphs/Nb5Te4-MP-mp-30797.json,0,True,4/m,0,0,0,0,3,0,0,0,0,1,0,1.0,False
B4Er0.29Rh4Y0.71,3,0.0644444444444444,2.0,False,B8Er0.58Rh8Y1.42,B8Rh8Y2,10.0,Other,True,B44.444Er3.222Rh44.444Y7.889,B-Er-Rh-Y,4,Supercon,Y0.71Er0.29Rh4B4,MP-mp-5984,Y2B8Rh8,B-Rh-Y,B44.444Rh44.444Y11.111,P 42/n m c,tetragonal,5.347098,5.347098,7.470892,data/final/MP/cifs/B4Er0.29Rh4Y0.71-MP-mp-5984-synth_doped.cif,data/source/MP/raw/cifs/mp-5984.cif,mp-5984,0.0,,2011-05-17 01:51:06,8.454483259902709,10.17188/1277215,"@misc{osti_1277215,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Y(BRh)4 (SG:137) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277215"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1705290'}},0.0126497084259256,6.88552514,520.0,-135.64692549,-7.535940305,"{'tags': ['Yttrium rhodium boride (1/4/4)', 'Rhodium yttrium boride (4/1/4)']}",-135.64692549,-7.535940305,-0.5757992298148148,"['xas', 'bandstructure']",True,"[44569, 615346, 602655, 87283]",True,2021-05-12 10:57:26.891000,NM,18,8,mp-5984,,Y(BRh)4,"{'functional': 'PBE', 'labels': ['Y_sv', 'B', 'Rh_pv'], 'pot_type': 'paw'}","{'Y': 1.0, 'B': 4.0, 'Rh': 4.0}",GGA,mp-5984,"['mp-910312', 'mp-5984', 'mp-926161', 'mp-925748', 'mp-1430442', 'mp-1705290', 'mp-1828135', 'mp-1604702']",0.00010715,"{'Y': 2.0, 'B': 8.0, 'Rh': 8.0}",213.60368753104515,[],NM,False,137,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.0032598335590702e-06,0.00010715,0,0.0002143,MP,data/source/MP/cleaned/cifs/MP-mp-5984.cif,True,,data/final/MP/graphs/B4Er0.29Rh4Y0.71-MP-mp-5984-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Co3Y4,3,0.1428571428571428,0.5,False,Co1.5Y2,Co2Y2,2.033333333,Other,True,Co42.857Y57.143,Co-Y,2,Supercon,Co3Y4,MP-mp-865373,Y2Co2,Co-Y,Co50Y50,R -3 m,trigonal,3.908338158939893,3.908338158939893,7.20958979,data/final/MP/cifs/Co3Y4-MP-mp-865373-synth_doped.cif,data/source/MP/raw/cifs/mp-865373.cif,mp-865373,0.0,,2014-08-31 00:22:59,5.420377437912928,10.17188/1310675,"@misc{osti_1310675,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YCo (SG:166) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1310675"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1732145'}},0.0,3.2255559,520.0,-27.93837983,-6.9845949575,{'tags': ['Cobalt yttrium (1/1)']},-27.93837983,-6.9845949575,-0.1972005033333337,"['xas', 'elasticity', 'bandstructure']",True,[168949],True,2021-05-12 10:56:33.121000,FM,4,8,mp-865373,,YCo,"{'functional': 'PBE', 'labels': ['Y_sv', 'Co'], 'pot_type': 'paw'}","{'Y': 1.0, 'Co': 1.0}",GGA,mp-865373,"['mp-865373', 'mp-1052700', 'mp-1052728', 'mp-1428052', 'mp-1732145', 'mp-1796799', 'mp-1612999', 'mp-1052712']",0.09469185,"{'Y': 2.0, 'Co': 2.0}",90.58133408726616,[],FM,True,166,1,"[0.0, 0.0, 0.3, 0.3]",0.0020907585642042,0.09469185,2,0.1893837,MP,data/source/MP/cleaned/cifs/MP-mp-865373.cif,True,,data/final/MP/graphs/Co3Y4-MP-mp-865373-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
B1N1,1,0.0,2.0,False,B2N2,B2N2,0.0,Other,True,B50N50,B-N,2,Supercon,B1N1,MP-mp-984,B2N2,B-N,B50N50,P 63/m m c,hexagonal,2.512428003916119,2.5124284600000006,7.707265,data/final/MP/cifs/B1N1-MP-mp-984.cif,data/source/MP/raw/cifs/mp-984.cif,mp-984,4.4938,,2011-05-12 17:46:36,1.956240948754851,10.17188/1281942,"@misc{osti_1281942,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BN (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281942"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668567'}},0.0,1.22676181,520.0,-35.15529351,-8.7888233775,"{'tags': ['Boron nitride - h', 'Boron nitride - hexagonal', 'Boron nitride - LT', 'Boron nitride']}",-35.15529351,-8.7888233775,-1.4613800295833332,"['diel', 'xas', 'elasticity', 'bandstructure']",True,"[240999, 24644, 168893, 240996, 186246, 168892, 167799, 35538, 162870, 168894, 183256]",True,2021-05-12 10:56:37.246000,NM,4,18,mp-984,,BN,"{'functional': 'PBE', 'labels': ['B', 'N'], 'pot_type': 'paw'}","{'B': 1.0, 'N': 1.0}",GGA,mp-984,"['mp-663611', 'mp-655515', 'mp-658399', 'mp-984', 'mp-1065231', 'mp-1065243', 'mp-1065237', 'mp-1067355', 'mp-1067367', 'mp-1067361', 'mp-1142083', 'mp-1440916', 'mp-1668567', 'mp-1792856', 'mp-1592333', 'mp-1589062', 'mp-1065244', 'mp-1067366']",0.0002662,"{'B': 2.0, 'N': 2.0}",42.13260173230655,[],NM,False,194,0,"[0, 0, 0, 0]",1.263629536534804e-05,0.0002662,0,0.0005324,MP,data/source/MP/cleaned/cifs/MP-mp-984.cif,False,,data/final/MP/graphs/B1N1-MP-mp-984.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Au0.27Tl0.73,3,0.1266666666666666,6.0,False,Au1.62Tl4.38,Au2Tl4,2.04,Other,True,Au27Tl73,Au-Tl,2,Supercon,Au0.27Tl0.73,MP-mp-30571,Tl4Au2,Au-Tl,Au33.333Tl66.667,I 4/m c m,tetragonal,5.762949998976243,6.014874690853105,6.01487469,data/final/MP/cifs/Au0.27Tl0.73-MP-mp-30571-synth_doped.cif,data/source/MP/raw/cifs/mp-30571.cif,mp-30571,0.0,,2014-02-19 18:08:48,12.5224110446022,10.17188/1204962,"@misc{osti_1204962,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Tl2Au (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1204962"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700972'}},0.0,5.54471971,520.0,-16.22732356,-2.7045539266666663,{'tags': ['Gold thallium (1/2)']},-16.22732356,-2.7045539266666663,-0.0381646488888887,"['xas', 'elasticity', 'bandstructure']",True,[102798],True,2021-05-12 10:56:18.721000,NM,6,8,mp-30571,,Tl2Au,"{'functional': 'PBE', 'labels': ['Tl_d', 'Au'], 'pot_type': 'paw'}","{'Tl': 2.0, 'Au': 1.0}",GGA,mp-30571,"['mp-941231', 'mp-934752', 'mp-30571', 'mp-941518', 'mp-1429140', 'mp-1700972', 'mp-1927675', 'mp-1594062']",0.00017575,"{'Tl': 4.0, 'Au': 2.0}",160.6469532867618,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0]",2.188027801389779e-06,0.00017575,0,0.0003515,MP,data/source/MP/cleaned/cifs/MP-mp-30571.cif,True,,data/final/MP/graphs/Au0.27Tl0.73-MP-mp-30571-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Be17Hf2,1,0.0,6.0,False,Be102Hf12,Be102Hf12,0.0,Other,True,Be89.474Hf10.526,Be-Hf,2,Supercon,Be17Hf2,MP-mp-1212567,Hf12Be102,Be-Hf,Be89.474Hf10.526,P 63/m m c,hexagonal,7.476712002032206,7.47671241,21.766557,data/final/MP/cifs/Be17Hf2-MP-mp-1212567.cif,data/source/MP/raw/cifs/mp-1212567.cif,mp-1212567,0.0,,2019-01-12 14:43:58.268000,4.823786859274744,,,,0.0,4.39176031,520.0,-526.92119057,-4.6221157067543865,"{'tags': ['CaCu5-Zr4Al3 intergrowth', 'Zn17U2', 'Be17Hf2 hex2']}",-526.92119057,-4.6221157067543865,-0.2282001064912286,[],False,[],True,2021-05-12 11:00:31.209000,NM,114,3,mp-1212567,,Hf2Be17,"{'functional': 'PBE', 'labels': ['Hf_pv', 'Be_sv'], 'pot_type': 'paw'}","{'Hf': 2.0, 'Be': 17.0}",GGA,mp-1212567,"['mp-1212567', 'mp-1337432', 'mp-1844263']",0.0002900333333333,"{'Hf': 12.0, 'Be': 102.0}",1053.7599926081737,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.65141968968931e-06,0.0002900333333333,0,0.0017402,MP,data/source/MP/cleaned/cifs/MP-mp-1212567.cif,False,,data/final/MP/graphs/Be17Hf2-MP-mp-1212567.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Pt3Sn1,1,0.0,1.0,True,Pt3Sn1,Pt3Sn1,0.0,Other,True,Pt75Sn25,Pt-Sn,2,Supercon,Pt3Sn1,MP-mp-20971,Sn1Pt3,Pt-Sn,Pt75Sn25,P m -3 m,cubic,4.065812,4.065812,4.065812,data/final/MP/cifs/Pt3Sn1-MP-mp-20971.cif,data/source/MP/raw/cifs/mp-20971.cif,mp-20971,0.0,,2014-12-22 16:14:13,17.392276612742958,10.17188/1196206,"@misc{osti_1196206,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SnPt3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196206"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686369'}},0.0,8.86478404,520.0,-23.73028416,-5.93257104,{'tags': ['Platinum tin (3/1)']},-23.73028416,-5.93257104,-0.3769972937499997,"['xas', 'elasticity', 'bandstructure']",True,"[108711, 105795, 183076, 658325, 105796]",True,2021-05-12 10:56:14.760000,NM,4,12,mp-20971,,SnPt3,"{'functional': 'PBE', 'labels': ['Sn_d', 'Pt'], 'pot_type': 'paw'}","{'Sn': 1.0, 'Pt': 3.0}",GGA,mp-20971,"['mp-914334', 'mp-977829', 'mp-20971', 'mp-1066366', 'mp-1066347', 'mp-1141934', 'mp-1440114', 'mp-1686369', 'mp-1793089', 'mp-992487', 'mp-1592032', 'mp-1066370']",9.71e-05,"{'Sn': 1.0, 'Pt': 3.0}",67.21123567833547,[],NM,False,221,0,"[0, 0, 0, 0]",1.4446989260055924e-06,9.71e-05,0,9.71e-05,MP,data/source/MP/cleaned/cifs/MP-mp-20971.cif,False,,data/final/MP/graphs/Pt3Sn1-MP-mp-20971.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Sn0.25Te0.75,1,0.0,4.0,False,Sn1Te3,Sn1Te3,1.7,Other,True,Sn25Te75,Sn-Te,2,Supercon,Sn0.25Te0.75,MP-mp-978885,Sn1Te3,Sn-Te,Sn25Te75,F m -3 m,cubic,5.46058828,5.460588279999999,5.460588279999999,data/final/MP/cifs/Sn0.25Te0.75-MP-mp-978885.cif,data/source/MP/raw/cifs/mp-978885.cif,mp-978885,0.0,,2015-10-08 18:00:52,7.233115420308162,10.17188/1316020,"@misc{osti_1316020,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SnTe3 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1316020"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1757735'}},0.1139585250000005,7.61412082,520.0,-12.71196414,-3.177991035,{'tags': []},-12.71196414,-3.177991035,-0.1346223737499996,"['xas', 'elasticity', 'bandstructure']",True,[],True,2021-05-12 10:56:37.246000,NM,4,8,mp-978885,,SnTe3,"{'functional': 'PBE', 'labels': ['Sn_d', 'Te'], 'pot_type': 'paw'}","{'Sn': 1.0, 'Te': 3.0}",GGA,mp-978885,"['mp-978885', 'mp-978905', 'mp-978900', 'mp-1430307', 'mp-1757735', 'mp-1803870', 'mp-978924', 'mp-1638317']",0.0024959,"{'Sn': 1.0, 'Te': 3.0}",115.13392209287956,[],NM,False,225,0,"[0, 0, 0, 0]",2.1678233092646104e-05,0.0024959,0,0.0024959,MP,data/source/MP/cleaned/cifs/MP-mp-978885.cif,False,,data/final/MP/graphs/Sn0.25Te0.75-MP-mp-978885.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Cr0.72Ru0.28,3,0.06,8.0,False,Cr5.76Ru2.24,Cr6Ru2,3.468,Other,True,Cr72Ru28,Cr-Ru,2,Supercon,Cr0.72Ru0.28,MP-mp-1272,Cr6Ru2,Cr-Ru,Cr75Ru25,P m -3 n,cubic,4.632632,4.632632,4.632632,data/final/MP/cifs/Cr0.72Ru0.28-MP-mp-1272-synth_doped.cif,data/source/MP/raw/cifs/mp-1272.cif,mp-1272,0.0,,2011-05-14 14:28:27,8.586720287673844,10.17188/1189141,"@misc{osti_1189141,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Cr3Ru (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189141"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702571'}},0.0821159475000019,7.27903235,520.0,-75.81013655,-9.47626706875,{'tags': ['Chromium ruthenium (3/1)']},-75.81013655,-9.47626706875,0.0821159475000019,"['xas', 'elasticity', 'bandstructure']",True,"[102843, 659684]",True,2021-05-12 10:56:12.755000,NM,8,8,mp-1272,,Cr3Ru,"{'functional': 'PBE', 'labels': ['Cr_pv', 'Ru_pv'], 'pot_type': 'paw'}","{'Cr': 3.0, 'Ru': 1.0}",GGA,mp-1272,"['mp-930605', 'mp-913890', 'mp-1272', 'mp-1413111', 'mp-1702571', 'mp-1797412', 'mp-977663', 'mp-1589232']",0.1460382,"{'Cr': 6.0, 'Ru': 2.0}",99.42220900255236,[],NM,False,223,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0029377379856094,0.1460382,0,0.2920764,MP,data/source/MP/cleaned/cifs/MP-mp-1272.cif,True,,data/final/MP/graphs/Cr0.72Ru0.28-MP-mp-1272-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Al2Lu1Pd5,1,0.0,1.0,True,Al2Lu1Pd5,Al2Lu1Pd5,0.0,Other,True,Al25Lu12.5Pd62.5,Al-Lu-Pd,3,Supercon,Lu1Pd5Al2,MP-mp-1025564,Lu1Al2Pd5,Al-Lu-Pd,Al25Lu12.5Pd62.5,I 4/m m m,tetragonal,4.113573999743643,4.113573999743643,8.01599418,data/final/MP/cifs/Al2Lu1Pd5-MP-mp-1025564.cif,data/source/MP/raw/cifs/mp-1025564.cif,mp-1025564,0.0,,2016-10-14 02:33:37,9.997997538568912,10.17188/1355431,"@article{osti_1355431,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LuAl2Pd5 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1355431"",
    place = ""United States"",
    year = ""2017"",
    month = ""5""
}
",{'GGA': {'task_id': 'mp-1752678'}},0.0,6.04707163,520.0,-45.70990268,-5.713737835,"{'tags': ['LuPd5Al2', 'ZrNi2Al5']}",-45.70990268,-5.713737835,-0.9747989312499996,['bandstructure'],True,[],True,2021-05-12 10:58:09.072000,NM,8,6,mp-1025564,,LuAl2Pd5,"{'functional': 'PBE', 'labels': ['Lu_3', 'Al', 'Pd'], 'pot_type': 'paw'}","{'Lu': 1.0, 'Al': 2.0, 'Pd': 5.0}",GGA,mp-1025564,"['mp-1025564', 'mp-1260156', 'mp-1386998', 'mp-1752678', 'mp-1789769', 'mp-1619532']",0.0100568,"{'Lu': 1.0, 'Al': 2.0, 'Pd': 5.0}",126.39732798224908,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0, 0]",7.956497309351627e-05,0.0100568,0,0.0100568,MP,data/source/MP/cleaned/cifs/MP-mp-1025564.cif,False,,data/final/MP/graphs/Al2Lu1Pd5-MP-mp-1025564.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B2C1Lu0.25Ni2Y0.75,3,0.0833333333333333,1.0,True,B2C1Lu0.25Ni2Y0.75,B2C1Ni2Y1,14.55,Other,True,B33.333C16.667Lu4.167Ni33.333Y12.5,B-C-Lu-Ni-Y,5,Supercon,Lu0.25Y0.75Ni2B2C1,MP-mp-6576,Y1Ni2B2C1,B-C-Ni-Y,B33.333C16.667Ni33.333Y16.667,I 4/m m m,tetragonal,3.548790000501972,3.548790000501972,5.76144136,data/final/MP/cifs/B2C1Lu0.25Ni2Y0.75-MP-mp-6576-synth_doped.cif,data/source/MP/raw/cifs/mp-6576.cif,mp-6576,0.0,,2011-05-13 05:21:43,6.099730998852292,10.17188/1281366,"@misc{osti_1281366,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281366"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688230'}},0.0,6.81083016,520.0,-43.677878,-7.279646333333333,{'tags': []},-43.677878,-7.279646333333333,-0.5109282141666659,"['xas', 'bandstructure']",True,"[75816, 89142, 83231, 79574, 41549]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6576,,YNi2B2C,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6576,"['mp-6576', 'mp-1007054', 'mp-1000583', 'mp-1439516', 'mp-1688230', 'mp-1794280', 'mp-1011792', 'mp-1597064']",0.0006603,"{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.3152437079014,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",1.010943177297096e-05,0.0006603,0,0.0006603,MP,data/source/MP/cleaned/cifs/MP-mp-6576.cif,True,,data/final/MP/graphs/B2C1Lu0.25Ni2Y0.75-MP-mp-6576-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ce0.15Cu1La1.85O4,2,0.0428571428571428,1.0,True,Ce0.15Cu1La1.85O4,Cu1La2O4,9.25,Cuprate,True,Ce2.143Cu14.286La26.429O57.142857142857146,Ce-Cu-La-O,4,Supercon,La1.85Ce0.15Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ce0.15Cu1La1.85O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ce0.15Cu1La1.85O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
C1Mo0.85Ta0.15,3,0.15,1.0,True,C1Mo0.85Ta0.15,C1Mo1,8.9,Other,True,C50Mo42.5Ta7.5,C-Mo-Ta,3,Supercon,C1Mo0.85Ta0.15,MP-mp-2305,Mo1C1,C-Mo,C50Mo50,P -6 m 2,hexagonal,2.835086,2.92410600478411,2.92410507,data/final/MP/cifs/C1Mo0.85Ta0.15-MP-mp-2305-synth_doped.cif,data/source/MP/raw/cifs/mp-2305.cif,mp-2305,0.0,,2011-05-12 17:49:42,8.538697979393088,10.17188/1199194,"@misc{osti_1199194,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MoC (SG:187) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199194"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668222'}},0.0010243049999996,8.62658168,520.0,-20.24014809,-10.120074045,{'tags': ['Molybdenum carbide (1/1)']},-20.24014809,-10.120074045,-0.0838621800000005,"['xas', 'elasticity', 'bandstructure']",True,"[77156, 618300]",True,2021-05-12 10:56:16.728000,NM,2,9,mp-2305,,MoC,"{'functional': 'PBE', 'labels': ['Mo_pv', 'C'], 'pot_type': 'paw'}","{'Mo': 1.0, 'C': 1.0}",GGA,mp-2305,"['mp-927633', 'mp-927239', 'mp-911174', 'mp-2305', 'mp-1116092', 'mp-1440368', 'mp-1668222', 'mp-1791400', 'mp-1638434']",0.0001977,"{'Mo': 1.0, 'C': 1.0}",20.99340614335182,[],NM,False,187,0,"[0, 0]",9.417242664197564e-06,0.0001977,0,0.0001977,MP,data/source/MP/cleaned/cifs/MP-mp-2305.cif,True,,data/final/MP/graphs/C1Mo0.85Ta0.15-MP-mp-2305-synth_doped.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Ag3.3Al1,2,0.0348837209302325,0.9090454545454546,True,Ag3Al0.909,Ag3Al1,0.34,Other,True,Ag76.744Al23.256,Ag-Al,2,Supercon,Ag3.3Al1,MP-mp-1228927,Al1Ag3,Ag-Al,Ag75Al25,C m m m,orthorhombic,2.86470806,2.86470806,8.982326,data/final/MP/cifs/Ag3.3Al1-MP-mp-1228927-synth_doped.cif,data/source/MP/raw/cifs/mp-1228927.cif,mp-1228927,0.0,,2019-01-13 04:34:55.563000,8.320607458548649,,,{'GGA': {'task_id': 'mp-1767003'}},0.0907937345,4.55702639,520.0,-12.18500697,-3.0462517425,{'tags': []},-12.18500697,-3.0462517425,0.0145592174999999,['bandstructure'],True,[],True,2021-05-12 10:58:49.477000,NM,4,5,mp-1228927,,AlAg3,"{'functional': 'PBE', 'labels': ['Al', 'Ag'], 'pot_type': 'paw'}","{'Al': 1.0, 'Ag': 3.0}",GGA,mp-1228927,"['mp-1228927', 'mp-1426765', 'mp-1767003', 'mp-1801525', 'mp-1613693']",1.04e-05,"{'Al': 1.0, 'Ag': 3.0}",69.96628338182508,[],NM,False,65,0,"[0, 0, 0, 0]",1.486430248587647e-07,1.04e-05,0,1.04e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1228927.cif,True,,data/final/MP/graphs/Ag3.3Al1-MP-mp-1228927-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Nb0.18U0.82,3,0.1399999999999999,8.0,False,Nb1.44U6.56,Nb2U6,2.011,Heavy_fermion,True,Nb18U82,Nb-U,2,Supercon,Nb0.18U0.82,MP-mp-972551,U6Nb2,Nb-U,Nb25U75,P 63/m m c,hexagonal,5.47549,5.930717999946023,5.930717609999999,data/final/MP/cifs/Nb0.18U0.82-MP-mp-972551-synth_doped.cif,data/source/MP/raw/cifs/mp-972551.cif,mp-972551,0.0,,2015-09-16 01:37:32,16.068701668754734,10.17188/1313878,"@misc{osti_1313878,
    author = ""Persson, Kristin"",
    title = ""Materials Data on U3Nb (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1313878"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1752359'}},0.3415145425000006,12.07866299,520.0,-85.2189538,-10.652369225,{'tags': []},-85.2189538,-10.652369225,0.3415145425000006,"['xas', 'bandstructure']",True,[],True,2021-05-12 10:57:55.580000,NM,8,8,mp-972551,,U3Nb,"{'functional': 'PBE', 'labels': ['U', 'Nb_pv'], 'pot_type': 'paw'}","{'U': 3.0, 'Nb': 1.0}",GGA,mp-972551,"['mp-972719', 'mp-972786', 'mp-972551', 'mp-1386707', 'mp-1752359', 'mp-1827596', 'mp-1655008', 'mp-972844']",0.14362885,"{'U': 6.0, 'Nb': 2.0}",166.789279340187,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0017222791604855,0.14362885,0,0.2872577,MP,data/source/MP/cleaned/cifs/MP-mp-972551.cif,True,,data/final/MP/graphs/Nb0.18U0.82-MP-mp-972551-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
B2Mg0.9,2,0.0459770114942528,1.0,True,B2Mg0.9,B2Mg1,38.2,Other,True,B68.966Mg31.034,B-Mg,2,Supercon,B2Mg0.9,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B2Mg0.9-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B2Mg0.9-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Al4Cu9,1,0.0,4.0,False,Al16Cu36,Al16Cu36,0.0,Other,True,Al30.769Cu69.231,Al-Cu,2,Supercon,Al4Cu9,MP-mp-593,Al16Cu36,Al-Cu,Al30.769Cu69.231,P -4 3 m,cubic,8.701462,8.701462,8.701462,data/final/MP/cifs/Al4Cu9-MP-mp-593.cif,data/source/MP/raw/cifs/mp-593.cif,mp-593,0.0,,2014-02-16 15:31:01,6.853922941979292,10.17188/1277187,"@misc{osti_1277187,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Al4Cu9 (SG:215) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277187"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-927534'}},0.0,7.88771728,520.0,-218.32140255,-4.198488510576923,"{'tags': ['Aluminium copper (4/9) - delta', 'Aluminium copper (4/9)', 'Aluminium copper (4/9) - gamma']}",-218.32140255,-4.198488510576923,-0.208091329807692,"['xas', 'elasticity', 'bandstructure']",True,"[1625, 606890, 151371, 57670, 57669]",True,2021-05-12 10:56:27.046000,NM,52,7,mp-593,,Al4Cu9,"{'functional': 'PBE', 'labels': ['Al', 'Cu_pv'], 'pot_type': 'paw'}","{'Al': 4.0, 'Cu': 9.0}",GGA,mp-593,"['mp-911564', 'mp-928356', 'mp-927534', 'mp-593', 'mp-1259628', 'mp-1342700', 'mp-1872951']",0.02552195,"{'Al': 16.0, 'Cu': 36.0}",658.8350321304132,[],NM,False,215,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0001549519910468,0.02552195,0,0.1020878,MP,data/source/MP/cleaned/cifs/MP-mp-593.cif,False,,data/final/MP/graphs/Al4Cu9-MP-mp-593.json,0,True,-43m,5,0,0,0,0,0,0,1,0,0,0,1.0,False
Rh43Zr57,3,0.14,0.0701807425540595,False,Rh3.018Zr4,Rh4Zr4,2.18,Other,True,Rh43Zr57,Rh-Zr,2,Supercon,Rh43Zr57,MP-mp-669917,Zr4Rh4,Rh-Zr,Rh50Zr50,P n m a,orthorhombic,4.492176,5.359641,6.154265,data/final/MP/cifs/Rh43Zr57-MP-mp-669917-synth_doped.cif,data/source/MP/raw/cifs/mp-669917.cif,mp-669917,0.0,,2013-10-10 08:44:23,8.702258262059981,10.17188/1281732,"@misc{osti_1281732,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrRh (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281732"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696038'}},0.0,5.42824024,520.0,-70.02420398,-8.7530254975,{'tags': ['Rhodium zirconium (1/1)']},-70.02420398,-8.7530254975,-0.7970212475,"['xas', 'elasticity', 'bandstructure']",True,[105979],True,2021-05-12 10:56:27.046000,NM,8,8,mp-669917,,ZrRh,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Rh_pv'], 'pot_type': 'paw'}","{'Zr': 1.0, 'Rh': 1.0}",GGA,mp-669917,"['mp-943104', 'mp-942084', 'mp-932818', 'mp-669917', 'mp-1432823', 'mp-1696038', 'mp-1924542', 'mp-1588225']",6.2e-06,"{'Zr': 4.0, 'Rh': 4.0}",148.17285767532087,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.6737208412584057e-07,6.2e-06,0,2.48e-05,MP,data/source/MP/cleaned/cifs/MP-mp-669917.cif,True,,data/final/MP/graphs/Rh43Zr57-MP-mp-669917-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ba1Pb0.75Sb0.25O3,3,0.1,2.0,False,Ba2Pb1.5Sb0.5O6,Ba2Pb2O6,3.5,Oxide,True,Ba20Pb15Sb5O60,Ba-Pb-Sb-O,4,Supercon,Ba1Pb0.75Sb0.25O3,MP-mp-20461,Ba2Pb2O6,Ba-Pb-O,Ba20Pb20O60,C 1 2/m 1,monoclinic,6.13110795,6.15036645,6.15036645,data/final/MP/cifs/Ba1Pb0.75Sb0.25O3-MP-mp-20461-synth_doped.cif,data/source/MP/raw/cifs/mp-20461.cif,mp-20461,0.2051999999999996,,2014-02-21 12:57:54,7.877180851020856,10.17188/1195591,"@misc{osti_1195591,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BaPbO3 (SG:12) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195591"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688120'}},0.0,2.99844765,520.0,-57.91699323,-5.7916993230000005,"{'tags': ['Barium plumbate', 'Barium lead(IV) oxide']}",-57.91699323,-5.7916993230000005,-2.108799140000001,"['diel', 'xas', 'bandstructure']",True,"[67299, 51656]",True,2021-05-12 10:56:45.290000,NM,10,10,mp-20461,oxide,BaPbO3,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Pb_d', 'O'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Pb': 1.0, 'O': 3.0}",GGA,mp-20461,"['mp-919763', 'mp-918765', 'mp-905786', 'mp-551164', 'mp-20461', 'mp-1141988', 'mp-1439228', 'mp-1688120', 'mp-1833847', 'mp-1588870']",5.695e-05,"{'Ba': 2.0, 'Pb': 2.0, 'O': 6.0}",165.49154870311418,[],NM,False,12,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.882526684449154e-07,5.695e-05,0,0.0001139,MP,data/source/MP/cleaned/cifs/MP-mp-20461.cif,True,,data/final/MP/graphs/Ba1Pb0.75Sb0.25O3-MP-mp-20461-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,0.5,False
Cr1Ga4,1,0.0,1.0,True,Cr1Ga4,Cr1Ga4,0.0,Other,True,Cr20Ga80,Cr-Ga,2,Supercon,Cr1Ga4,MP-mp-1070544,Cr1Ga4,Cr-Ga,Cr20Ga80,I m -3 m,cubic,4.912979441089131,4.912979440000001,4.91297944,data/final/MP/cifs/Cr1Ga4-MP-mp-1070544.cif,data/source/MP/raw/cifs/mp-1070544.cif,mp-1070544,0.0,,2018-03-22 03:29:25,6.018902353877146,,,{'GGA': {'task_id': 'mp-1696631'}},0.0,2.90230841,520.0,-22.54707074,-4.509414147999999,"{'tags': ['Hg4Pt', 'Chromium gallide (1/4)', 'CrGa4']}",-22.54707074,-4.509414147999999,-0.1563278359999991,['bandstructure'],True,[626026],True,2021-05-12 10:58:14.654000,NM,5,8,mp-1070544,,CrGa4,"{'functional': 'PBE', 'labels': ['Cr_pv', 'Ga_d'], 'pot_type': 'paw'}","{'Cr': 1.0, 'Ga': 4.0}",GGA,mp-1070544,"['mp-1070544', 'mp-1070550', 'mp-1070571', 'mp-1419509', 'mp-1696631', 'mp-1933618', 'mp-1590956', 'mp-1070585']",1.52e-05,"{'Cr': 1.0, 'Ga': 4.0}",91.28784359977382,[],NM,False,229,0,"[0, 0, 0, 0, 0]",1.6650628824841317e-07,1.52e-05,0,1.52e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1070544.cif,False,,data/final/MP/graphs/Cr1Ga4-MP-mp-1070544.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,1,0,1.0,False
Gd0.055In1La2.945,2,0.0275,1.0,True,Gd0.055In1La2.945,In1La3,2.71,Other,True,Gd1.375In25La73.625,Gd-In-La,3,Supercon,La2.9451Gd0.0549In1,MP-mp-20909,La3In1,In-La,In25La75,P m -3 m,cubic,5.076766,5.076766,5.076766,data/final/MP/cifs/Gd0.055In1La2.945-MP-mp-20909-synth_doped.cif,data/source/MP/raw/cifs/mp-20909.cif,mp-20909,0.0,,2014-02-21 06:52:52,6.7455760598452565,10.17188/1196104,"@misc{osti_1196104,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La3In (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196104"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671685'}},0.0,8.16935076,520.0,-18.73796121,-4.6844903025,"{'tags': ['Indium lanthanum (1/3)', 'Lanthanum indium (3/1)']}",-18.73796121,-4.6844903025,-0.2945640412500001,"['xas', 'bandstructure']",True,"[639844, 51950, 639851, 639840, 603208, 107019]",True,2021-05-12 10:56:57.051000,NM,4,8,mp-20909,,La3In,"{'functional': 'PBE', 'labels': ['La', 'In_d'], 'pot_type': 'paw'}","{'La': 3.0, 'In': 1.0}",GGA,mp-20909,"['mp-906743', 'mp-921394', 'mp-920373', 'mp-20909', 'mp-1476042', 'mp-1671685', 'mp-1778647', 'mp-1590323']",0.0489742,"{'La': 3.0, 'In': 1.0}",130.84629766481785,[],NM,False,221,0,"[0, 0, 0, 0]",0.0003742880071811,0.0489742,0,0.0489742,MP,data/source/MP/cleaned/cifs/MP-mp-20909.cif,True,,data/final/MP/graphs/Gd0.055In1La2.945-MP-mp-20909-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
B2Ir3U1,1,0.0,1.0,True,B2Ir3U1,B2Ir3U1,0.0,Heavy_fermion,True,B33.333Ir50U16.667,B-Ir-U,3,Supercon,U1Ir3B2,MP-mp-10116,U1B2Ir3,B-Ir-U,B33.333Ir50U16.667,P 6/m m m,hexagonal,3.154215,5.470604003075261,5.47060397,data/final/MP/cifs/B2Ir3U1-MP-mp-10116.cif,data/source/MP/raw/cifs/mp-10116.cif,mp-10116,0.0,,2011-05-28 03:11:14,16.98711816521815,10.17188/1186100,"@misc{osti_1186100,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UB2Ir3 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1186100"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702882'}},0.0,10.46411437,520.0,-54.23739565,-9.039565941666668,{'tags': ['Uranium iridium boride (1/3/2)']},-54.23739565,-9.039565941666668,-0.5119851397222229,"['xas', 'bandstructure']",True,[44426],True,2021-05-12 10:56:51.169000,FM,6,8,mp-10116,,UB2Ir3,"{'functional': 'PBE', 'labels': ['U', 'B', 'Ir'], 'pot_type': 'paw'}","{'U': 1.0, 'B': 2.0, 'Ir': 3.0}",GGA,mp-10116,"['mp-1007274', 'mp-10116', 'mp-1000822', 'mp-1431119', 'mp-1702882', 'mp-1798735', 'mp-1012030', 'mp-1595509']",2.0868636,"{'U': 1.0, 'B': 2.0, 'Ir': 3.0}",81.7508879093244,[],FM,True,191,1,"[2.1, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0255271062292887,2.0868636,1,2.0868636,MP,data/source/MP/cleaned/cifs/MP-mp-10116.cif,False,,data/final/MP/graphs/B2Ir3U1-MP-mp-10116.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Nb1Si2,1,0.0,3.0,False,Nb3Si6,Nb3Si6,0.0,Other,True,Nb33.333Si66.667,Nb-Si,2,Supercon,Nb1Si2,MP-mp-12104,Nb3Si6,Nb-Si,Nb33.333Si66.667,P 64 2 2,hexagonal,4.817956001240644,4.81795575,6.623552,data/final/MP/cifs/Nb1Si2-MP-mp-12104.cif,data/source/MP/raw/cifs/mp-12104.cif,mp-12104,0.0,,2011-05-28 08:29:13,5.577439820821865,10.17188/1188577,"@misc{osti_1188577,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbSi2 (SG:181) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188577"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1751316'}},0.0,8.69742138,520.0,-67.79900716,-7.533223017777778,{'tags': ['Niobium silicide (1/2)']},-67.79900716,-7.533223017777778,-0.5019119911111116,"['xas', 'elasticity', 'bandstructure']",True,[645450],True,2021-05-12 10:56:12.755000,NM,9,12,mp-12104,,NbSi2,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Si'], 'pot_type': 'paw'}","{'Nb': 1.0, 'Si': 2.0}",GGA,mp-12104,"['mp-1001145', 'mp-1007508', 'mp-12104', 'mp-1138568', 'mp-1145844', 'mp-1115731', 'mp-1249800', 'mp-1411017', 'mp-1751316', 'mp-1932663', 'mp-1012272', 'mp-1621919']",0.0008655,"{'Nb': 3.0, 'Si': 6.0}",133.15185177554952,[],NM,False,181,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0]",1.950029207537309e-05,0.0008655,0,0.0025965,MP,data/source/MP/cleaned/cifs/MP-mp-12104.cif,False,,data/final/MP/graphs/Nb1Si2-MP-mp-12104.json,0,True,622,0,4,0,0,0,0,0,1,0,0,0,0.5,False
As2Fe2Rb1,1,0.0,1.0,True,As2Fe2Rb1,As2Fe2Rb1,1.983333333,Ferrite,True,As40Fe40Rb20,As-Fe-Rb,3,Supercon,Rb1Fe2As2,MP-mp-975359,Rb1Fe2As2,As-Fe-Rb,As40Fe40Rb20,I 4/m m m,tetragonal,3.756793998676204,3.756793998676204,7.71561827,data/final/MP/cifs/As2Fe2Rb1-MP-mp-975359.cif,data/source/MP/raw/cifs/mp-975359.cif,mp-975359,0.0,,2015-09-17 05:55:46,5.636025040487316,10.17188/1314774,"@misc{osti_1314774,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Rb(FeAs)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1314774"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1760383'}},0.0,3.75456325,520.0,-28.58461133,-5.716922266,{'tags': ['Rubidium diiron diarsenide']},-28.58461133,-5.716922266,-0.2691647095000007,"['xas', 'elasticity', 'bandstructure']",True,[167329],True,2021-05-12 10:56:35.166000,FM,5,8,mp-975359,,Rb(FeAs)2,"{'functional': 'PBE', 'labels': ['Rb_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Rb': 1.0, 'Fe': 2.0, 'As': 2.0}",GGA,mp-975359,"['mp-975542', 'mp-975453', 'mp-975359', 'mp-1415647', 'mp-1760383', 'mp-1784381', 'mp-975595', 'mp-1585189']",1.4778717,"{'Rb': 1.0, 'Fe': 2.0, 'As': 2.0}",102.23672047408876,[],FM,True,139,1,"[0.0, 0.9, 0.9, 0.0, 0.0]",0.0144553903249914,1.4778717,2,1.4778717,MP,data/source/MP/cleaned/cifs/MP-mp-975359.cif,False,,data/final/MP/graphs/As2Fe2Rb1-MP-mp-975359.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
N0.84Nb1,3,0.0869565217391304,1.0,True,N0.84Nb1,N1Nb1,13.5,Other,True,N45.652Nb54.348,N-Nb,2,Supercon,N0.84Nb1,MP-mp-2634,Nb1N1,N-Nb,N50Nb50,P -6 m 2,hexagonal,2.898656,2.9761920047347994,2.97619211,data/final/MP/cifs/N0.84Nb1-MP-mp-2634-synth_doped.cif,data/source/MP/raw/cifs/mp-2634.cif,mp-2634,0.0,,2011-05-12 17:49:04,7.984187332554685,10.17188/1201157,"@misc{osti_1201157,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbN (SG:187) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201157"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671304'}},0.0,7.12357548,520.0,-20.57319827,-10.286599135,"{'tags': ['Niobium nitride (1/1)', 'Niobium nitride', 'Niobium nitride (1/1) - gamma']}",-20.57319827,-10.286599135,-1.2481991524999998,"['xas', 'elasticity', 'bandstructure']",True,"[185569, 644536, 76385, 191062]",True,2021-05-12 10:56:18.721000,NM,2,17,mp-2634,,NbN,"{'functional': 'PBE', 'labels': ['Nb_pv', 'N'], 'pot_type': 'paw'}","{'Nb': 1.0, 'N': 1.0}",GGA,mp-2634,"['mp-926732', 'mp-910421', 'mp-926222', 'mp-2634', 'mp-1058402', 'mp-1058440', 'mp-1058487', 'mp-1061535', 'mp-1061589', 'mp-1061648', 'mp-1116126', 'mp-1442283', 'mp-1671304', 'mp-1924826', 'mp-1594881', 'mp-1061618', 'mp-1058457']",0.0002504,"{'Nb': 1.0, 'N': 1.0}",22.23561881453577,[],NM,False,187,0,"[0, 0]",1.1261211216496917e-05,0.0002504,0,0.0002504,MP,data/source/MP/cleaned/cifs/MP-mp-2634.cif,True,,data/final/MP/graphs/N0.84Nb1-MP-mp-2634-synth_doped.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Cu1La1Sb2,1,0.0,2.0,False,Cu2La2Sb4,Cu2La2Sb4,0.9,Other,True,Cu25La25Sb50,Cu-La-Sb,3,Supercon,La1Cu1Sb2,MP-mp-1079103,La2Cu2Sb4,Cu-La-Sb,Cu25La25Sb50,P 4/n m m,tetragonal,4.38858,4.38858,10.340965,data/final/MP/cifs/Cu1La1Sb2-MP-mp-1079103.cif,data/source/MP/raw/cifs/mp-1079103.cif,mp-1079103,0.0,,2018-04-14 01:49:27,7.436645207523663,,,{'GGA': {'task_id': 'mp-1698296'}},0.0,8.15591549,520.0,-40.43257879,-5.05407234875,{'tags': ['Lanthanum copper antimonide (1/1/2)']},-40.43257879,-5.05407234875,-0.8267682850000009,['bandstructure'],True,[658225],True,2021-05-12 10:58:16.596000,NM,8,5,mp-1079103,,LaCuSb2,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'Sb'], 'pot_type': 'paw'}","{'La': 1.0, 'Cu': 1.0, 'Sb': 2.0}",GGA,mp-1079103,"['mp-1079103', 'mp-1435758', 'mp-1698296', 'mp-1828201', 'mp-1601061']",0.0055685,"{'La': 2.0, 'Cu': 2.0, 'Sb': 4.0}",199.16320541278785,[],NM,False,129,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",5.591896342960202e-05,0.0055685,0,0.011137,MP,data/source/MP/cleaned/cifs/MP-mp-1079103.cif,False,,data/final/MP/graphs/Cu1La1Sb2-MP-mp-1079103.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ga0.25V0.75,1,0.0,8.0,False,Ga2V6,Ga2V6,14.32088889,Other,True,Ga25V75,Ga-V,2,Supercon,Ga0.25V0.75,MP-mp-22568,V6Ga2,Ga-V,Ga25V75,P m -3 n,cubic,4.789645,4.789645,4.789645,data/final/MP/cifs/Ga0.25V0.75-MP-mp-22568.cif,data/source/MP/raw/cifs/mp-22568.cif,mp-22568,0.0,,2014-02-22 11:36:40,6.726541666276222,10.17188/1198793,"@misc{osti_1198793,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Ga (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198793"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686867'}},0.0,5.67452231,520.0,-61.95244347,-7.74405543375,{'tags': ['Gallium vanadium (1/3)']},-61.95244347,-7.74405543375,-0.1741018756249994,"['xas', 'elasticity', 'bandstructure']",True,"[635643, 635628, 635619, 635634, 104021, 635646, 635604, 635610, 635617, 635624, 635626, 635605, 635631, 635625, 635636, 635603, 104020, 635616, 635607]",True,2021-05-12 10:56:16.728000,FM,8,9,mp-22568,,V3Ga,"{'functional': 'PBE', 'labels': ['V_pv', 'Ga_d'], 'pot_type': 'paw'}","{'V': 3.0, 'Ga': 1.0}",GGA,mp-22568,"['mp-941343', 'mp-941663', 'mp-934924', 'mp-22568', 'mp-1440749', 'mp-1686867', 'mp-1804076', 'mp-1593784', 'mp-1595713']",0.09063635,"{'V': 6.0, 'Ga': 2.0}",109.87780534443452,[],FM,True,131,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.0, -0.0, -0.0]",0.0016497662965852,0.09063635,2,0.1812727,MP,data/source/MP/cleaned/cifs/MP-mp-22568.cif,False,,data/final/MP/graphs/Ga0.25V0.75-MP-mp-22568.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
B0.2P0.8Ru1Zr1,3,0.1333333333333333,4.0,False,B0.8P3.2Ru4Zr4,P4Ru4Zr4,5.4,Other,True,B6.667P26.667Ru33.333Zr33.333,B-P-Ru-Zr,4,Supercon,Zr1Ru1P0.8B0.2,MP-mp-22268,Zr4P4Ru4,P-Ru-Zr,P33.333Ru33.333Zr33.333,P n m a,orthorhombic,3.896771,6.476559,7.378435,data/final/MP/cifs/B0.2P0.8Ru1Zr1-MP-mp-22268-synth_doped.cif,data/source/MP/raw/cifs/mp-22268.cif,mp-22268,0.0,,2014-02-22 18:40:36,7.963823777103373,10.17188/1197495,"@misc{osti_1197495,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrPRu (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197495"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677547'}},0.0,7.91938263,520.0,-106.40582437,-8.867152030833333,"{'tags': ['Ruthenium zirconium phosphide (1/1/1)', 'Zirconium ruthenium phosphide (1/1/1)']}",-106.40582437,-8.867152030833333,-1.1220211002777785,"['xas', 'elasticity', 'bandstructure']",True,"[648038, 30727]",True,2021-05-12 10:56:16.728000,NM,12,9,mp-22268,,ZrPRu,"{'functional': 'PBE', 'labels': ['Zr_sv', 'P', 'Ru_pv'], 'pot_type': 'paw'}","{'Zr': 1.0, 'P': 1.0, 'Ru': 1.0}",GGA,mp-22268,"['mp-921696', 'mp-907212', 'mp-920689', 'mp-22268', 'mp-1102635', 'mp-1442687', 'mp-1677547', 'mp-1785321', 'mp-1602314']",3.01e-05,"{'Zr': 4.0, 'P': 4.0, 'Ru': 4.0}",186.21448765818843,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.46566233992512e-07,3.01e-05,0,0.0001204,MP,data/source/MP/cleaned/cifs/MP-mp-22268.cif,True,,data/final/MP/graphs/B0.2P0.8Ru1Zr1-MP-mp-22268-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
B2C1La0.05Lu0.95Ni2,2,0.0166666666666666,1.0,True,B2C1La0.05Lu0.95Ni2,B2C1Lu1Ni2,15.3,Other,True,B33.333C16.667La0.833Lu15.833Ni33.333,B-C-La-Lu-Ni,5,Supercon,Lu0.95La0.05Ni2B2C1,MP-mp-6544,Lu1Ni2B2C1,B-C-Lu-Ni,B33.333C16.667Lu16.667Ni33.333,I 4/m m m,tetragonal,3.4660159989239463,3.4660159989239463,5.81490896,data/final/MP/cifs/B2C1La0.05Lu0.95Ni2-MP-mp-6544-synth_doped.cif,data/source/MP/raw/cifs/mp-6544.cif,mp-6544,0.0,,2011-05-13 04:17:06,8.54504130524706,10.17188/1281287,"@misc{osti_1281287,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LuNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281287"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702891'}},0.0,6.71335166,520.0,-41.78223818,-6.963706363333333,{'tags': []},-41.78223818,-6.963706363333333,-0.5192416763888884,"['xas', 'bandstructure']",True,"[75609, 83230, 79564]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6544,,LuNi2B2C,"{'functional': 'PBE', 'labels': ['Lu_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Lu': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6544,"['mp-1000584', 'mp-1007055', 'mp-6544', 'mp-1441469', 'mp-1702891', 'mp-1783160', 'mp-1011794', 'mp-1588498']",0.0023161,"{'Lu': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",63.34823894903922,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",3.656139520884231e-05,0.0023161,0,0.0023161,MP,data/source/MP/cleaned/cifs/MP-mp-6544.cif,True,,data/final/MP/graphs/B2C1La0.05Lu0.95Ni2-MP-mp-6544-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ni2P2Sr1,1,0.0,3.0,False,Ni6P6Sr3,Ni6P6Sr3,1.415,Ferrite,True,Ni40P40Sr20,Ni-P-Sr,3,Supercon,Sr1Ni2P2,MP-mp-29167,Sr3Ni6P6,Ni-P-Sr,Ni40P40Sr20,I m m m,orthorhombic,3.9504480020780215,8.175182199999998,8.175182200370694,data/final/MP/cifs/Ni2P2Sr1-MP-mp-29167.cif,data/source/MP/raw/cifs/mp-29167.cif,mp-29167,0.0,,2014-02-26 00:19:32,5.385055932762331,10.17188/1203457,"@misc{osti_1203457,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr(NiP)2 (SG:71) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1203457"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1708088'}},0.0,6.65797546,520.0,-83.99002559,-5.599335039333334,{'tags': ['Strontium nickel phosphide (1/2/2) - NT']},-83.99002559,-5.599335039333334,-0.7840606739999998,"['xas', 'bandstructure']",True,[85406],True,2021-05-12 10:57:03.017000,NM,15,6,mp-29167,,Sr(NiP)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ni_pv', 'P'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Ni': 2.0, 'P': 2.0}",GGA,mp-29167,"['mp-29167', 'mp-505317', 'mp-1413204', 'mp-1708088', 'mp-1777178', 'mp-1599113']",0.0049636333333333,"{'Sr': 3.0, 'Ni': 6.0, 'P': 6.0}",246.9545847998669,[],NM,False,71,0,"[0.0, 0.0, 0.0, 0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",6.0298131383418736e-05,0.0049636333333333,0,0.0148909,MP,data/source/MP/cleaned/cifs/MP-mp-29167.cif,False,,data/final/MP/graphs/Ni2P2Sr1-MP-mp-29167.json,0,True,mmm,0,0,0,7,0,0,0,0,0,1,0,1.0,False
C2Dy1,3,0.1333333333333334,6.0,False,C12Dy6,C12Dy8,0.0,Carbon,True,C66.667Dy33.333,C-Dy,2,Supercon,C2Dy1,MP-mp-2238,Dy8C12,C-Dy,C60Dy40,I -4 3 d,cubic,7.133816711581456,7.13381671,7.13381671,data/final/MP/cifs/C2Dy1-MP-mp-2238-synth_doped.cif,data/source/MP/raw/cifs/mp-2238.cif,mp-2238,0.0,,2011-05-15 03:41:50,8.580467606616118,10.17188/1197599,"@misc{osti_1197599,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Dy2C3 (SG:220) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197599"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1705233'}},0.0337898850333342,5.24617687,520.0,-152.82906983,-7.6414534915,{'tags': ['Dysprosium carbide (2/3)']},-152.82906983,-7.6414534915,-0.2626703355000003,"['xas', 'bandstructure']",True,"[2448, 2449, 617567]",True,2021-05-12 10:56:59.077000,NM,20,8,mp-2238,,Dy2C3,"{'functional': 'PBE', 'labels': ['Dy_3', 'C'], 'pot_type': 'paw'}","{'Dy': 2.0, 'C': 3.0}",GGA,mp-2238,"['mp-926141', 'mp-910271', 'mp-925720', 'mp-2238', 'mp-1430273', 'mp-1705233', 'mp-1926812', 'mp-1604870']",0.000422925,"{'Dy': 8.0, 'C': 12.0}",279.4756341178315,[],NM,False,220,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.0531216087580345e-06,0.000422925,0,0.0016917,MP,data/source/MP/cleaned/cifs/MP-mp-2238.cif,True,,data/final/MP/graphs/C2Dy1-MP-mp-2238-synth_doped.json,0,True,-43m,5,0,0,0,0,0,0,0,0,1,0,1.0,False
Ge2Hf1,1,0.0,2.0,False,Ge4Hf2,Ge4Hf2,2.2,Other,True,Ge66.667Hf33.333,Ge-Hf,2,Supercon,Ge2Hf1,MP-mp-13683,Hf2Ge4,Ge-Hf,Ge66.667Hf33.333,C m c m,orthorhombic,3.794497,3.839018001922332,7.72109571,data/final/MP/cifs/Ge2Hf1-MP-mp-13683.cif,data/source/MP/raw/cifs/mp-13683.cif,mp-13683,0.0,,2011-05-29 07:57:31,9.869969362766131,10.17188/1189717,"@misc{osti_1189717,
    author = ""Persson, Kristin"",
    title = ""Materials Data on HfGe2 (SG:63) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189717"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1673433'}},0.0,5.57800515,520.0,-41.23565202,-6.872608670000001,"{'tags': ['Hafnium germanide (1/2)', 'Hafnium germanium (1:2)']}",-41.23565202,-6.872608670000001,-0.47152715,"['xas', 'elasticity', 'bandstructure']",True,"[636542, 16698, 636552]",True,2021-05-12 10:56:12.755000,NM,6,10,mp-13683,,HfGe2,"{'functional': 'PBE', 'labels': ['Hf_pv', 'Ge_d'], 'pot_type': 'paw'}","{'Hf': 1.0, 'Ge': 2.0}",GGA,mp-13683,"['mp-925098', 'mp-909396', 'mp-924397', 'mp-13683', 'mp-1077146', 'mp-1077489', 'mp-1441866', 'mp-1673433', 'mp-1805627', 'mp-1593542']",0.0018157,"{'Hf': 2.0, 'Ge': 4.0}",108.9431413275241,[],NM,False,63,0,"[0, 0, 0, 0, 0, 0]",3.333298412134679e-05,0.0018157,0,0.0036314,MP,data/source/MP/cleaned/cifs/MP-mp-13683.cif,False,,data/final/MP/graphs/Ge2Hf1-MP-mp-13683.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
La0.94Nd0.06Pt1Si1,2,0.04,2.0,False,La1.88Nd0.12Pt2Si2,La2Pt2Si2,2.56,Other,True,La31.333Nd2Pt33.333Si33.333,La-Nd-Pt-Si,4,Supercon,La0.94Nd0.06Pt1Si1,MP-mp-1206485,La2Si2Pt2,La-Pt-Si,La33.333Pt33.333Si33.333,I 41 m d,tetragonal,4.277808001286174,4.277808001286175,7.94541446,data/final/MP/cifs/La0.94Nd0.06Pt1Si1-MP-mp-1206485-synth_doped.cif,data/source/MP/raw/cifs/mp-1206485.cif,mp-1206485,0.0,,2019-01-12 09:47:13.211000,8.943745313538361,,,{'GGA': {'task_id': 'mp-1734531'}},0.0,7.90579938,520.0,-39.77896993,-6.629828321666667,{'tags': ['LaPtSi']},-39.77896993,-6.629828321666667,-1.1287520433333331,['bandstructure'],True,[],True,2021-05-12 10:58:37.524000,NM,6,5,mp-1206485,,LaSiPt,"{'functional': 'PBE', 'labels': ['La', 'Si', 'Pt'], 'pot_type': 'paw'}","{'La': 1.0, 'Si': 1.0, 'Pt': 1.0}",GGA,mp-1206485,"['mp-1206485', 'mp-1387492', 'mp-1734531', 'mp-1788111', 'mp-1628393']",1.825e-05,"{'La': 2.0, 'Si': 2.0, 'Pt': 2.0}",134.4491846861766,[],NM,False,109,0,"[0, 0, 0, 0, 0, 0]",2.714780315343388e-07,1.825e-05,0,3.65e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1206485.cif,True,,data/final/MP/graphs/La0.94Nd0.06Pt1Si1-MP-mp-1206485-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,0,0,1,0,1.0,False
Ca0.78Cl1Cu1Sm1Sr0.22O3,3,0.0628571428571428,2.0,False,Ca1.56Cl2Cu2Sm2Sr0.44O6,Ca2Cl2Cu2Sm2O6,0.0,Cuprate,True,Ca11.143Cl14.286Cu14.286Sm14.286Sr3.143O42.85714285714286,Ca-Cl-Cu-Sm-Sr-O,6,Supercon,Ca0.78Sr0.22Sm1Cu1Cl1O3,MP-mp-620364,Ca2Sm2Cu2Cl2O6,Ca-Cl-Cu-Sm-O,Ca14.286Cl14.286Cu14.286Sm14.286O42.85714285714286,P 4/n m m,tetragonal,3.921618,3.921618,13.571283,data/final/MP/cifs/Ca0.78Cl1Cu1Sm1Sr0.22O3-MP-mp-620364-synth_doped.cif,data/source/MP/raw/cifs/mp-620364.cif,mp-620364,0.0,,2013-06-10 20:46:31,5.369304033090635,10.17188/1278023,"@misc{osti_1278023,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CaSmCuClO3 (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278023"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702820'}},0.0146560968749991,3.63975654,520.0,-87.73025745,-6.266446960714285,{'tags': ['Calcium samarium copper trioxide chloride']},-87.73025745,-6.266446960714285,-2.7177594807142853,"['xas', 'bandstructure']",True,[86428],True,2021-05-12 10:57:28.836000,NM,14,8,mp-620364,oxide,CaSmCuClO3,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Sm_3', 'Cu_pv', 'Cl', 'O'], 'pot_type': 'paw'}","{'Ca': 1.0, 'Sm': 1.0, 'Cu': 1.0, 'Cl': 1.0, 'O': 3.0}",GGA,mp-620364,"['mp-620364', 'mp-916797', 'mp-937365', 'mp-939923', 'mp-1475753', 'mp-1702820', 'mp-1882873', 'mp-1602835']",6.525e-05,"{'Ca': 2.0, 'Sm': 2.0, 'Cu': 2.0, 'Cl': 2.0, 'O': 6.0}",208.71395197319643,[],NM,False,129,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.252576733191231e-07,6.525e-05,0,0.0001305,MP,data/source/MP/cleaned/cifs/MP-mp-620364.cif,True,,data/final/MP/graphs/Ca0.78Cl1Cu1Sm1Sr0.22O3-MP-mp-620364-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Bi0.45Pb0.55,3,0.1,2.0,False,Bi0.9Pb1.1,Bi1Pb1,7.7,Other,True,Bi45Pb55,Bi-Pb,2,Supercon,Bi0.45Pb0.55,MP-mp-1227326,Bi1Pb1,Bi-Pb,Bi50Pb50,P -6 m 2,hexagonal,3.516368000693316,3.5163671200000004,5.970432,data/final/MP/cifs/Bi0.45Pb0.55-MP-mp-1227326-synth_doped.cif,data/source/MP/raw/cifs/mp-1227326.cif,mp-1227326,0.0,,2019-01-13 03:10:32.704000,10.809505812237871,,,{'GGA': {'task_id': 'mp-1734205'}},0.051447295,6.6014312,520.0,-7.49978679,-3.749893395,{'tags': []},-7.49978679,-3.749893395,0.051447295,['bandstructure'],True,[],True,2021-05-12 10:58:49.477000,NM,2,5,mp-1227326,,BiPb,"{'functional': 'PBE', 'labels': ['Bi', 'Pb_d'], 'pot_type': 'paw'}","{'Bi': 1.0, 'Pb': 1.0}",GGA,mp-1227326,"['mp-1227326', 'mp-1415472', 'mp-1734205', 'mp-1793117', 'mp-1609931']",0.0053651,"{'Bi': 1.0, 'Pb': 1.0}",63.93297019839806,[],NM,False,187,0,"[0, 0]",8.391757779047205e-05,0.0053651,0,0.0053651,MP,data/source/MP/cleaned/cifs/MP-mp-1227326.cif,True,,data/final/MP/graphs/Bi0.45Pb0.55-MP-mp-1227326-synth_doped.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Al0.21B2Mg0.79,3,0.1399999999999999,1.0,True,Al0.21B2Mg0.79,B2Mg1,27.1,Other,True,Al7B66.667Mg26.333,Al-B-Mg,3,Supercon,Mg0.79Al0.21B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/Al0.21B2Mg0.79-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/Al0.21B2Mg0.79-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
B5W2,3,0.0952380952380952,1.6,False,B8W3.2,B8W4,0.0,Other,True,B71.429W28.571,B-W,2,Supercon,B5W2,MP-mp-569803,B8W4,B-W,B66.667W33.333,P 63/m m c,hexagonal,3.0187600041630245,3.01875927,14.089487,data/final/MP/cifs/B5W2-MP-mp-569803-synth_doped.cif,data/source/MP/raw/cifs/mp-569803.cif,mp-569803,0.0,,2014-02-16 12:30:19,12.273198408160388,10.17188/1275270,"@misc{osti_1275270,
    author = ""Persson, Kristin"",
    title = ""Materials Data on B2W (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1275270"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695975'}},0.0,8.59981484,520.0,-109.26297388,-9.105247823333334,{'tags': ['Tungsten boride (1/2)']},-109.26297388,-9.105247823333334,-0.3329444861111111,"['xas', 'elasticity', 'bandstructure']",True,"[23716, 615700]",True,2021-05-12 10:56:22.739000,NM,12,10,mp-569803,,B2W,"{'functional': 'PBE', 'labels': ['B', 'W_pv'], 'pot_type': 'paw'}","{'B': 2.0, 'W': 1.0}",GGA,mp-569803,"['mp-929243', 'mp-930061', 'mp-912964', 'mp-569888', 'mp-569803', 'mp-1102126', 'mp-1437316', 'mp-1695975', 'mp-1805137', 'mp-1601096']",0.000812975,"{'B': 8.0, 'W': 4.0}",111.19438188986558,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.9245182577847333e-05,0.000812975,0,0.0032519,MP,data/source/MP/cleaned/cifs/MP-mp-569803.cif,True,,data/final/MP/graphs/B5W2-MP-mp-569803-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Al0.19B2Mg0.81,3,0.1266666666666666,1.0,True,Al0.19B2Mg0.81,B2Mg1,30.8,Other,True,Al6.333B66.667Mg27,Al-B-Mg,3,Supercon,Mg0.81Al0.19B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/Al0.19B2Mg0.81-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/Al0.19B2Mg0.81-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ir1Se2,1,0.0,8.0,False,Ir8Se16,Ir8Se16,0.0,Other,True,Ir33.333Se66.667,Ir-Se,2,Supercon,Ir1Se2,MP-mp-1361,Ir8Se16,Ir-Se,Ir33.333Se66.667,P n m a,orthorhombic,3.806903,6.021498,21.262684,data/final/MP/cifs/Ir1Se2-MP-mp-1361.cif,data/source/MP/raw/cifs/mp-1361.cif,mp-1361,0.0669000000000004,,2011-05-17 02:56:13,9.54295000044884,10.17188/1189687,"@misc{osti_1189687,
    author = ""Persson, Kristin"",
    title = ""Materials Data on IrSe2 (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189687"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1675203'}},0.0,5.68611147,520.0,-134.84739156,-5.6186413150000005,"{'tags': ['Iridium(IV) selenide', 'Iridium selenide (1/2)']}",-134.84739156,-5.6186413150000005,-0.6565568565624998,"['xas', 'elasticity', 'bandstructure']",True,"[16728, 640985, 654007, 80569]",True,2021-05-12 10:56:12.755000,NM,24,8,mp-1361,,IrSe2,"{'functional': 'PBE', 'labels': ['Ir', 'Se'], 'pot_type': 'paw'}","{'Ir': 1.0, 'Se': 2.0}",GGA,mp-1361,"['mp-909387', 'mp-925124', 'mp-924389', 'mp-1361', 'mp-1416474', 'mp-1675203', 'mp-1824484', 'mp-1637694']",7.175e-06,"{'Ir': 8.0, 'Se': 16.0}",487.4100081293755,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.177653290712983e-07,7.175e-06,0,5.74e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1361.cif,False,,data/final/MP/graphs/Ir1Se2-MP-mp-1361.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
As1F0.07Fe1Sm1O0.93,2,0.0349999999999999,2.0,False,As2F0.14Fe2Sm2O1.86,As2Fe2Sm2O2,33.0,Ferrite,True,As25F1.75Fe25Sm25O23.25,As-F-Fe-Sm-O,5,Supercon,Sm1Fe1As1F0.07O0.93,MP-mp-20349,Sm2Fe2As2O2,As-Fe-Sm-O,As25Fe25Sm25O25,P 4/n m m,tetragonal,4.026492,4.026492,9.046755,data/final/MP/cifs/As1F0.07Fe1Sm1O0.93-MP-mp-20349-synth_doped.cif,data/source/MP/raw/cifs/mp-20349.cif,mp-20349,0.0,,2014-02-19 11:24:42,6.727802583283198,,,{'GGA+U': {'task_id': 'mp-1695938'}},0.3015723809374986,3.77685593,520.0,-52.73407138,-6.5917589225,{'tags': ['Samarium iron arsenic oxide (1/1/1/1)']},-52.73407138,-6.5917589225,-1.6285904237499995,"['xas', 'elasticity', 'bandstructure']",True,"[236652, 236653, 422002, 163457, 163458]",True,2021-05-12 10:56:16.728000,FM,8,10,mp-20349,oxide,SmFeAsO,"{'functional': 'PBE', 'labels': ['Sm_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Sm': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-20349,"['mp-24944', 'mp-1078897', 'mp-1079866', 'mp-1173321', 'mp-20349', 'mp-1425472', 'mp-1695938', 'mp-1772503', 'mp-1789694', 'mp-1588381']",3.75729895,"{'Sm': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",146.67176231613362,[],FM,True,129,1,"[0.0, 0.0, 3.5, 3.5, -0.0, -0.0, -0.0, -0.0]",0.0512341147425717,3.75729895,2,7.5145979,MP,data/source/MP/cleaned/cifs/MP-mp-20349.cif,True,,data/final/MP/graphs/As1F0.07Fe1Sm1O0.93-MP-mp-20349-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Er1Ru2,1,0.0,4.0,False,Er4Ru8,Er4Ru8,0.0,Other,True,Er33.333Ru66.667,Er-Ru,2,Supercon,Er1Ru2,MP-mp-569220,Er4Ru8,Er-Ru,Er33.333Ru66.667,P 63/m m c,hexagonal,5.2563100012606,5.256310009999999,8.900365,data/final/MP/cifs/Er1Ru2-MP-mp-569220.cif,data/source/MP/raw/cifs/mp-569220.cif,mp-569220,0.0,,2014-12-22 16:22:30,11.521377675180371,10.17188/1274989,"@misc{osti_1274989,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ErRu2 (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1274989"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-977906'}},0.0,5.84311835,520.0,-96.81717011,-8.068097509166668,"{'tags': ['Erbium ruthenium (1/2)', 'Erbium ruthenium hydride (1/2/4)']}",-96.81717011,-8.068097509166668,-0.3625981358333341,[],False,"[630666, 150524, 631043, 631034, 631040, 631041]",True,2021-05-12 11:01:41.789000,NM,12,10,mp-569220,,ErRu2,"{'functional': 'PBE', 'labels': ['Er_3', 'Ru_pv'], 'pot_type': 'paw'}","{'Er': 1.0, 'Ru': 2.0}",GGA,mp-569220,"['mp-914497', 'mp-977906', 'mp-1102016', 'mp-1102608', 'mp-1102703', 'mp-1102951', 'mp-569220', 'mp-1244521', 'mp-1829280', 'mp-978156']",0.002023525,"{'Er': 4.0, 'Ru': 8.0}",212.96115376353904,[],NM,False,194,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",3.800740114785097e-05,0.002023525,0,0.0080941,MP,data/source/MP/cleaned/cifs/MP-mp-569220.cif,False,,data/final/MP/graphs/Er1Ru2-MP-mp-569220.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ca0.17Cu1Tm1.83O4,3,0.0485714285714285,2.0,False,Ca0.34Cu2Tm3.66O8,Cu2Tm4O8,30.0,Cuprate,True,Ca2.429Cu14.286Tm26.143O57.142857142857146,Ca-Cu-Tm-O,4,Supercon,Tm1.83Ca0.17Cu1O4,MP-mp-1100986,Tm4Cu2O8,Cu-Tm-O,Cu14.286Tm28.571O57.142857142857146,P 1 21/c 1,monoclinic,5.409843553237426,5.48364013,6.13602021,data/final/MP/cifs/Ca0.17Cu1Tm1.83O4-MP-mp-1100986-synth_doped.cif,data/source/MP/raw/cifs/mp-1100986.cif,mp-1100986,0.2054,,2018-07-15 12:43:08,8.988727038800237,,,,0.0336481182143,3.17438928,520.0,-104.41694245,-7.458353032142857,{'tags': []},-104.41694245,-7.458353032142857,-3.1591070983333327,[],False,[],True,2021-05-12 10:59:28.847000,AFM,14,2,mp-1100986,oxide,Tm2CuO4,"{'functional': 'PBE', 'labels': ['Tm_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Tm': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1100986,"['mp-1100986', 'mp-1833440']",0.0,"{'Tm': 4.0, 'Cu': 2.0, 'O': 8.0}",171.9564601170432,[],AFM,True,2,2,"[0.0, -0.0, -0.0, 0.0, 0.3, -0.3, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0,0.0,2,0.0,MP,data/source/MP/cleaned/cifs/MP-mp-1100986.cif,True,,data/final/MP/graphs/Ca0.17Cu1Tm1.83O4-MP-mp-1100986-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,1,0,0,0,1.0,False
Ce4Sb3,3,0.1428571428571428,0.25,False,Ce1Sb0.75,Ce1Sb1,0.0,Heavy_fermion,True,Ce57.143Sb42.857,Ce-Sb,2,Supercon,Ce4Sb3,MP-mp-387,Ce1Sb1,Ce-Sb,Ce50Sb50,F m -3 m,cubic,4.50445546,4.50445546,4.50445546,data/final/MP/cifs/Ce4Sb3-MP-mp-387-synth_doped.cif,data/source/MP/raw/cifs/mp-387.cif,mp-387,0.0,,2011-05-12 18:02:54,6.728726926954054,10.17188/1207554,"@misc{osti_1207554,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeSb (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207554"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1674324'}},0.0,6.8449331,520.0,-12.17884957,-6.089424785,"{'tags': ['Cerium antimony (1/1)', 'Cerium antimonide']}",-12.17884957,-6.089424785,-1.1543795875000002,"['xas', 'elasticity', 'bandstructure']",True,"[622097, 52012, 622094, 622102, 603005, 163722, 622093, 52902, 622087, 622092, 622084, 622080, 622095, 622098, 622101]",True,2021-05-12 10:56:20.740000,FM,2,9,mp-387,,CeSb,"{'functional': 'PBE', 'labels': ['Ce', 'Sb'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Sb': 1.0}",GGA,mp-387,"['mp-387', 'mp-1000480', 'mp-1006950', 'mp-1440992', 'mp-1674324', 'mp-1784316', 'mp-1011672', 'mp-1586309', 'mp-1588362']",0.9040693,"{'Ce': 1.0, 'Sb': 1.0}",64.62668693880121,[],FM,True,225,1,"[0.8, 0.0]",0.0139891017600223,0.9040693,1,0.9040693,MP,data/source/MP/cleaned/cifs/MP-mp-387.cif,True,,data/final/MP/graphs/Ce4Sb3-MP-mp-387-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Al1Nb2.94W0.06,2,0.03,2.0,False,Al2Nb5.88W0.12,Al2Nb6,17.2,Other,True,Al25Nb73.5W1.5,Al-Nb-W,3,Supercon,Nb2.94W0.06Al1,MP-mp-796,Nb6Al2,Al-Nb,Al25Nb75,P m -3 n,cubic,5.215254,5.215254,5.215254,data/final/MP/cifs/Al1Nb2.94W0.06-MP-mp-796-synth_doped.cif,data/source/MP/raw/cifs/mp-796.cif,mp-796,0.0,,2011-05-13 16:07:37,7.157298025966356,,,{'GGA': {'task_id': 'mp-1686893'}},0.0460773865000003,5.52947534,520.0,-69.48918494,-8.6861481175,"{'tags': ['Aluminium niobium (1/3)', 'Niobium aluminide (3/1)', 'Aluminum niobium (1/3)']}",-69.48918494,-8.6861481175,-0.1737753800000003,"['bandstructure', 'elasticity']",True,"[608675, 608654, 608688, 608668, 608669, 608685, 608676, 608683, 58014, 608657, 107856, 608655, 608666, 608691, 608656, 608665, 608673, 608653, 608661]",True,2021-05-12 10:56:31.128000,NM,8,10,mp-796,,Nb3Al,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Al': 1.0}",GGA,mp-796,"['mp-911586', 'mp-927906', 'mp-796', 'mp-927472', 'mp-1260512', 'mp-1440919', 'mp-1686893', 'mp-1927652', 'mp-1591599', 'mp-1587739']",0.16323955,"{'Nb': 6.0, 'Al': 2.0}",141.8490379078192,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0023015954483396,0.16323955,0,0.3264791,MP,data/source/MP/cleaned/cifs/MP-mp-796.cif,True,,data/final/MP/graphs/Al1Nb2.94W0.06-MP-mp-796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
S0.8Se1.2Ta1,3,0.1333333333333333,1.0,True,S0.8Se1.2Ta1,S1Se1Ta1,3.9,Chevrel,True,S26.667Se40Ta33.333,S-Se-Ta,3,Supercon,S0.8Se1.2Ta1,MP-mp-1217890,Ta1Se1S1,S-Se-Ta,S33.333Se33.333Ta33.333,P 3 m 1,trigonal,3.4333280014504988,3.43332777,6.39995,data/final/MP/cifs/S0.8Se1.2Ta1-MP-mp-1217890-synth_doped.cif,data/source/MP/raw/cifs/mp-1217890.cif,mp-1217890,0.0,,2019-01-12 19:09:04.956000,7.420853309436702,,,{'GGA': {'task_id': 'mp-1712748'}},0.0335588799999992,4.5864584,520.0,-22.18986267,-7.39662089,{'tags': []},-22.18986267,-7.39662089,-1.2249078984895845,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,3,5,mp-1217890,,TaSeS,"{'functional': 'PBE', 'labels': ['Ta_pv', 'Se', 'S'], 'pot_type': 'paw'}","{'Ta': 1.0, 'Se': 1.0, 'S': 1.0}",GGA,mp-1217890,"['mp-1217890', 'mp-1426851', 'mp-1712748', 'mp-1784093', 'mp-1610869']",0.0149374,"{'Ta': 1.0, 'Se': 1.0, 'S': 1.0}",65.333776778902,[],NM,False,156,0,"[0, 0, 0]",0.0002286321216443,0.0149374,0,0.0149374,MP,data/source/MP/cleaned/cifs/MP-mp-1217890.cif,True,,data/final/MP/graphs/S0.8Se1.2Ta1-MP-mp-1217890-synth_doped.json,0,True,3m,0,0,0,0,0,0,5,1,0,0,0,1.0,False
Al1.1Ca1Si0.9,3,0.0666666666666667,1.0,True,Al1.1Ca1Si0.9,Al1Ca1Si1,6.63,Other,True,Al36.667Ca33.333Si30,Al-Ca-Si,3,Supercon,Ca1Al1.1Si0.9,MP-mp-3173,Ca1Al1Si1,Al-Ca-Si,Al33.333Ca33.333Si33.333,P -6 m 2,hexagonal,4.204102004380959,4.20410189,4.381114,data/final/MP/cifs/Al1.1Ca1Si0.9-MP-mp-3173-synth_doped.cif,data/source/MP/raw/cifs/mp-3173.cif,mp-3173,0.0,,2011-05-12 18:07:21,2.3559907742364445,10.17188/1205871,"@misc{osti_1205871,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CaAlSi (SG:187) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1205871"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688380'}},0.0042011372222221,5.20030027,520.0,-12.33105355,-4.110351183333333,"{'tags': ['Calcium aluminium silicide (1/1/1) - 1H', 'Calcium aluminium silicide (1/1/1) - (SrPtSb)-type']}",-12.33105355,-4.110351183333333,-0.36118794,"['xas', 'elasticity', 'bandstructure']",True,"[162864, 155853]",True,2021-05-12 10:56:20.740000,NM,3,12,mp-3173,,CaAlSi,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Al', 'Si'], 'pot_type': 'paw'}","{'Ca': 1.0, 'Al': 1.0, 'Si': 1.0}",GGA,mp-3173,"['mp-3173', 'mp-1000446', 'mp-1006914', 'mp-1170858', 'mp-1252945', 'mp-1258722', 'mp-1259938', 'mp-1439603', 'mp-1688380', 'mp-1781727', 'mp-1011629', 'mp-1597142']",0.0033294,"{'Ca': 1.0, 'Al': 1.0, 'Si': 1.0}",67.05970809230726,[],NM,False,187,0,"[0, 0, 0]",4.964829246523266e-05,0.0033294,0,0.0033294,MP,data/source/MP/cleaned/cifs/MP-mp-3173.cif,True,,data/final/MP/graphs/Al1.1Ca1Si0.9-MP-mp-3173-synth_doped.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Pt2Y8,1,0.0,1.0,True,Pt2Y8,Pt2Y8,0.9,Other,True,Pt20Y80,Pt-Y,2,Supercon,Pt2Y8,MP-mp-1207762,Y8Pt2,Pt-Y,Pt20Y80,F d -3 m,cubic,7.82852342,7.828523419999999,7.828523419999999,data/final/MP/cifs/Pt2Y8-MP-mp-1207762.cif,data/source/MP/raw/cifs/mp-1207762.cif,mp-1207762,0.0,,2019-01-12 10:48:30.309000,5.391075785688583,,,,0.5311332571666654,2.72435494,520.0,-64.20256652,-6.420256652000001,"{'tags': ['MgCu2', 'Friauf-Laves phase, Frank-Kasper phase', 'YPt2']}",-64.20256652,-6.420256652000001,-0.0328982193333338,[],False,[],True,2021-05-12 11:00:19.396000,NM,10,2,mp-1207762,,Y4Pt,"{'functional': 'PBE', 'labels': ['Y_sv', 'Pt'], 'pot_type': 'paw'}","{'Y': 4.0, 'Pt': 1.0}",GGA,mp-1207762,"['mp-1207762', 'mp-1836132']",0.1147019,"{'Y': 8.0, 'Pt': 2.0}",339.2536808305732,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.000676201358931,0.1147019,0,0.2294038,MP,data/source/MP/cleaned/cifs/MP-mp-1207762.cif,False,,data/final/MP/graphs/Pt2Y8-MP-mp-1207762.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
V0.7Zr0.3,3,0.0666666666666666,6.0,False,V4.2Zr1.8,V4Zr2,8.6,Other,True,V70Zr30,V-Zr,2,Supercon,V0.7Zr0.3,MP-mp-258,Zr2V4,V-Zr,V66.667Zr33.333,F d -3 m,cubic,5.20454208,5.20454208,5.20454208,data/final/MP/cifs/V0.7Zr0.3-MP-mp-258-synth_doped.cif,data/source/MP/raw/cifs/mp-258.cif,mp-258,0.0,,2011-05-13 13:06:32,6.4334589517749015,10.17188/1201055,"@misc{osti_1201055,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrV2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201055"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686904'}},0.0488598200000005,4.89596571,520.0,-53.13786662,-8.856311103333333,"{'tags': ['Zirconium vanadium (1/2)', 'Vanadium zirconium deuteride (2/1/5)', 'Vanadium zirconium hydride (2/1/5)', 'Vanadium zirconium deuteride (2/1/4)', 'Vanadium zirconium (2/1)', 'High pressure experimental phase', 'Vanadium zirconium hydride (2/1/4)']}",-53.13786662,-8.856311103333333,0.0488598199999993,"['xas', 'elasticity', 'bandstructure']",True,"[183002, 653420, 638530, 167450, 187954, 106215, 183001, 653413, 183003, 653426, 653428, 638531, 653418, 638533, 653407, 653406, 638534, 653415, 653417, 653408, 653427, 106214, 656648, 638532, 653410, 653409, 653405, 653411]",True,2021-05-12 10:56:18.721000,NM,6,34,mp-258,,ZrV2,"{'functional': 'PBE', 'labels': ['Zr_sv', 'V_pv'], 'pot_type': 'paw'}","{'Zr': 1.0, 'V': 2.0}",GGA,mp-258,"['mp-930966', 'mp-930609', 'mp-913794', 'mp-258', 'mp-1071784', 'mp-1071714', 'mp-1071952', 'mp-1071810', 'mp-1072028', 'mp-1072052', 'mp-1072339', 'mp-1072434', 'mp-1072432', 'mp-1072450', 'mp-1072519', 'mp-1072536', 'mp-1072714', 'mp-1072786', 'mp-1072809', 'mp-1077011', 'mp-1076995', 'mp-1077180', 'mp-1077357', 'mp-1077570', 'mp-1440605', 'mp-1686904', 'mp-1928517', 'mp-1591452', 'mp-1596888', 'mp-1071821', 'mp-1072464', 'mp-1072551', 'mp-1072818', 'mp-1072068']",0.0235113,"{'Zr': 2.0, 'V': 4.0}",99.68563410059843,[],NM,False,227,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0004717088919005,0.0235113,0,0.0470226,MP,data/source/MP/cleaned/cifs/MP-mp-258.cif,True,,data/final/MP/graphs/V0.7Zr0.3-MP-mp-258-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Cu0.03Ru0.97Sr2Y1O6,2,0.006,2.0,False,Cu0.06Ru1.94Sr4Y2O12,Ru2Sr4Y2O12,0.0,Cuprate,True,Cu0.3Ru9.7Sr20Y10O60,Cu-Ru-Sr-Y-O,5,Supercon,Sr2Y1Ru0.97Cu0.03O6,MP-mp-14430,Sr4Y2Ru2O12,Ru-Sr-Y-O,Ru10Sr20Y10O60,P 1 21/c 1,monoclinic,5.816658,5.885394,8.254861792272742,data/final/MP/cifs/Cu0.03Ru0.97Sr2Y1O6-MP-mp-14430-synth_doped.cif,data/source/MP/raw/cifs/mp-14430.cif,mp-14430,0.0,,2011-06-07 07:34:15,5.420400820723878,10.17188/1190674,"@misc{osti_1190674,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr2YRuO6 (SG:14) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1190674"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1669873'}},0.0,3.25749146,520.0,-146.31379286,-7.315689643000001,"{'tags': ['Distrontium yttrium ruthenium(V) oxide', 'Distrontium yttrium ruthenium hexaoxide']}",-146.31379286,-7.315689643000001,-2.847128272500001,"['xas', 'bandstructure']",True,"[192766, 49500]",True,2021-05-12 10:56:53.126000,FM,20,10,mp-14430,oxide,Sr2YRuO6,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Y_sv', 'Ru_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Y': 1.0, 'Ru': 1.0, 'O': 6.0}",GGA,mp-14430,"['mp-923119', 'mp-922143', 'mp-917338', 'mp-14430', 'mp-1106028', 'mp-1236895', 'mp-1431640', 'mp-1669873', 'mp-1931083', 'mp-1608013']",2.9996044,"{'Sr': 4.0, 'Y': 2.0, 'Ru': 2.0, 'O': 12.0}",282.584622226224,[],FM,True,14,1,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 2.0, 2.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0212297780138839,2.9996044,2,5.9992088,MP,data/source/MP/cleaned/cifs/MP-mp-14430.cif,True,,data/final/MP/graphs/Cu0.03Ru0.97Sr2Y1O6-MP-mp-14430-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,1,0,0,0,1.0,False
B2Eu1Rh3,1,0.0,1.0,True,B2Eu1Rh3,B2Eu1Rh3,0.0,Other,True,B33.333Eu16.667Rh50,B-Eu-Rh,3,Supercon,Eu1Rh3B2,MP-mp-21127,Eu1B2Rh3,B-Eu-Rh,B33.333Eu16.667Rh50,P 6/m m m,hexagonal,2.964209,5.671106001708141,5.67110612,data/final/MP/cifs/B2Eu1Rh3-MP-mp-21127.cif,data/source/MP/raw/cifs/mp-21127.cif,mp-21127,0.0,,2014-02-21 14:36:45,9.70048873128566,10.17188/1196399,"@misc{osti_1196399,
    author = ""Persson, Kristin"",
    title = ""Materials Data on EuB2Rh3 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196399"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698881'}},0.0,6.26740372,520.0,-49.37192574,-8.22865429,{'tags': ['Europium rhodium boride (1/3/2)']},-49.37192574,-8.22865429,-0.6046958522222224,"['xas', 'bandstructure']",True,"[613864, 44243]",True,2021-05-12 10:56:57.051000,FM,6,5,mp-21127,,EuB2Rh3,"{'functional': 'PBE', 'labels': ['Eu', 'B', 'Rh_pv'], 'pot_type': 'paw'}","{'Eu': 1.0, 'B': 2.0, 'Rh': 3.0}",GGA,mp-21127,"['mp-21127', 'mp-1476126', 'mp-1698881', 'mp-1798420', 'mp-1590330']",6.8900316,"{'Eu': 1.0, 'B': 2.0, 'Rh': 3.0}",82.56100958974064,[],FM,True,191,1,"[6.8, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0834538195964137,6.8900316,1,6.8900316,MP,data/source/MP/cleaned/cifs/MP-mp-21127.cif,False,,data/final/MP/graphs/B2Eu1Rh3-MP-mp-21127.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
B2Mg0.98Pb0.02,2,0.0133333333333333,1.0,True,B2Mg0.98Pb0.02,B2Mg1,35.5,Other,True,B66.667Mg32.667Pb0.667,B-Mg-Pb,3,Supercon,Mg0.98Pb0.02B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B2Mg0.98Pb0.02-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B2Mg0.98Pb0.02-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
C2Cl2Y2,1,0.0,1.0,True,C2Cl2Y2,C2Cl2Y2,2.3,Other,True,C33.333Cl33.333Y33.333,C-Cl-Y,3,Supercon,Y2Cl2C2,MP-mp-1206889,Y2C2Cl2,C-Cl-Y,C33.333Cl33.333Y33.333,C 1 2/m 1,monoclinic,3.7758959996084736,3.9291662,9.62221594,data/final/MP/cifs/C2Cl2Y2-MP-mp-1206889.cif,data/source/MP/raw/cifs/mp-1206889.cif,mp-1206889,0.0,,2019-01-12 10:06:32.284000,3.635461491542189,,,{'GGA': {'task_id': 'mp-1758051'}},0.0,3.79649973,520.0,-42.5160616,-7.086010266666666,"{'tags': ['GdCBr-a', 'YCCl']}",-42.5160616,-7.086010266666666,-1.443414108888889,['bandstructure'],True,[],True,2021-05-12 10:58:39.488000,NM,6,5,mp-1206889,,YCCl,"{'functional': 'PBE', 'labels': ['Y_sv', 'C', 'Cl'], 'pot_type': 'paw'}","{'Y': 1.0, 'C': 1.0, 'Cl': 1.0}",GGA,mp-1206889,"['mp-1206889', 'mp-1388964', 'mp-1758051', 'mp-1787588', 'mp-1624415']",0.00031225,"{'Y': 2.0, 'C': 2.0, 'Cl': 2.0}",124.57673711933698,[],NM,False,12,0,"[0, 0, 0, 0, 0, 0]",5.012974448044555e-06,0.00031225,0,0.0006245,MP,data/source/MP/cleaned/cifs/MP-mp-1206889.cif,False,,data/final/MP/graphs/C2Cl2Y2-MP-mp-1206889.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
Ba2Co1Cu2Eu1O7.31,2,0.0214991619950297,0.9577184678522572,True,Ba1.915Co0.958Cu1.915Eu0.958O7,Ba2Co1Cu2Eu1O7,0.0,Cuprate,True,Ba15.026Co7.513Cu15.026Eu7.513O54.92111194590534,Ba-Co-Cu-Eu-O,5,Supercon,Eu1Ba2Cu2Co1O7.31,MP-mp-1214711,Ba2Eu1Co1Cu2O7,Ba-Co-Cu-Eu-O,Ba15.385Co7.692Cu15.385Eu7.692O53.84615384615385,P m m m,orthorhombic,3.901791,3.927605,11.985016,data/final/MP/cifs/Ba2Co1Cu2Eu1O7.31-MP-mp-1214711-synth_doped.cif,data/source/MP/raw/cifs/mp-1214711.cif,mp-1214711,0.0,,2019-01-12 16:30:30.966000,6.551494389849945,,,{'GGA+U': {'task_id': 'mp-1742590'}},0.0361571532692215,2.95093856,520.0,-84.67312685,-6.513317450000001,"{'tags': ['Ba2Cu2EuCoO7', 'high-Tc cuprate family', 'Ba2Cu2(Cu0.89Al0.11)YO7']}",-84.67312685,-6.513317450000001,-2.0805910419230766,[],False,[],True,2021-05-12 11:00:37.845000,FiM,13,4,mp-1214711,oxide,Ba2EuCoCu2O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Eu', 'Co', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Eu': 1.0, 'Co': 1.0, 'Cu': 2.0, 'O': 7.0}",GGA+U,mp-1214711,"['mp-1214711', 'mp-1402850', 'mp-1742590', 'mp-1788389']",8.5329526,"{'Ba': 2.0, 'Eu': 1.0, 'Co': 1.0, 'Cu': 2.0, 'O': 7.0}",183.6667008741531,[],FiM,True,47,3,"[0.0, 0.0, 6.3, 2.2, -0.1, -0.1, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0464588984251789,8.5329526,4,8.5329526,MP,data/source/MP/cleaned/cifs/MP-mp-1214711.cif,True,,data/final/MP/graphs/Ba2Co1Cu2Eu1O7.31-MP-mp-1214711-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Au5Cd8,1,0.0,2.0,False,Au10Cd16,Au10Cd16,0.0,Other,True,Au38.462Cd61.538,Au-Cd,2,Supercon,Au5Cd8,MP-mp-1193415,Cd16Au10,Au-Cd,Au38.462Cd61.538,I -4 3 m,cubic,8.792437231949148,8.792437230000003,8.79243723,data/final/MP/cifs/Au5Cd8-MP-mp-1193415.cif,data/source/MP/raw/cifs/mp-1193415.cif,mp-1193415,0.0,,2019-01-11 23:13:39.996000,11.95864321942915,,,{'GGA': {'task_id': 'mp-1731399'}},0.0193960838461535,3.42439393,520.0,-51.34790867,-1.9749195642307693,"{'tags': ['Gold cadmide (5/8)', 'Cu5Zn8', 'γ-brass', 'Au5Cd8 ht2', 'Au5Cd8 ht3']}",-51.34790867,-1.9749195642307693,-0.1478021965384617,['bandstructure'],True,[611679],True,2021-05-12 10:58:35.561000,NM,26,5,mp-1193415,,Cd8Au5,"{'functional': 'PBE', 'labels': ['Cd', 'Au'], 'pot_type': 'paw'}","{'Cd': 8.0, 'Au': 5.0}",GGA,mp-1193415,"['mp-1193415', 'mp-1406489', 'mp-1731399', 'mp-1825303', 'mp-1626117']",9.25e-06,"{'Cd': 16.0, 'Au': 10.0}",523.246025809147,[],NM,False,217,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.535621693713129e-08,9.25e-06,0,1.85e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1193415.cif,False,,data/final/MP/graphs/Au5Cd8-MP-mp-1193415.json,0,True,-43m,5,0,0,0,0,0,0,0,0,1,0,1.0,False
Nb1P1Se1,1,0.0,2.0,False,Nb2P2Se2,Nb2P2Se2,0.0,Other,True,Nb33.333P33.333Se33.333,Nb-P-Se,3,Supercon,Nb1P1Se1,MP-mp-7524,Nb2P2Se2,Nb-P-Se,Nb33.333P33.333Se33.333,I m m m,orthorhombic,3.47929000037504,4.860446000598675,6.97321847,data/final/MP/cifs/Nb1P1Se1-MP-mp-7524.cif,data/source/MP/raw/cifs/mp-7524.cif,mp-7524,0.0,,2011-05-28 02:18:55,6.322763655336428,10.17188/1288531,"@misc{osti_1288531,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbPSe (SG:71) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1288531"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701507'}},0.0605963212499993,6.9226405,520.0,-42.20850907,-7.034751511666666,{'tags': ['Niobium phosphide selenide']},-42.20850907,-7.034751511666666,-0.8552451702256944,"['bandstructure', 'elasticity']",True,[16076],True,2021-05-12 10:56:29.056000,NM,6,8,mp-7524,,NbPSe,"{'functional': 'PBE', 'labels': ['Nb_pv', 'P', 'Se'], 'pot_type': 'paw'}","{'Nb': 1.0, 'P': 1.0, 'Se': 1.0}",GGA,mp-7524,"['mp-923953', 'mp-909051', 'mp-7524', 'mp-924567', 'mp-1423153', 'mp-1701507', 'mp-1782184', 'mp-1595825']",0.0003939,"{'Nb': 2.0, 'P': 2.0, 'Se': 2.0}",106.5432770941584,[],NM,False,71,0,"[0, 0, 0, 0, 0, 0]",7.3941784173184e-06,0.0003939,0,0.0007878,MP,data/source/MP/cleaned/cifs/MP-mp-7524.cif,False,,data/final/MP/graphs/Nb1P1Se1-MP-mp-7524.json,0,True,mmm,0,0,0,7,0,0,0,0,0,1,0,1.0,False
N5Nb4,3,0.1111111111111111,0.2,False,N1Nb0.8,N1Nb1,8.5,Other,True,N55.556Nb44.444,N-Nb,2,Supercon,N5Nb4,MP-mp-2634,Nb1N1,N-Nb,N50Nb50,P -6 m 2,hexagonal,2.898656,2.9761920047347994,2.97619211,data/final/MP/cifs/N5Nb4-MP-mp-2634-synth_doped.cif,data/source/MP/raw/cifs/mp-2634.cif,mp-2634,0.0,,2011-05-12 17:49:04,7.984187332554685,10.17188/1201157,"@misc{osti_1201157,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbN (SG:187) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201157"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671304'}},0.0,7.12357548,520.0,-20.57319827,-10.286599135,"{'tags': ['Niobium nitride (1/1)', 'Niobium nitride', 'Niobium nitride (1/1) - gamma']}",-20.57319827,-10.286599135,-1.2481991524999998,"['xas', 'elasticity', 'bandstructure']",True,"[185569, 644536, 76385, 191062]",True,2021-05-12 10:56:18.721000,NM,2,17,mp-2634,,NbN,"{'functional': 'PBE', 'labels': ['Nb_pv', 'N'], 'pot_type': 'paw'}","{'Nb': 1.0, 'N': 1.0}",GGA,mp-2634,"['mp-926732', 'mp-910421', 'mp-926222', 'mp-2634', 'mp-1058402', 'mp-1058440', 'mp-1058487', 'mp-1061535', 'mp-1061589', 'mp-1061648', 'mp-1116126', 'mp-1442283', 'mp-1671304', 'mp-1924826', 'mp-1594881', 'mp-1061618', 'mp-1058457']",0.0002504,"{'Nb': 1.0, 'N': 1.0}",22.23561881453577,[],NM,False,187,0,"[0, 0]",1.1261211216496917e-05,0.0002504,0,0.0002504,MP,data/source/MP/cleaned/cifs/MP-mp-2634.cif,True,,data/final/MP/graphs/N5Nb4-MP-mp-2634-synth_doped.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Ce3Ge13Ru4,1,0.0,2.0,False,Ce6Ge26Ru8,Ce6Ge26Ru8,0.0,Heavy_fermion,True,Ce15Ge65Ru20,Ce-Ge-Ru,3,Supercon,Ce3Ru4Ge13,MP-mp-1204084,Ce6Ge26Ru8,Ce-Ge-Ru,Ce15Ge65Ru20,P m -3 n,cubic,9.088571,9.088571,9.088571,data/final/MP/cifs/Ce3Ge13Ru4-MP-mp-1204084.cif,data/source/MP/raw/cifs/mp-1204084.cif,mp-1204084,0.0,,2019-01-12 07:49:19.601000,7.825414430476159,,,{'GGA': {'task_id': 'mp-1681414'}},0.0369381024374968,7.37483969,520.0,-248.36046565,-6.20901164125,"{'tags': ['Cerium ruthenium germanide (3/4/13)', 'LaRuSn3', 'CeRuGe3']}",-248.36046565,-6.20901164125,-0.4592022312499999,[],False,[621269],True,2021-05-12 11:00:14.977000,FM,40,4,mp-1204084,,Ce3Ge13Ru4,"{'functional': 'PBE', 'labels': ['Ce', 'Ge_d', 'Ru_pv'], 'pot_type': 'paw'}","{'Ce': 3.0, 'Ge': 13.0, 'Ru': 4.0}",GGA,mp-1204084,"['mp-1204084', 'mp-1372992', 'mp-1681414', 'mp-1910178']",1.0686192,"{'Ce': 6.0, 'Ge': 26.0, 'Ru': 8.0}",750.73525801884,[],FM,True,223,1,"[0.3, 0.3, 0.3, 0.3, 0.3, 0.3, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0028468602975169,1.0686192,6,2.1372384,MP,data/source/MP/cleaned/cifs/MP-mp-1204084.cif,False,,data/final/MP/graphs/Ce3Ge13Ru4-MP-mp-1204084.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Cu4Yb1O8,1,0.0,1.0,True,Ba2Cu4Yb1O8,Ba2Cu4Yb1O8,78.8,Cuprate,True,Ba13.333Cu26.667Yb6.667O53.333333333333336,Ba-Cu-Yb-O,4,Supercon,Yb1Ba2Cu4O8,MP-mp-15039,Ba2Yb1Cu4O8,Ba-Cu-Yb-O,Ba13.333Cu26.667Yb6.667O53.333333333333336,C m m m,orthorhombic,3.8323699978883337,3.864227,14.07800749,data/final/MP/cifs/Ba2Cu4Yb1O8-MP-mp-15039.cif,data/source/MP/raw/cifs/mp-15039.cif,mp-15039,0.0,,2011-06-05 16:29:12,6.671911625695413,10.17188/1191000,"@misc{osti_1191000,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YbBa2(CuO2)4 (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191000"",
    place = ""United States"",
    year = ""2015"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1708113'}},0.0,2.57482917,520.0,-84.80896532,-5.653931021333333,{'tags': []},-84.80896532,-5.653931021333333,-1.929793377333333,"['xas', 'bandstructure']",True,[78621],True,2021-05-12 10:56:53.126000,NM,15,8,mp-15039,oxide,Ba2Yb(CuO2)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Yb_2', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Yb': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-15039,"['mp-937238', 'mp-931809', 'mp-916540', 'mp-15039', 'mp-1424980', 'mp-1708113', 'mp-1789741', 'mp-1600170']",0.0006418,"{'Ba': 2.0, 'Yb': 1.0, 'Cu': 4.0, 'O': 8.0}",206.54303387610025,[],NM,False,65,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.107342755432744e-06,0.0006418,0,0.0006418,MP,data/source/MP/cleaned/cifs/MP-mp-15039.cif,False,,data/final/MP/graphs/Ba2Cu4Yb1O8-MP-mp-15039.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Cu1Y1O2.55,3,0.0791208791208791,1.0,True,Cu1Y1O2.55,Cu1Y1O3,0.0,Cuprate,True,Cu21.978Y21.978O56.043956043956044,Cu-Y-O,3,Supercon,Y1Cu1O2.55,MP-mvc-11697,Y1Cu1O3,Cu-Y-O,Cu20Y20O60,P m -3 m,cubic,3.782154,3.782154,3.782154,data/final/MP/cifs/Cu1Y1O2.55-MP-mvc-11697-synth_doped.cif,data/source/MP/raw/cifs/mvc-11697.cif,mvc-11697,0.0,,2014-02-03 16:44:08,6.15230194191815,10.17188/1318302,"@misc{osti_1318302,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YCuO3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1318302"",
    place = ""United States"",
    year = ""2014"",
    month = ""9"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1767057'}},0.2224574458068184,5.28242166,520.0,-34.43613767,-6.887227534,{'tags': []},-34.43613767,-6.887227534,-2.217515374333334,"['bandstructure', 'elasticity']",True,[],True,2021-05-12 10:56:37.246000,NM,5,5,mvc-11697,oxide,YCuO3,"{'functional': 'PBE', 'labels': ['Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Y': 1.0, 'Cu': 1.0, 'O': 3.0}",GGA,mvc-11697,"['mvc-11697', 'mp-1432347', 'mp-1767057', 'mp-1792243', 'mp-1615717']",0.0007474,"{'Y': 1.0, 'Cu': 1.0, 'O': 3.0}",54.10253626517338,[],NM,False,221,0,"[0, 0, 0, 0, 0]",1.3814509477647404e-05,0.0007474,0,0.0007474,MP,data/source/MP/cleaned/cifs/MP-mvc-11697.cif,True,,data/final/MP/graphs/Cu1Y1O2.55-MP-mvc-11697-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Fe3Sc2Si5,1,0.0,4.0,False,Fe12Sc8Si20,Fe12Sc8Si20,4.57,Other,True,Fe30Sc20Si50,Fe-Sc-Si,3,Supercon,Sc2Fe3Si5,MP-mp-21588,Sc8Fe12Si20,Fe-Sc-Si,Fe30Sc20Si50,P 4/m n c,tetragonal,5.280587,10.168727,10.168727,data/final/MP/cifs/Fe3Sc2Si5-MP-mp-21588.cif,data/source/MP/raw/cifs/mp-21588.cif,mp-21588,0.0,,2014-02-19 15:41:57,4.839936061363307,10.17188/1197016,"@misc{osti_1197016,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sc2Fe3Si5 (SG:128) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197016"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1739387'}},0.0,7.98681162,520.0,-288.42210053,-7.210552513250001,"{'tags': ['Yttrium iron silicide (2/3/5)', 'Iron scandium silicide (3/2/5)', 'Scandium iron silicide (2/3/5)']}",-288.42210053,-7.210552513250001,-0.6548991472500006,"['xas', 'bandstructure']",True,"[41834, 633446, 633453, 633447, 247834]",True,2021-05-12 10:56:59.077000,NM,40,12,mp-21588,,Sc2Fe3Si5,"{'functional': 'PBE', 'labels': ['Sc_sv', 'Fe_pv', 'Si'], 'pot_type': 'paw'}","{'Sc': 2.0, 'Fe': 3.0, 'Si': 5.0}",GGA,mp-21588,"['mp-942431', 'mp-942811', 'mp-920961', 'mp-21588', 'mp-1143380', 'mp-1201172', 'mp-1204688', 'mp-1204823', 'mp-1204875', 'mp-1410477', 'mp-1739387', 'mp-1930429']",0.0033316,"{'Sc': 8.0, 'Fe': 12.0, 'Si': 20.0}",546.0285840329591,[],NM,False,128,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",2.440604830899402e-05,0.0033316,0,0.0133264,MP,data/source/MP/cleaned/cifs/MP-mp-21588.cif,False,,data/final/MP/graphs/Fe3Sc2Si5-MP-mp-21588.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ru0.46V0.54,3,0.08,2.0,False,Ru0.92V1.08,Ru1V1,5.16,Other,True,Ru46V54,Ru-V,2,Supercon,Ru0.46V0.54,MP-mp-1395,V1Ru1,Ru-V,Ru50V50,P m -3 m,cubic,3.014694,3.014694,3.014694,data/final/MP/cifs/Ru0.46V0.54-MP-mp-1395-synth_doped.cif,data/source/MP/raw/cifs/mp-1395.cif,mp-1395,0.0,,2011-05-12 19:37:14,9.21288886283982,10.17188/1189837,"@misc{osti_1189837,
    author = ""Persson, Kristin"",
    title = ""Materials Data on VRu (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189837"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688485'}},0.0,7.72767567,520.0,-18.82570789,-9.412853945,"{'tags': ['Ruthenium vanadium (1/1)', 'Ruthenium vanadium (1/1) - HT']}",-18.82570789,-9.412853945,-0.2337060825000012,"['xas', 'elasticity', 'bandstructure']",True,"[106010, 106011]",True,2021-05-12 10:56:12.755000,FiM,2,17,mp-1395,,VRu,"{'functional': 'PBE', 'labels': ['V_pv', 'Ru_pv'], 'pot_type': 'paw'}","{'V': 1.0, 'Ru': 1.0}",GGA,mp-1395,"['mp-991544', 'mp-993492', 'mp-2829', 'mp-1395', 'mp-1059722', 'mp-1059669', 'mp-1059766', 'mp-1059703', 'mp-1059619', 'mp-1059801', 'mp-1442257', 'mp-1688485', 'mp-1792970', 'mp-994797', 'mp-1591529', 'mp-1059798', 'mp-1059699']",0.647887,"{'V': 1.0, 'Ru': 1.0}",27.39868439535897,[],FiM,True,221,2,"[0.7, -0.1]",0.023646646337141,0.647887,2,0.647887,MP,data/source/MP/cleaned/cifs/MP-mp-1395.cif,True,,data/final/MP/graphs/Ru0.46V0.54-MP-mp-1395-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Re1O2,1,0.0,4.0,False,Re4O8,Re4O8,0.0,Oxide,True,Re33.333O66.66666666666667,Re-O,2,Supercon,O2Re1,MP-mp-7228,Re4O8,Re-O,Re33.333O66.66666666666667,P b c n,orthorhombic,4.629759,4.886105,5.700275,data/final/MP/cifs/Re1O2-MP-mp-7228.cif,data/source/MP/raw/cifs/mp-7228.cif,mp-7228,0.0,,2011-06-01 11:22:22,11.239795013626262,10.17188/1287512,"@misc{osti_1287512,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ReO2 (SG:60) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1287512"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700087'}},0.0016992347222224,5.72272875,520.0,-106.62285407,-8.885237839166667,"{'tags': ['Rhenium(IV) oxide', 'Rhenium dioxide']}",-106.62285407,-8.885237839166667,-1.8964214408333333,"['bandstructure', 'elasticity']",True,"[24060, 647362]",True,2021-05-12 10:56:29.056000,NM,12,9,mp-7228,oxide,ReO2,"{'functional': 'PBE', 'labels': ['Re_pv', 'O'], 'pot_type': 'paw'}","{'Re': 1.0, 'O': 2.0}",GGA,mp-7228,"['mp-943353', 'mp-933141', 'mp-942675', 'mp-7228', 'mp-1103018', 'mp-1414950', 'mp-1700087', 'mp-1787586', 'mp-1600816']",0.000168825,"{'Re': 4.0, 'O': 8.0}",128.94870592192615,[],NM,False,60,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.236966087964234e-06,0.000168825,0,0.0006753,MP,data/source/MP/cleaned/cifs/MP-mp-7228.cif,False,,data/final/MP/graphs/Re1O2-MP-mp-7228.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Fe0.03La1Ru2.97Si2,2,0.0099999999999999,1.0,True,Fe0.03La1Ru2.97Si2,La1Ru3Si2,6.22,Other,True,Fe0.5La16.667Ru49.5Si33.333,Fe-La-Ru-Si,4,Supercon,La1Ru2.97Fe0.03Si2,MP-mp-29240,La2Si4Ru6,La-Ru-Si,La16.667Ru50Si33.333,P 6/m m m,hexagonal,3.6088705,5.693851997310984,5.69385245,data/final/MP/cifs/Fe0.03La1Ru2.97Si2-MP-mp-29240-synth_doped.cif,data/source/MP/raw/cifs/mp-29240.cif,mp-29240,0.0,,2014-02-24 11:42:03,8.166084465628895,10.17188/1203620,"@misc{osti_1203620,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaSi2Ru3 (SG:193) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1203620"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1719509'}},0.0844490616666675,8.56766587,520.0,-95.13702135,-7.9280851125,{'tags': []},-95.13702135,-7.9280851125,-0.6361177608333328,"['xas', 'bandstructure']",True,[],True,2021-05-12 10:57:03.017000,NM,12,10,mp-29240,,LaSi2Ru3,"{'functional': 'PBE', 'labels': ['La', 'Si', 'Ru_pv'], 'pot_type': 'paw'}","{'La': 1.0, 'Si': 2.0, 'Ru': 3.0}",GGA,mp-29240,"['mp-925171', 'mp-924493', 'mp-909454', 'mp-29240', 'mp-1172476', 'mp-1254946', 'mp-1406081', 'mp-1719509', 'mp-1834844', 'mp-1618500']",0.00014945,"{'La': 2.0, 'Si': 4.0, 'Ru': 6.0}",202.6489324904347,[],NM,False,38,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, 0.0, 0.0, 0.0, -0.0]",1.4749645918520125e-06,0.00014945,0,0.0002989,MP,data/source/MP/cleaned/cifs/MP-mp-29240.cif,True,,data/final/MP/graphs/Fe0.03La1Ru2.97Si2-MP-mp-29240-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Cu1Sr1O2,1,0.0,2.0,False,Cu2Sr2O4,Cu2Sr2O4,0.0,Cuprate,True,Cu25Sr25O50,Cu-Sr-O,3,Supercon,SrCu1O2,MP-mp-5787,Sr2Cu2O4,Cu-Sr-O,Cu25Sr25O50,C m c m,orthorhombic,3.644437999912225,3.974263,8.32909336,data/final/MP/cifs/Cu1Sr1O2-MP-mp-5787.cif,data/source/MP/raw/cifs/mp-5787.cif,mp-5787,0.0,,2011-05-13 22:43:08,5.167573150857569,10.17188/1276630,"@misc{osti_1276630,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SrCuO2 (SG:63) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1276630"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703560'}},0.0,3.45760864,520.0,-45.24374469,-5.65546808625,"{'tags': ['Strontium cuprate', 'Strontium copper oxide']}",-45.24374469,-5.65546808625,-2.0778125529166664,"['xas', 'elasticity', 'bandstructure']",True,"[77291, 93653, 202992, 16217, 83051, 77293]",True,2021-05-12 10:56:27.046000,NM,8,8,mp-5787,oxide,SrCuO2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Cu': 1.0, 'O': 2.0}",GGA,mp-5787,"['mp-924142', 'mp-909103', 'mp-5787', 'mp-924940', 'mp-1475985', 'mp-1703560', 'mp-1802910', 'mp-1593696']",4e-07,"{'Sr': 2.0, 'Cu': 2.0, 'O': 4.0}",117.71572347282628,[],NM,False,63,0,"[0, 0, 0, 0, 0, 0, 0, 0]",6.796033498317439e-09,4e-07,0,8e-07,MP,data/source/MP/cleaned/cifs/MP-mp-5787.cif,False,,data/final/MP/graphs/Cu1Sr1O2-MP-mp-5787.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ho3Ni1,1,0.0,4.0,False,Ho12Ni4,Ho12Ni4,0.0,Other,True,Ho75Ni25,Ho-Ni,2,Supercon,Ho3Ni1,MP-mp-1189188,Ho12Ni4,Ho-Ni,Ho75Ni25,P n m a,orthorhombic,6.262922,6.806703,9.534901,data/final/MP/cifs/Ho3Ni1-MP-mp-1189188.cif,data/source/MP/raw/cifs/mp-1189188.cif,mp-1189188,0.0,,2019-01-11 20:00:23.026000,9.044497641210327,,,,0.0,3.65198587,520.0,-82.21210056,-5.138256285,"{'tags': ['Holmium nickel (3/1)', 'Fe3C', 'Ho3Ni']}",-82.21210056,-5.138256285,-0.2564154624999997,[],False,[639451],True,2021-05-12 10:59:54.607000,NM,16,3,mp-1189188,,Ho3Ni,"{'functional': 'PBE', 'labels': ['Ho_3', 'Ni_pv'], 'pot_type': 'paw'}","{'Ho': 3.0, 'Ni': 1.0}",GGA,mp-1189188,"['mp-1189188', 'mp-1822025', 'mp-1984404']",0.0001793,"{'Ho': 12.0, 'Ni': 4.0}",406.4713990722461,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.764453788475595e-06,0.0001793,0,0.0007172,MP,data/source/MP/cleaned/cifs/MP-mp-1189188.cif,False,,data/final/MP/graphs/Ho3Ni1-MP-mp-1189188.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ca1P2Rh2,1,0.0,1.0,True,Ca1P2Rh2,Ca1P2Rh2,0.0,Other,True,Ca20P40Rh40,Ca-P-Rh,3,Supercon,Ca1Rh2P2,MP-mp-8580,Ca1P2Rh2,Ca-P-Rh,Ca20P40Rh40,I 4/m m m,tetragonal,4.060372001006815,4.060372001006815,5.637406580000001,data/final/MP/cifs/Ca1P2Rh2-MP-mp-8580.cif,data/source/MP/raw/cifs/mp-8580.cif,mp-8580,0.0,,2011-05-28 04:21:10,6.390894512991742,10.17188/1309163,"@misc{osti_1309163,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ca(PRh)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1309163"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698731'}},0.0,7.51093125,520.0,-32.36031014,-6.472062028000001,{'tags': ['Calcium rhodium phosphide (1/2/2)']},-32.36031014,-6.472062028000001,-0.9598979013333334,['bandstructure'],True,[50185],True,2021-05-12 10:59:07.834000,NM,5,8,mp-8580,,Ca(PRh)2,"{'functional': 'PBE', 'labels': ['Ca_sv', 'P', 'Rh_pv'], 'pot_type': 'paw'}","{'Ca': 1.0, 'P': 2.0, 'Rh': 2.0}",GGA,mp-8580,"['mp-922461', 'mp-907949', 'mp-923246', 'mp-8580', 'mp-1441757', 'mp-1698731', 'mp-1800449', 'mp-1589973']",1.34e-05,"{'Ca': 1.0, 'P': 2.0, 'Rh': 2.0}",79.9848242197092,[],NM,False,139,0,"[0, 0, 0, 0, 0]",1.6753178031862305e-07,1.34e-05,0,1.34e-05,MP,data/source/MP/cleaned/cifs/MP-mp-8580.cif,False,,data/final/MP/graphs/Ca1P2Rh2-MP-mp-8580.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ca1Cu2Pb0.5Sr2Tl0.5O7,1,0.0,2.0,False,Ca2Cu4Pb1Sr4Tl1O14,Ca2Cu4Pb1Sr4Tl1O14,83.15,Cuprate,True,Ca7.692Cu15.385Pb3.846Sr15.385Tl3.846O53.84615384615385,Ca-Cu-Pb-Sr-Tl-O,6,Supercon,Tl0.5Pb0.5Sr2Ca1Cu2O7,MP-mp-1173221,Sr4Ca2Tl1Cu4Pb1O14,Ca-Cu-Pb-Sr-Tl-O,Ca7.692Cu15.385Pb3.846Sr15.385Tl3.846O53.84615384615385,I 4/m m m,tetragonal,5.374731999708263,5.374731999708263,12.82905816,data/final/MP/cifs/Ca1Cu2Pb0.5Sr2Tl0.5O7-MP-mp-1173221.cif,data/source/MP/raw/cifs/mp-1173221.cif,mp-1173221,0.0,,2019-01-11 01:27:33.089000,6.194266073733895,,,,0.0254255932211506,3.8256747,520.0,-146.89191057,-5.649688868076923,{'tags': []},-146.89191057,-5.649688868076923,-2.0768140780769224,[],False,[],True,2021-05-12 10:59:37.456000,NM,26,4,mp-1173221,oxide,Sr4Ca2TlCu4PbO14,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Tl_d', 'Cu_pv', 'Pb_d', 'O'], 'pot_type': 'paw'}","{'Sr': 4.0, 'Ca': 2.0, 'Tl': 1.0, 'Cu': 4.0, 'Pb': 1.0, 'O': 14.0}",GGA,mp-1173221,"['mp-1173221', 'mp-1218598', 'mp-1366452', 'mp-1839546']",0.0074263,"{'Sr': 4.0, 'Ca': 2.0, 'Tl': 1.0, 'Cu': 4.0, 'Pb': 1.0, 'O': 14.0}",353.9672478853857,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",2.098018967677097e-05,0.0074263,0,0.0074263,MP,data/source/MP/cleaned/cifs/MP-mp-1173221.cif,False,,data/final/MP/graphs/Ca1Cu2Pb0.5Sr2Tl0.5O7-MP-mp-1173221.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ca0.4Cu2Ga1Sr2Y0.6O7,2,0.0153846153846153,2.0,False,Ca0.8Cu4Ga2Sr4Y1.2O14,Ca1Cu4Ga2Sr4Y1O14,39.5,Cuprate,True,Ca3.077Cu15.385Ga7.692Sr15.385Y4.615O53.84615384615385,Ca-Cu-Ga-Sr-Y-O,6,Supercon,Y0.6Ca0.4Sr2Cu2Ga1O7,MP-mp-1218546,Sr4Ca1Y1Ga2Cu4O14,Ca-Cu-Ga-Sr-Y-O,Ca3.846Cu15.385Ga7.692Sr15.385Y3.846O53.84615384615385,C 1 2 1,monoclinic,5.395410001165968,5.50183153,12.23851722,data/final/MP/cifs/Ca0.4Cu2Ga1Sr2Y0.6O7-MP-mp-1218546-synth_doped.cif,data/source/MP/raw/cifs/mp-1218546.cif,mp-1218546,0.0,,2019-01-12 19:41:46.800000,5.2818649947650655,,,,0.0215927057772509,2.78925142,520.0,-159.54941305,-6.1365158865384615,{'tags': []},-159.54941305,-6.1365158865384615,-2.392803671089744,[],False,[],True,2021-05-12 11:00:42.526000,FM,26,3,mp-1218546,oxide,Sr4CaYGa2(Cu2O7)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Y_sv', 'Ga_d', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 4.0, 'Ca': 1.0, 'Y': 1.0, 'Ga': 2.0, 'Cu': 4.0, 'O': 14.0}",GGA,mp-1218546,"['mp-1218546', 'mp-1379849', 'mp-1841784']",0.4705663,"{'Sr': 4.0, 'Ca': 1.0, 'Y': 1.0, 'Ga': 2.0, 'Cu': 4.0, 'O': 14.0}",344.9071967816306,[],FM,True,5,2,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.1, 0.1, 0.1, 0.1, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0013643272868496,0.4705663,4,0.4705663,MP,data/source/MP/cleaned/cifs/MP-mp-1218546.cif,True,,data/final/MP/graphs/Ca0.4Cu2Ga1Sr2Y0.6O7-MP-mp-1218546-synth_doped.json,0,True,2,0,0,1,0,0,0,0,0,1,0,0,1.0,False
Ca0.86Cu1Sr0.14O2,3,0.07,1.0,True,Ca0.86Cu1Sr0.14O2,Ca1Cu1O2,0.0,Cuprate,True,Ca21.5Cu25Sr3.5O50,Ca-Cu-Sr-O,4,Supercon,Ca0.86Sr0.14Cu1O2,MP-mp-4826,Ca1Cu1O2,Ca-Cu-O,Ca25Cu25O50,P 4/m m m,tetragonal,3.209758,3.874978,3.874978,data/final/MP/cifs/Ca0.86Cu1Sr0.14O2-MP-mp-4826-synth_doped.cif,data/source/MP/raw/cifs/mp-4826.cif,mp-4826,0.0,,2016-01-04 14:41:26,4.672733703518964,10.17188/1208429,"@misc{osti_1208429,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CaCuO2 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208429"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1673419'}},0.0156029366666672,4.13949381,520.0,-23.13425142,-5.783562855,"{'tags': ['Calcium copper oxide', 'Calcium copper dioxide', 'Calcium cuprate']}",-23.13425142,-5.783562855,-2.1268807149999995,"['xas', 'elasticity', 'bandstructure']",True,"[75868, 86544, 93652]",True,2021-05-12 10:56:20.740000,NM,4,9,mp-4826,oxide,CaCuO2,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ca': 1.0, 'Cu': 1.0, 'O': 2.0}",GGA,mp-4826,"['mp-990138', 'mp-990171', 'mp-4826', 'mp-1140641', 'mp-1439582', 'mp-1673419', 'mp-1795363', 'mp-990181', 'mp-1588650']",0.0003672,"{'Ca': 1.0, 'Cu': 1.0, 'O': 2.0}",48.195975206564526,[],NM,False,123,0,"[0, 0, 0, 0]",7.618893453783368e-06,0.0003672,0,0.0003672,MP,data/source/MP/cleaned/cifs/MP-mp-4826.cif,True,,data/final/MP/graphs/Ca0.86Cu1Sr0.14O2-MP-mp-4826-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Co1V3,1,0.0,2.0,False,Co2V6,Co2V6,0.0,Other,True,Co25V75,Co-V,2,Supercon,Co1V3,MP-mp-1585,V6Co2,Co-V,Co25V75,P m -3 n,cubic,4.652111,4.652111,4.652111,data/final/MP/cifs/Co1V3-MP-mp-1585.cif,data/source/MP/raw/cifs/mp-1585.cif,mp-1585,0.0,,2011-05-14 00:56:01,6.985026990677996,10.17188/1191419,"@misc{osti_1191419,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Co (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191419"",
    place = ""United States"",
    year = ""2015"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698792'}},0.0,6.09531255,520.0,-70.28982049,-8.78622756125,{'tags': ['Cobalt vanadium (1/3)']},-70.28982049,-8.78622756125,-0.1962185600000001,"['xas', 'elasticity', 'bandstructure']",True,"[102716, 625530]",True,2021-05-12 10:56:12.755000,NM,8,8,mp-1585,,V3Co,"{'functional': 'PBE', 'labels': ['V_pv', 'Co'], 'pot_type': 'paw'}","{'V': 3.0, 'Co': 1.0}",GGA,mp-1585,"['mp-941517', 'mp-941229', 'mp-934751', 'mp-1585', 'mp-1418424', 'mp-1698792', 'mp-1796546', 'mp-1589027']",0.00021955,"{'V': 6.0, 'Co': 2.0}",100.68162246758524,[],NM,False,223,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0]",4.361272586179962e-06,0.00021955,0,0.0004391,MP,data/source/MP/cleaned/cifs/MP-mp-1585.cif,False,,data/final/MP/graphs/Co1V3-MP-mp-1585.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
C1Mo0.15Nb0.85,3,0.15,1.0,True,C1Mo0.15Nb0.85,C1Nb1,12.7,Other,True,C50Mo7.5Nb42.5,C-Mo-Nb,3,Supercon,Nb0.85Mo0.15C1,MP-mp-910,Nb1C1,C-Nb,C50Nb50,F m -3 m,cubic,3.18634336,3.1863433599999995,3.1863433599999995,data/final/MP/cifs/C1Mo0.15Nb0.85-MP-mp-910-synth_doped.cif,data/source/MP/raw/cifs/mp-910.cif,mp-910,0.0,,2011-05-12 17:28:40,7.616098778357742,10.17188/1282001,"@misc{osti_1282001,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbC (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1282001"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686610'}},0.0408750508333302,7.39992982,520.0,-20.24633413,-10.123167065,"{'tags': ['Niobium carbide (1/1)', 'Niobium carbide (1/1) - RS-type']}",-20.24633413,-10.123167065,-0.4591241950000011,"['xas', 'elasticity', 'bandstructure']",True,"[618465, 77214, 187077, 618456, 181792, 618453, 94449, 618472, 183163, 237582, 618457, 159872, 618480, 618475, 618482, 618469, 155164, 618466, 44355, 618450, 618458, 618449, 44496, 618463, 618462, 618460, 618481, 618471, 618476, 181052, 601142, 618448, 189089, 618478, 26955, 618473, 618484, 618483]",True,2021-05-12 10:56:35.166000,NM,2,25,mp-910,,NbC,"{'functional': 'PBE', 'labels': ['Nb_pv', 'C'], 'pot_type': 'paw'}","{'Nb': 1.0, 'C': 1.0}",GGA,mp-910,"['mp-1000444', 'mp-1001333', 'mp-910', 'mp-1057158', 'mp-1057178', 'mp-1057130', 'mp-1057651', 'mp-1057669', 'mp-1057682', 'mp-1057771', 'mp-1057779', 'mp-1057802', 'mp-1060960', 'mp-1060978', 'mp-1061015', 'mp-1440938', 'mp-1686610', 'mp-1805660', 'mp-1007673', 'mp-1593845', 'mp-1596940', 'mp-1061007', 'mp-1057677', 'mp-1057792', 'mp-1057174']",3.33e-05,"{'Nb': 1.0, 'C': 1.0}",22.87508541625878,[],NM,False,225,0,"[0, 0]",1.4557322691495426e-06,3.33e-05,0,3.33e-05,MP,data/source/MP/cleaned/cifs/MP-mp-910.cif,True,,data/final/MP/graphs/C1Mo0.15Nb0.85-MP-mp-910-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Li1Ti2O4,1,0.0,2.0,False,Li2Ti4O8,Li2Ti4O8,11.87272727,Oxide,True,Li14.286Ti28.571O57.142857142857146,Li-Ti-O,3,Supercon,Li1Ti2O4,MP-mp-5670,Li2Ti4O8,Li-Ti-O,Li14.286Ti28.571O57.142857142857146,F d -3 m,cubic,5.986032260000001,5.98603226,5.98603226,data/final/MP/cifs/Li1Ti2O4-MP-mp-5670.cif,data/source/MP/raw/cifs/mp-5670.cif,mp-5670,0.0,,2011-05-14 11:10:22,3.649565337909552,10.17188/1273637,"@misc{osti_1273637,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LiTi2O4 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1273637"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699404'}},0.0,5.03116805,520.0,-114.93444733,-8.209603380714286,"{'tags': ['Lithium titanium oxide (1/2/4)', 'Lithium titanium(III) titanium(IV) oxide', 'Lithium titanium(III) titanium oxide', 'Lithium titanium titanium(III) oxide', 'Lithium titano(III)titanate', 'Spinel-(Li,Ti)']}",-114.93444733,-8.209603380714286,-3.2462103921428564,"['bandstructure', 'elasticity']",True,"[72859, 78482, 154982, 81329, 15789, 48127]",True,2021-05-12 10:56:22.739000,NM,14,7,mp-5670,oxide,LiTi2O4,"{'functional': 'PBE', 'labels': ['Li_sv', 'Ti_pv', 'O'], 'pot_type': 'paw'}","{'Li': 1.0, 'Ti': 2.0, 'O': 4.0}",GGA,mp-5670,"['mp-923613', 'mp-922835', 'mp-908534', 'mp-5670', 'mp-1418091', 'mp-1699404', 'mp-1787951']",0.0521081,"{'Li': 2.0, 'Ti': 4.0, 'O': 8.0}",151.67086379131675,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0006871207652868,0.0521081,0,0.1042162,MP,data/source/MP/cleaned/cifs/MP-mp-5670.cif,False,,data/final/MP/graphs/Li1Ti2O4-MP-mp-5670.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Au0.23V0.77,2,0.04,8.0,False,Au1.84V6.16,Au2V6,0.66,Other,True,Au23V77,Au-V,2,Supercon,Au0.23V0.77,MP-mp-839,V6Au2,Au-V,Au25V75,P m -3 n,cubic,4.881091,4.881091,4.881091,data/final/MP/cifs/Au0.23V0.77-MP-mp-839-synth_doped.cif,data/source/MP/raw/cifs/mp-839.cif,mp-839,0.0,,2011-05-14 03:30:11,9.989346931472513,10.17188/1308070,"@misc{osti_1308070,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Au (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1308070"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695038'}},0.0,6.24725953,520.0,-61.34047794,-7.6675597425,{'tags': ['Gold vanadium (1/3)']},-61.34047794,-7.6675597425,-0.0361598049999996,"['bandstructure', 'elasticity']",True,"[612456, 58612, 612451, 612459]",True,2021-05-12 10:56:31.128000,FM,8,8,mp-839,,V3Au,"{'functional': 'PBE', 'labels': ['V_pv', 'Au'], 'pot_type': 'paw'}","{'V': 3.0, 'Au': 1.0}",GGA,mp-839,"['mp-941051', 'mp-839', 'mp-932069', 'mp-940891', 'mp-1420994', 'mp-1695038', 'mp-1802554', 'mp-1596616']",1.39593805,"{'V': 6.0, 'Au': 2.0}",116.2922339582124,[],FM,True,47,1,"[0.4, 0.4, 0.5, 0.5, 0.2, 0.2, 0.0, 0.0]",0.0240074165313843,1.39593805,6,2.7918761,MP,data/source/MP/cleaned/cifs/MP-mp-839.cif,True,,data/final/MP/graphs/Au0.23V0.77-MP-mp-839-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ce0.84Ru2Y0.16,3,0.1066666666666666,2.0,False,Ce1.68Ru4Y0.32,Ce2Ru4,4.92,Heavy_fermion,True,Ce28Ru66.667Y5.333,Ce-Ru-Y,3,Supercon,Ce0.84Y0.16Ru2,MP-mp-607,Ce2Ru4,Ce-Ru,Ce33.333Ru66.667,F d -3 m,cubic,5.35903077,5.35903077,5.35903077,data/final/MP/cifs/Ce0.84Ru2Y0.16-MP-mp-607-synth_doped.cif,data/source/MP/raw/cifs/mp-607.cif,mp-607,0.0,,2011-05-13 22:34:26,10.444470046690055,10.17188/1277529,"@misc{osti_1277529,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeRu2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277529"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686879'}},0.0,8.61419203,520.0,-50.66413619,-8.444022698333333,"{'tags': ['Cerium ruthenium (1/2)', 'Cerium ruthenium hydride (1/2/4)']}",-50.66413619,-8.444022698333333,-0.2833998766666663,"['xas', 'elasticity', 'bandstructure']",True,"[621326, 656077, 621978, 621973, 621980, 621984, 102277, 621972, 621976, 621979, 604113, 621977, 621982, 621983, 102276, 656078]",True,2021-05-12 10:56:27.046000,NM,6,14,mp-607,,CeRu2,"{'functional': 'PBE', 'labels': ['Ce', 'Ru_pv'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Ru': 2.0}",GGA,mp-607,"['mp-928203', 'mp-912221', 'mp-928809', 'mp-607', 'mp-1071462', 'mp-1071593', 'mp-1071613', 'mp-1077792', 'mp-1440763', 'mp-1686879', 'mp-1803198', 'mp-1591928', 'mp-1591642', 'mp-1071635']",1.005e-05,"{'Ce': 2.0, 'Ru': 4.0}",108.82877852828122,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",1.846937939745105e-07,1.005e-05,0,2.01e-05,MP,data/source/MP/cleaned/cifs/MP-mp-607.cif,True,,data/final/MP/graphs/Ce0.84Ru2Y0.16-MP-mp-607-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Gd1Sn3,1,0.0,1.0,True,Gd1Sn3,Gd1Sn3,0.0,Other,True,Gd25Sn75,Gd-Sn,2,Supercon,Gd1Sn3,MP-mp-19919,Gd1Sn3,Gd-Sn,Gd25Sn75,P m -3 m,cubic,4.742978,4.742978,4.742978,data/final/MP/cifs/Gd1Sn3-MP-mp-19919.cif,data/source/MP/raw/cifs/mp-19919.cif,mp-19919,0.0,,2014-02-21 09:28:40,7.9897780015542255,10.17188/1195104,"@misc{osti_1195104,
    author = ""Persson, Kristin"",
    title = ""Materials Data on GdSn3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195104"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677556'}},0.0,7.26014057,520.0,-27.95722232,-6.98930558,"{'tags': ['Gadolinium stannide (1/3)', 'Gadolinium tin (1/3)']}",-27.95722232,-6.98930558,-0.4630961287500001,"['xas', 'bandstructure']",True,"[636461, 182147, 104133]",True,2021-05-12 10:56:57.051000,FM,4,6,mp-19919,,GdSn3,"{'functional': 'PBE', 'labels': ['Gd', 'Sn_d'], 'pot_type': 'paw'}","{'Gd': 1.0, 'Sn': 3.0}",GGA,mp-19919,"['mp-19919', 'mp-1437818', 'mp-1677556', 'mp-1771396', 'mp-1933916', 'mp-1596286']",6.7136873,"{'Gd': 1.0, 'Sn': 3.0}",106.6972756746528,[],FM,True,221,1,"[6.9, 0.0, 0.0, 0.0]",0.0629227621562873,6.7136873,1,6.7136873,MP,data/source/MP/cleaned/cifs/MP-mp-19919.cif,False,,data/final/MP/graphs/Gd1Sn3-MP-mp-19919.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Si3U1,1,0.0,1.0,True,Si3U1,Si3U1,0.0,Heavy_fermion,True,Si75U25,Si-U,2,Supercon,Si3U1,MP-mp-2800,U1Si3,Si-U,Si75U25,P m -3 m,cubic,4.020644,4.020644,4.020644,data/final/MP/cifs/Si3U1-MP-mp-2800.cif,data/source/MP/raw/cifs/mp-2800.cif,mp-2800,0.0,,2011-05-12 19:52:22,8.233848645791042,10.17188/1202138,"@misc{osti_1202138,
    author = ""Persson, Kristin"",
    title = ""Materials Data on USi3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1202138"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687762'}},0.0,11.23202944,520.0,-29.07230012,-7.26807503,"{'tags': ['Uranium silicide (1/3)', 'silicon uranium (3/1)']}",-29.07230012,-7.26807503,-0.3229870125000005,"['xas', 'elasticity', 'bandstructure']",True,"[652480, 652474, 652473, 52470, 652466, 106054, 657101]",True,2021-05-12 10:56:18.721000,NM,4,11,mp-2800,,USi3,"{'functional': 'PBE', 'labels': ['U', 'Si'], 'pot_type': 'paw'}","{'U': 1.0, 'Si': 3.0}",GGA,mp-2800,"['mp-926656', 'mp-911079', 'mp-927168', 'mp-2800', 'mp-1125039', 'mp-1132765', 'mp-1260872', 'mp-1442016', 'mp-1687762', 'mp-1791398', 'mp-1590559']",0.0013063,"{'U': 1.0, 'Si': 3.0}",64.99603489478324,[],NM,False,221,0,"[0, 0, 0, 0]",2.009814909655124e-05,0.0013063,0,0.0013063,MP,data/source/MP/cleaned/cifs/MP-mp-2800.cif,False,,data/final/MP/graphs/Si3U1-MP-mp-2800.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
As2Ba1Co2,1,0.0,1.0,True,As2Ba1Co2,As2Ba1Co2,0.0,Other,True,As40Ba20Co40,As-Ba-Co,3,Supercon,Ba1Co2As2,MP-mp-20563,Ba1Co2As2,As-Ba-Co,As40Ba20Co40,I 4/m m m,tetragonal,3.990995998110407,3.990995998110407,6.9237496300000005,data/final/MP/cifs/As2Ba1Co2-MP-mp-20563.cif,data/source/MP/raw/cifs/mp-20563.cif,mp-20563,0.0,,2014-02-21 07:42:02,6.678676708924591,10.17188/1195711,"@misc{osti_1195711,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba(CoAs)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195711"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-929952'}},0.0,4.8371159,520.0,-28.53190695,-5.70638139,{'tags': ['Barium cobalt arsenide (1/2/2)']},-28.53190695,-5.70638139,-0.6156127440000005,"['xas', 'elasticity', 'bandstructure']",True,[609848],True,2021-05-12 10:56:14.760000,FM,5,8,mp-20563,,Ba(CoAs)2,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Co', 'As'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Co': 2.0, 'As': 2.0}",GGA,mp-20563,"['mp-913616', 'mp-930417', 'mp-929952', 'mp-20563', 'mp-1475466', 'mp-1698600', 'mp-1797078', 'mp-1591443']",1.0760623,"{'Ba': 1.0, 'Co': 2.0, 'As': 2.0}",100.70544067490076,[],FM,True,139,1,"[0.0, 0.5, 0.5, 0.0, 0.0]",0.0106852449360086,1.0760623,2,1.0760623,MP,data/source/MP/cleaned/cifs/MP-mp-20563.cif,False,,data/final/MP/graphs/As2Ba1Co2-MP-mp-20563.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Be2Mo1,1,0.0,4.0,False,Be8Mo4,Be8Mo4,0.0,Other,True,Be66.667Mo33.333,Be-Mo,2,Supercon,Be2Mo1,MP-mp-1677,Be8Mo4,Be-Mo,Be66.667Mo33.333,P 63/m m c,hexagonal,4.450666003929433,4.45066616,7.301567,data/final/MP/cifs/Be2Mo1-MP-mp-1677.cif,data/source/MP/raw/cifs/mp-1677.cif,mp-1677,0.0,,2011-05-13 22:57:03,6.043401186038341,10.17188/1192154,"@misc{osti_1192154,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Be2Mo (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1192154"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697119'}},0.0,5.98477542,520.0,-77.13689567,-6.428074639166667,"{'tags': ['Beryllium molybdenum (2/1)', 'Molybdenum beryllide (1/2)']}",-77.13689567,-6.428074639166667,-0.3199183858333339,"['xas', 'elasticity', 'bandstructure']",True,"[616342, 616337, 58716]",True,2021-05-12 10:56:14.760000,NM,12,9,mp-1677,,Be2Mo,"{'functional': 'PBE', 'labels': ['Be_sv', 'Mo_pv'], 'pot_type': 'paw'}","{'Be': 2.0, 'Mo': 1.0}",GGA,mp-1677,"['mp-913637', 'mp-930502', 'mp-929991', 'mp-1677', 'mp-1101853', 'mp-1420051', 'mp-1697119', 'mp-1921197', 'mp-1601169']",0.003714175,"{'Be': 8.0, 'Mo': 4.0}",125.2554796854567,[],NM,False,194,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001186111780283,0.003714175,0,0.0148567,MP,data/source/MP/cleaned/cifs/MP-mp-1677.cif,False,,data/final/MP/graphs/Be2Mo1-MP-mp-1677.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Bi2Cu1Sr2O6.16,2,0.0130335614206581,1.9480129870129868,False,Bi3.896Cu1.948Sr3.896O12,Bi4Cu2Sr4O12,10.0,Cuprate,True,Bi17.921Cu8.961Sr17.921O55.19713261648746,Bi-Cu-Sr-O,4,Supercon,Bi2Sr2Cu1O6.16,MP-mp-555827,Sr4Cu2Bi4O12,Bi-Cu-Sr-O,Bi18.182Cu9.091Sr18.182O54.54545454545455,C c c m,orthorhombic,5.133052,5.52519599964684,13.01880065,data/final/MP/cifs/Bi2Cu1Sr2O6.16-MP-mp-555827-synth_doped.cif,data/source/MP/raw/cifs/mp-555827.cif,mp-555827,0.0,,2014-02-22 10:13:35,6.928457216674172,10.17188/1269010,"@misc{osti_1269010,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr2Cu(BiO3)2 (SG:66) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1269010"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1707731'}},0.0585641377272736,4.75363105,520.0,-126.5422218,-5.7519191727272725,{'tags': ['Dibismuth distrontium copper hexaoxide']},-126.5422218,-5.7519191727272725,-2.0406438793939388,"['xas', 'bandstructure']",True,[67426],True,2021-05-12 10:57:17.297000,NM,22,8,mp-555827,oxide,Sr2Cu(BiO3)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Cu': 1.0, 'Bi': 2.0, 'O': 6.0}",GGA,mp-555827,"['mp-932594', 'mp-931549', 'mp-918058', 'mp-555827', 'mp-1418436', 'mp-1707731', 'mp-1837530', 'mp-1605675']",0.00627605,"{'Sr': 4.0, 'Cu': 2.0, 'Bi': 4.0, 'O': 12.0}",360.8189966762927,[],NM,False,66,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",3.478780251490214e-05,0.00627605,0,0.0125521,MP,data/source/MP/cleaned/cifs/MP-mp-555827.cif,True,,data/final/MP/graphs/Bi2Cu1Sr2O6.16-MP-mp-555827-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
C1Ta0.6W0.4,3,0.0999999999999999,2.0,False,C2Ta1.2W0.8,C2Ta1W1,10.0,Other,True,C50Ta30W20,C-Ta-W,3,Supercon,Ta0.6W0.4C1,MP-mp-1217826,Ta1W1C2,C-Ta-W,C50Ta25W25,R -3 m,trigonal,3.143710581936928,3.1437105819369275,5.41487146,data/final/MP/cifs/C1Ta0.6W0.4-MP-mp-1217826-synth_doped.cif,data/source/MP/raw/cifs/mp-1217826.cif,mp-1217826,0.0,,2019-01-12 19:05:53.027000,14.786382904799275,,,{'GGA': {'task_id': 'mp-1767905'}},0.2106623600000006,8.86330729,520.0,-43.82464305,-10.9561607625,{'tags': []},-43.82464305,-10.9561607625,-0.1387943875000008,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,4,5,mp-1217826,,TaWC2,"{'functional': 'PBE', 'labels': ['Ta_pv', 'W_pv', 'C'], 'pot_type': 'paw'}","{'Ta': 1.0, 'W': 1.0, 'C': 2.0}",GGA,mp-1217826,"['mp-1217826', 'mp-1424018', 'mp-1767905', 'mp-1793222', 'mp-1612658']",0.0002661,"{'Ta': 1.0, 'W': 1.0, 'C': 2.0}",43.664025411316935,[],NM,False,166,0,"[0, 0, 0, 0]",6.094261751941718e-06,0.0002661,0,0.0002661,MP,data/source/MP/cleaned/cifs/MP-mp-1217826.cif,True,,data/final/MP/graphs/C1Ta0.6W0.4-MP-mp-1217826-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Nb0.5Re0.5,1,0.0,2.0,False,Nb1Re1,Nb1Re1,2.9,Other,True,Nb50Re50,Nb-Re,2,Supercon,Nb0.5Re0.5,MP-mp-1220322,Nb1Re1,Nb-Re,Nb50Re50,C m m m,orthorhombic,2.780963,2.780963,4.535669,data/final/MP/cifs/Nb0.5Re0.5-MP-mp-1220322.cif,data/source/MP/raw/cifs/mp-1220322.cif,mp-1220322,0.0,,2019-01-12 21:11:16.524000,14.037573111624948,,,{'GGA': {'task_id': 'mp-1674486'}},0.0,6.51687711,520.0,-22.82601076,-11.41300538,{'tags': []},-22.82601076,-11.41300538,-0.1400892675000005,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,2,5,mp-1220322,,NbRe,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Re_pv'], 'pot_type': 'paw'}","{'Nb': 1.0, 'Re': 1.0}",GGA,mp-1220322,"['mp-1220322', 'mp-1422874', 'mp-1674486', 'mp-1794151', 'mp-1610446']",0.0013699,"{'Nb': 1.0, 'Re': 1.0}",33.01700855377558,[],NM,False,65,0,"[0, 0]",4.149073644175884e-05,0.0013699,0,0.0013699,MP,data/source/MP/cleaned/cifs/MP-mp-1220322.cif,False,,data/final/MP/graphs/Nb0.5Re0.5-MP-mp-1220322.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
La1Os4P12,1,0.0,1.0,True,La1Os4P12,La1Os4P12,0.9,Other,True,La5.882Os23.529P70.588,La-Os-P,3,Supercon,La1Os4P12,MP-mp-1021506,La1P12Os4,La-Os-P,La5.882Os23.529P70.588,I m -3,cubic,7.051229071563148,7.05122907,7.05122907,data/final/MP/cifs/La1Os4P12-MP-mp-1021506.cif,data/source/MP/raw/cifs/mp-1021506.cif,mp-1021506,0.0,,2017-04-12 19:35:32,7.823417509288382,10.17188/1351432,"@article{osti_1351432,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La(P3Os)4 (SG:204) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1351432"",
    place = ""United States"",
    year = ""2017"",
    month = ""4""
}
",{'GGA': {'task_id': 'mp-1669717'}},0.0,8.14009796,520.0,-125.36047512,-7.374145595294117,"{'tags': ['LaOs4P12', 'Lanthanum osmium phosphide (1/4/12)', 'LaFe4P12']}",-125.36047512,-7.374145595294117,-0.6209042891176475,['bandstructure'],True,[641615],True,2021-05-12 10:58:09.072000,NM,17,7,mp-1021506,,La(P3Os)4,"{'functional': 'PBE', 'labels': ['La', 'P', 'Os_pv'], 'pot_type': 'paw'}","{'La': 1.0, 'P': 12.0, 'Os': 4.0}",GGA,mp-1021506,"['mp-1023377', 'mp-1021506', 'mp-1189394', 'mp-1423041', 'mp-1669717', 'mp-1876802', 'mp-1607923']",0.0011231,"{'La': 1.0, 'P': 12.0, 'Os': 4.0}",269.88116710335265,[],NM,False,204,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.1614611795787215e-06,0.0011231,0,0.0011231,MP,data/source/MP/cleaned/cifs/MP-mp-1021506.cif,False,,data/final/MP/graphs/La1Os4P12-MP-mp-1021506.json,0,True,m-3,2,0,0,0,0,0,0,0,0,1,0,1.0,False
In1.5Sn1.5Th1,1,0.0,2.0,False,In3Sn3Th2,In3Sn3Th2,1.03,Other,True,In37.5Sn37.5Th25,In-Sn-Th,3,Supercon,Th1In1.5Sn1.5,MP-mp-1217463,Th2In3Sn3,In-Sn-Th,In37.5Sn37.5Th25,P m m m,orthorhombic,4.743894,4.839092,9.341656,data/final/MP/cifs/In1.5Sn1.5Th1-MP-mp-1217463.cif,data/source/MP/raw/cifs/mp-1217463.cif,mp-1217463,0.0,,2019-01-12 18:47:43.110000,9.018318645902704,,,{'GGA': {'task_id': 'mp-1754054'}},0.0,8.39403303,520.0,-38.31070284,-4.788837855,{'tags': []},-38.31070284,-4.788837855,-0.3999024481250002,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,8,5,mp-1217463,,Th2(InSn)3,"{'functional': 'PBE', 'labels': ['Th', 'In_d', 'Sn_d'], 'pot_type': 'paw'}","{'Th': 2.0, 'In': 3.0, 'Sn': 3.0}",GGA,mp-1217463,"['mp-1217463', 'mp-1412361', 'mp-1754054', 'mp-1830259', 'mp-1620925']",0.1030608,"{'Th': 2.0, 'In': 3.0, 'Sn': 3.0}",214.4483583366953,[],NM,False,47,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0004805856328272,0.1030608,0,0.1030608,MP,data/source/MP/cleaned/cifs/MP-mp-1217463.cif,False,,data/final/MP/graphs/In1.5Sn1.5Th1-MP-mp-1217463.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Si3Ti5,1,0.0,2.0,False,Si6Ti10,Si6Ti10,0.0,Other,True,Si37.5Ti62.5,Si-Ti,2,Supercon,Si3Ti5,MP-mp-2108,Ti10Si6,Si-Ti,Si37.5Ti62.5,P 63/m c m,hexagonal,5.119423,7.4673319960157025,7.46733268,data/final/MP/cifs/Si3Ti5-MP-mp-2108.cif,data/source/MP/raw/cifs/mp-2108.cif,mp-2108,0.0,,2011-05-15 07:21:01,4.347039405670554,10.17188/1196357,"@misc{osti_1196357,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ti5Si3 (SG:193) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196357"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703014'}},0.0,7.37815555,520.0,-123.82733035,-7.739208146875,"{'tags': ['Silicon titanium (3/5)', 'Titanium silicide (5/3)']}",-123.82733035,-7.739208146875,-0.7434078789583332,"['xas', 'elasticity', 'bandstructure']",True,"[652424, 652420, 652413, 168415, 62591, 44386]",True,2021-05-12 10:56:16.728000,NM,16,10,mp-2108,,Ti5Si3,"{'functional': 'PBE', 'labels': ['Ti_pv', 'Si'], 'pot_type': 'paw'}","{'Ti': 5.0, 'Si': 3.0}",GGA,mp-2108,"['mp-910224', 'mp-925697', 'mp-926116', 'mp-2108', 'mp-1125031', 'mp-1138242', 'mp-1429023', 'mp-1703014', 'mp-1923727', 'mp-1601709']",0.01930175,"{'Ti': 10.0, 'Si': 6.0}",247.2194416589637,[],NM,False,193,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0001561507450261,0.01930175,0,0.0386035,MP,data/source/MP/cleaned/cifs/MP-mp-2108.cif,False,,data/final/MP/graphs/Si3Ti5-MP-mp-2108.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
B6Rh8Sr3,1,0.0,1.0,True,B6Rh8Sr3,B6Rh8Sr3,3.4,Other,True,B35.294Rh47.059Sr17.647,B-Rh-Sr,3,Supercon,Sr3Rh8B6,MP-mp-568771,Sr3B6Rh8,B-Rh-Sr,B35.294Rh47.059Sr17.647,F m m m,orthorhombic,5.623322003102879,5.759563996365164,9.054735096774332,data/final/MP/cifs/B6Rh8Sr3-MP-mp-568771.cif,data/source/MP/raw/cifs/mp-568771.cif,mp-568771,0.0,,2014-02-24 13:55:07,7.855673800652788,10.17188/1274685,"@misc{osti_1274685,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr3(B3Rh4)2 (SG:69) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1274685"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1670117'}},0.0,5.59123926,520.0,-113.46280168,-6.6742824517647055,{'tags': ['Strontium rhodium boride (3/8/6)']},-113.46280168,-6.6742824517647055,-0.5531475138235289,"['xas', 'bandstructure']",True,[66771],True,2021-05-12 10:57:24.969000,NM,17,8,mp-568771,,Sr3(B3Rh4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'B', 'Rh_pv'], 'pot_type': 'paw'}","{'Sr': 3.0, 'B': 6.0, 'Rh': 8.0}",GGA,mp-568771,"['mp-916247', 'mp-931594', 'mp-932670', 'mp-568771', 'mp-1431924', 'mp-1670117', 'mp-1777738', 'mp-1608160']",5.2e-05,"{'Sr': 3.0, 'B': 6.0, 'Rh': 8.0}",243.2930259051468,[],NM,False,69,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.137340345311557e-07,5.2e-05,0,5.2e-05,MP,data/source/MP/cleaned/cifs/MP-mp-568771.cif,False,,data/final/MP/graphs/B6Rh8Sr3-MP-mp-568771.json,0,True,mmm,0,0,0,7,0,0,0,0,0,0,1,1.0,False
C1Mg1Ni3,1,0.0,1.0,True,C1Mg1Ni3,C1Mg1Ni3,6.91125,Other,True,C20Mg20Ni60,C-Mg-Ni,3,Supercon,Mg1C1Ni3,MP-mp-10700,Mg1Ni3C1,C-Mg-Ni,C20Mg20Ni60,P m -3 m,cubic,3.810209,3.810209,3.810209,data/final/MP/cifs/C1Mg1Ni3-MP-mp-10700.cif,data/source/MP/raw/cifs/mp-10700.cif,mp-10700,0.0,,2011-05-28 10:04:44,6.376007671789427,10.17188/1187303,"@misc{osti_1187303,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MgNi3C (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187303"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678621'}},0.0,6.64260176,520.0,-28.85099542,-5.770199084,{'tags': ['Magnesium nickel carbide (1/3/1)']},-28.85099542,-5.770199084,-0.1367049259999994,"['xas', 'elasticity', 'bandstructure']",True,[77152],True,2021-05-12 10:56:10.715000,NM,5,8,mp-10700,,MgNi3C,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Ni_pv', 'C'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",GGA,mp-10700,"['mp-927245', 'mp-927653', 'mp-911184', 'mp-10700', 'mp-1438083', 'mp-1678621', 'mp-1791467', 'mp-1591421']",0.0387875,"{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",55.31544309398296,[],NM,False,221,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",0.0007012056277683,0.0387875,0,0.0387875,MP,data/source/MP/cleaned/cifs/MP-mp-10700.cif,False,,data/final/MP/graphs/C1Mg1Ni3-MP-mp-10700.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
B2C1Er0.7Ni2Tb0.3,3,0.1,1.0,True,B2C1Er0.7Ni2Tb0.3,B2C1Er1Ni2,2.0,Other,True,B33.333C16.667Er11.667Ni33.333Tb5,B-C-Er-Ni-Tb,5,Supercon,Er0.7Tb0.3Ni2B2C1,MP-mp-6098,Er1Ni2B2C1,B-C-Er-Ni,B33.333C16.667Er16.667Ni33.333,I 4/m m m,tetragonal,3.5122880026935177,3.5122880026935173,5.77805085,data/final/MP/cifs/B2C1Er0.7Ni2Tb0.3-MP-mp-6098-synth_doped.cif,data/source/MP/raw/cifs/mp-6098.cif,mp-6098,0.0,,2011-05-13 04:24:02,8.212015229638553,10.17188/1277667,"@misc{osti_1277667,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ErNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277667"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700042'}},0.0,6.72687579,520.0,-41.84324782,-6.973874636666667,{'tags': []},-41.84324782,-6.973874636666667,-0.5216152347222227,"['xas', 'elasticity', 'bandstructure']",True,"[246431, 79576, 56651]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-6098,,ErNi2B2C,"{'functional': 'PBE', 'labels': ['Er_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Er': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6098,"['mp-1006980', 'mp-1000513', 'mp-6098', 'mp-1441533', 'mp-1700042', 'mp-1793903', 'mp-1011723', 'mp-1589040']",0.0020747,"{'Er': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",64.35860973581151,[],NM,False,139,0,"[0.0, -0.0, -0.0, 0.0, 0.0, 0.0]",3.2236557136900987e-05,0.0020747,0,0.0020747,MP,data/source/MP/cleaned/cifs/MP-mp-6098.cif,True,,data/final/MP/graphs/B2C1Er0.7Ni2Tb0.3-MP-mp-6098-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
C3Lu0.2Th1.8,3,0.0799999999999999,4.0,False,C12Lu0.8Th7.2,C12Th8,10.3,Other,True,C60Lu4Th36,C-Lu-Th,3,Supercon,Th1.8Lu0.2C3,MP-mp-1188514,Th8C12,C-Th,C60Th40,I -4 3 d,cubic,7.414620251643706,7.41462025,7.41462025,data/final/MP/cifs/C3Lu0.2Th1.8-MP-mp-1188514-synth_doped.cif,data/source/MP/raw/cifs/mp-1188514.cif,mp-1188514,0.0,,2019-01-11 19:30:01.530000,10.585910862659652,,,{'GGA': {'task_id': 'mp-1669546'}},0.0,8.12401413,520.0,-175.32363419,-8.7661817095,"{'tags': ['Pu2C3', 'Th2C3 hp', 'Thorium carbide (2/3)']}",-175.32363419,-8.7661817095,-0.2645699894999992,['bandstructure'],True,[618903],True,2021-05-12 10:58:33.577000,NM,20,5,mp-1188514,,Th2C3,"{'functional': 'PBE', 'labels': ['Th', 'C'], 'pot_type': 'paw'}","{'Th': 2.0, 'C': 3.0}",GGA,mp-1188514,"['mp-1188514', 'mp-1415692', 'mp-1669546', 'mp-1811506', 'mp-1605961']",0.000101475,"{'Th': 8.0, 'C': 12.0}",313.7941543668512,[],NM,False,220,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.2935231404134748e-06,0.000101475,0,0.0004059,MP,data/source/MP/cleaned/cifs/MP-mp-1188514.cif,True,,data/final/MP/graphs/C3Lu0.2Th1.8-MP-mp-1188514-synth_doped.json,0,True,-43m,5,0,0,0,0,0,0,0,0,1,0,1.0,False
Au0.3Nb3Rh0.7,3,0.15,2.0,False,Au0.6Nb6Rh1.4,Nb6Rh2,4.6,Other,True,Au7.5Nb75Rh17.5,Au-Nb-Rh,3,Supercon,Nb3Rh0.7Au0.3,MP-mp-1545,Nb6Rh2,Nb-Rh,Nb75Rh25,P m -3 n,cubic,5.186072,5.186072,5.186072,data/final/MP/cifs/Au0.3Nb3Rh0.7-MP-mp-1545-synth_doped.cif,data/source/MP/raw/cifs/mp-1545.cif,mp-1545,0.0,,2011-05-14 11:20:25,9.086567873234834,10.17188/1191190,"@misc{osti_1191190,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Rh (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191190"",
    place = ""United States"",
    year = ""2015"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700041'}},0.0,5.48706495,520.0,-77.37430008,-9.67178751,{'tags': ['Niobium rhodium (3/1)']},-77.37430008,-9.67178751,-0.2547317625000005,"['xas', 'elasticity', 'bandstructure']",True,"[105216, 645269]",True,2021-05-12 10:56:12.755000,NM,8,8,mp-1545,,Nb3Rh,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Rh_pv'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Rh': 1.0}",GGA,mp-1545,"['mp-942004', 'mp-943019', 'mp-935201', 'mp-1545', 'mp-1433570', 'mp-1700041', 'mp-1786474', 'mp-1591392']",0.00021655,"{'Nb': 6.0, 'Rh': 2.0}",139.48118416938905,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",3.1050783127424102e-06,0.00021655,0,0.0004331,MP,data/source/MP/cleaned/cifs/MP-mp-1545.cif,True,,data/final/MP/graphs/Au0.3Nb3Rh0.7-MP-mp-1545-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ca3Ge13Ir4,1,0.0,2.0,False,Ca6Ge26Ir8,Ca6Ge26Ir8,1.7,Other,True,Ca15Ge65Ir20,Ca-Ge-Ir,3,Supercon,Ca3Ir4Ge13,MP-mp-1202780,Ca6Ge26Ir8,Ca-Ge-Ir,Ca15Ge65Ir20,P m -3 n,cubic,9.106374,9.106374,9.106374,data/final/MP/cifs/Ca3Ge13Ir4-MP-mp-1202780.cif,data/source/MP/raw/cifs/mp-1202780.cif,mp-1202780,0.0,,2019-01-12 06:45:30.166000,8.063156381582536,,,,0.0,4.95880636,520.0,-220.05930603,-5.50148265075,"{'tags': ['Yb3Rh4Sn13', 'Ca3Ir4Ge13', 'Calcium iridium germanide (3/4/13)']}",-220.05930603,-5.50148265075,-0.427988478999999,[],False,[619308],True,2021-05-12 11:00:12.709000,NM,40,3,mp-1202780,,Ca3Ge13Ir4,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Ge_d', 'Ir'], 'pot_type': 'paw'}","{'Ca': 3.0, 'Ge': 13.0, 'Ir': 4.0}",GGA,mp-1202780,"['mp-1202780', 'mp-1372854', 'mp-1885508']",0.00168705,"{'Ca': 6.0, 'Ge': 26.0, 'Ir': 8.0}",755.155602219977,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.46808576945063e-06,0.00168705,0,0.0033741,MP,data/source/MP/cleaned/cifs/MP-mp-1202780.cif,False,,data/final/MP/graphs/Ca3Ge13Ir4-MP-mp-1202780.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba1.7Cu2La2.3Ti2O11.15,3,0.0579634464751957,0.5,False,Ba0.85Cu1La1.15Ti1O5.575,Ba1Cu1La1Ti1O6,0.0,Cuprate,True,Ba8.877Cu10.444La12.01Ti10.444O58.22454308093995,Ba-Cu-La-Ti-O,5,Supercon,La2.3Ba1.7Cu2Ti2O11.15,MP-mp-1227852,Ba1La1Ti1Cu1O6,Ba-Cu-La-Ti-O,Ba10Cu10La10Ti10O60,F -4 3 m,cubic,5.61997722,5.619977219999999,5.619977219999999,data/final/MP/cifs/Ba1.7Cu2La2.3Ti2O11.15-MP-mp-1227852-synth_doped.cif,data/source/MP/raw/cifs/mp-1227852.cif,mp-1227852,0.0,,2019-01-13 03:38:10.917000,6.398590577851808,,,{'GGA': {'task_id': 'mp-1734188'}},0.1228187138579528,4.96777084,520.0,-72.7941219,-7.279412189999999,{'tags': []},-72.7941219,-7.279412189999999,-2.8378679248333327,['bandstructure'],True,[],True,2021-05-12 10:58:49.477000,FM,10,5,mp-1227852,oxide,BaLaTiCuO6,"{'functional': 'PBE', 'labels': ['Ba_sv', 'La', 'Ti_pv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 1.0, 'La': 1.0, 'Ti': 1.0, 'Cu': 1.0, 'O': 6.0}",GGA,mp-1227852,"['mp-1227852', 'mp-1389128', 'mp-1734188', 'mp-1805149', 'mp-1621737']",1.9113509,"{'Ba': 1.0, 'La': 1.0, 'Ti': 1.0, 'Cu': 1.0, 'O': 6.0}",125.51298752546604,[],FM,True,216,1,"[0.0, 0.0, 0.0, 0.9, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0152283117283954,1.9113509,1,1.9113509,MP,data/source/MP/cleaned/cifs/MP-mp-1227852.cif,True,,data/final/MP/graphs/Ba1.7Cu2La2.3Ti2O11.15-MP-mp-1227852-synth_doped.json,0,True,-43m,5,0,0,0,0,0,0,0,0,0,1,1.0,False
Pd0.15Pt2.85U1,3,0.0749999999999999,2.0,False,Pd0.3Pt5.7U2,Pt6U2,0.0,Heavy_fermion,True,Pd3.75Pt71.25U25,Pd-Pt-U,3,Supercon,U1Pt2.85Pd0.15,MP-mp-30855,U2Pt6,Pt-U,Pt75U25,P 63/m m c,hexagonal,4.997603,5.777009996166576,5.7770105,data/final/MP/cifs/Pd0.15Pt2.85U1-MP-mp-30855-synth_doped.cif,data/source/MP/raw/cifs/mp-30855.cif,mp-30855,0.0,,2014-02-19 21:36:23,18.929034548497903,10.17188/1205211,"@misc{osti_1205211,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UPt3 (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1205211"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687777'}},0.0,9.26919984,520.0,-64.84444661,-8.10555582625,"{'tags': ['Platinum uranium (3/1)', 'Uranium platinum boride (1/3/0.11)', 'Uranium platinum (1/3)']}",-64.84444661,-8.10555582625,-0.7295225412500006,"['xas', 'bandstructure']",True,"[615213, 649804, 105833, 191938]",True,2021-05-12 10:57:04.957000,FM,8,11,mp-30855,,UPt3,"{'functional': 'PBE', 'labels': ['U', 'Pt'], 'pot_type': 'paw'}","{'U': 1.0, 'Pt': 3.0}",GGA,mp-30855,"['mp-943077', 'mp-932790', 'mp-942062', 'mp-30855', 'mp-1078485', 'mp-1079639', 'mp-1092253', 'mp-1299942', 'mp-1687777', 'mp-1924669', 'mp-1595664']",0.6726182,"{'U': 2.0, 'Pt': 6.0}",144.44372324836635,[],FM,True,187,1,"[0.0, 1.4, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0093132215768691,0.6726182,1,1.3452364,MP,data/source/MP/cleaned/cifs/MP-mp-30855.cif,True,,data/final/MP/graphs/Pd0.15Pt2.85U1-MP-mp-30855-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Li0.45Nb1O2,2,0.0248447204968943,4.0,False,Li1.8Nb4O8,Li2Nb4O8,5.5,Oxide,True,Li13.043Nb28.986O57.97101449275362,Li-Nb-O,3,Supercon,Li0.45Nb1O2,MP-mp-758673,Li2Nb4O8,Li-Nb-O,Li14.286Nb28.571O57.142857142857146,P n n m,orthorhombic,2.972999,5.165176,10.7268,data/final/MP/cifs/Li0.45Nb1O2-MP-mp-758673-synth_doped.cif,data/source/MP/raw/cifs/mp-758673.cif,mp-758673,0.0,,2014-05-09 12:22:29,5.176566231803271,10.17188/1291127,"@misc{osti_1291127,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LiNb2O4 (SG:58) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1291127"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-894280'}},0.0600248224999866,3.22049784,520.0,-116.3472335,-8.310516678571428,{'tags': []},-116.3472335,-8.310516678571428,-2.716891397619047,['bandstructure'],True,[],True,2021-05-12 10:59:01.620000,NM,14,6,mp-758673,oxide,LiNb2O4,"{'functional': 'PBE', 'labels': ['Li_sv', 'Nb_pv', 'O'], 'pot_type': 'paw'}","{'Li': 1.0, 'Nb': 2.0, 'O': 4.0}",GGA,mp-758673,"['mp-880306', 'mp-894280', 'mp-758673', 'mp-1399221', 'mp-1785811', 'mp-894708']",0.0148934,"{'Li': 2.0, 'Nb': 4.0, 'O': 8.0}",164.7214174768365,[],NM,False,58,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0001808313724849,0.0148934,0,0.0297868,MP,data/source/MP/cleaned/cifs/MP-mp-758673.cif,True,,data/final/MP/graphs/Li0.45Nb1O2-MP-mp-758673-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ce0.14Cu1Pr1.86O4,2,0.0399999999999999,1.0,True,Ce0.14Cu1Pr1.86O4,Cu1Pr2O4,19.35,Cuprate,True,Ce2Cu14.286Pr26.571O57.142857142857146,Ce-Cu-Pr-O,4,Supercon,Pr1.86Ce0.14Cu1O4,MP-mp-4181,Pr2Cu1O4,Cu-Pr-O,Cu14.286Pr28.571O57.142857142857146,I 4/m m m,tetragonal,3.995734002478021,3.995734002478021,6.85109716,data/final/MP/cifs/Ce0.14Cu1Pr1.86O4-MP-mp-4181-synth_doped.cif,data/source/MP/raw/cifs/mp-4181.cif,mp-4181,0.0,,2011-05-13 10:21:01,6.821515862307185,10.17188/1207928,"@misc{osti_1207928,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Pr2CuO4 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207928"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-669887'}},0.0,3.15418113,520.0,-51.2919541,-7.327422014285714,"{'tags': ['Dipraseodymium cuprate', 'Dipraseodymium copper oxide', 'Praseodymium cuprate', 'Dipraseodymium copper tetraoxide']}",-51.2919541,-7.327422014285714,-2.9410150171428566,"['xas', 'elasticity', 'bandstructure']",True,"[91071, 261374, 71180, 186589, 185267, 185268, 65925, 65924, 191813, 261373, 202884, 72241]",True,2021-05-12 10:56:20.740000,NM,7,12,mp-4181,oxide,Pr2CuO4,"{'functional': 'PBE', 'labels': ['Pr_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Pr': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-4181,"['mp-669887', 'mp-660138', 'mp-4181', 'mp-1077961', 'mp-1077976', 'mp-1077987', 'mp-1078042', 'mp-1442060', 'mp-1687781', 'mp-1797293', 'mp-1589370', 'mp-688743']",0.0084498,"{'Pr': 2.0, 'Cu': 1.0, 'O': 4.0}",99.64888441679796,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",8.479573102552068e-05,0.0084498,0,0.0084498,MP,data/source/MP/cleaned/cifs/MP-mp-4181.cif,True,,data/final/MP/graphs/Ce0.14Cu1Pr1.86O4-MP-mp-4181-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ca1Hg1,1,0.0,1.0,True,Ca1Hg1,Ca1Hg1,1.6,Other,True,Ca50Hg50,Ca-Hg,2,Supercon,Ca1Hg1,MP-mp-11286,Ca1Hg1,Ca-Hg,Ca50Hg50,P m -3 m,cubic,3.811914,3.811914,3.811914,data/final/MP/cifs/Ca1Hg1-MP-mp-11286.cif,data/source/MP/raw/cifs/mp-11286.cif,mp-11286,0.0,,2011-05-27 18:23:33,7.215030383240868,10.17188/1187710,"@misc{osti_1187710,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CaHg (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187710"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-928213'}},0.0,3.01955761,520.0,-3.413521,-1.7067605,{'tags': ['Calcium mercury (1/1)']},-3.413521,-1.7067605,-0.5521203774999999,"['xas', 'elasticity', 'bandstructure']",True,[58900],True,2021-05-12 10:56:10.715000,NM,2,7,mp-11286,,CaHg,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Hg'], 'pot_type': 'paw'}","{'Ca': 1.0, 'Hg': 1.0}",GGA,mp-11286,"['mp-928748', 'mp-11286', 'mp-912168', 'mp-928213', 'mp-1439478', 'mp-1791206', 'mp-1593578']",0.00029,"{'Ca': 1.0, 'Hg': 1.0}",55.389734325828016,[],NM,False,221,0,"[0, 0]",5.235627206552138e-06,0.00029,0,0.00029,MP,data/source/MP/cleaned/cifs/MP-mp-11286.cif,False,,data/final/MP/graphs/Ca1Hg1-MP-mp-11286.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Al0.94Nb3Se0.06,2,0.03,2.0,False,Al1.88Nb6Se0.12,Al2Nb6,17.8,Other,True,Al23.5Nb75Se1.5,Al-Nb-Se,3,Supercon,Nb3Al0.94Se0.06,MP-mp-796,Nb6Al2,Al-Nb,Al25Nb75,P m -3 n,cubic,5.215254,5.215254,5.215254,data/final/MP/cifs/Al0.94Nb3Se0.06-MP-mp-796-synth_doped.cif,data/source/MP/raw/cifs/mp-796.cif,mp-796,0.0,,2011-05-13 16:07:37,7.157298025966356,,,{'GGA': {'task_id': 'mp-1686893'}},0.0460773865000003,5.52947534,520.0,-69.48918494,-8.6861481175,"{'tags': ['Aluminium niobium (1/3)', 'Niobium aluminide (3/1)', 'Aluminum niobium (1/3)']}",-69.48918494,-8.6861481175,-0.1737753800000003,"['bandstructure', 'elasticity']",True,"[608675, 608654, 608688, 608668, 608669, 608685, 608676, 608683, 58014, 608657, 107856, 608655, 608666, 608691, 608656, 608665, 608673, 608653, 608661]",True,2021-05-12 10:56:31.128000,NM,8,10,mp-796,,Nb3Al,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Al': 1.0}",GGA,mp-796,"['mp-911586', 'mp-927906', 'mp-796', 'mp-927472', 'mp-1260512', 'mp-1440919', 'mp-1686893', 'mp-1927652', 'mp-1591599', 'mp-1587739']",0.16323955,"{'Nb': 6.0, 'Al': 2.0}",141.8490379078192,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0023015954483396,0.16323955,0,0.3264791,MP,data/source/MP/cleaned/cifs/MP-mp-796.cif,True,,data/final/MP/graphs/Al0.94Nb3Se0.06-MP-mp-796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Co1Sc1,1,0.0,1.0,True,Co1Sc1,Co1Sc1,0.0,Other,True,Co50Sc50,Co-Sc,2,Supercon,Co1Sc1,MP-mp-2212,Sc1Co1,Co-Sc,Co50Sc50,P m -3 m,cubic,3.11951,3.11951,3.11951,data/final/MP/cifs/Co1Sc1-MP-mp-2212.cif,data/source/MP/raw/cifs/mp-2212.cif,mp-2212,0.0,,2011-05-12 18:44:20,5.682768496639224,10.17188/1197358,"@misc{osti_1197358,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ScCo (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197358"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672224'}},0.0,5.04037795,520.0,-14.18205023,-7.091025115,{'tags': ['Cobalt scandium (1/1)']},-14.18205023,-7.091025115,-0.3706316650000003,"['xas', 'elasticity', 'bandstructure']",True,"[624932, 102642]",True,2021-05-12 10:56:16.728000,FM,2,8,mp-2212,,ScCo,"{'functional': 'PBE', 'labels': ['Sc_sv', 'Co'], 'pot_type': 'paw'}","{'Sc': 1.0, 'Co': 1.0}",GGA,mp-2212,"['mp-912325', 'mp-928336', 'mp-928852', 'mp-2212', 'mp-1440350', 'mp-1672224', 'mp-1793348', 'mp-1596779']",0.0333728,"{'Sc': 1.0, 'Co': 1.0}",30.357020679218348,[],FM,True,221,1,"[0.0, 0.1]",0.0010993437186293,0.0333728,1,0.0333728,MP,data/source/MP/cleaned/cifs/MP-mp-2212.cif,False,,data/final/MP/graphs/Co1Sc1-MP-mp-2212.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ce0.085Ge12Pr0.915Pt4,2,0.0099999999999999,1.0,True,Ce0.085Ge12Pr0.915Pt4,Ge12Pr1Pt4,4.61,Heavy_fermion,True,Ce0.5Ge70.588Pr5.382Pt23.529,Ce-Ge-Pr-Pt,4,Supercon,Pr0.915Ce0.085Pt4Ge12,MP-mp-1105939,Pr1Ge12Pt4,Ge-Pr-Pt,Ge70.588Pr5.882Pt23.529,I m -3,cubic,7.560907531676135,7.560907530000001,7.56090753,data/final/MP/cifs/Ce0.085Ge12Pr0.915Pt4-MP-mp-1105939-synth_doped.cif,data/source/MP/raw/cifs/mp-1105939.cif,mp-1105939,0.0,,2018-07-19 06:58:09,8.947691530234051,,,{'GGA': {'task_id': 'mp-1705662'}},0.0059454020588258,4.25899828,520.0,-91.15368674,-5.361981572941176,{'tags': ['Praseodymium platinum germanide (1/4/12)']},-91.15368674,-5.361981572941176,-0.3889895585294119,['bandstructure'],True,[174554],True,2021-05-12 10:58:22.271000,NM,17,5,mp-1105939,,Pr(Ge3Pt)4,"{'functional': 'PBE', 'labels': ['Pr_3', 'Ge_d', 'Pt'], 'pot_type': 'paw'}","{'Pr': 1.0, 'Ge': 12.0, 'Pt': 4.0}",GGA,mp-1105939,"['mp-1105939', 'mp-1427343', 'mp-1705662', 'mp-1805701', 'mp-1584493']",0.0022709,"{'Pr': 1.0, 'Ge': 12.0, 'Pt': 4.0}",332.73607546662794,[],NM,False,204,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.824928727115922e-06,0.0022709,0,0.0022709,MP,data/source/MP/cleaned/cifs/MP-mp-1105939.cif,True,,data/final/MP/graphs/Ce0.085Ge12Pr0.915Pt4-MP-mp-1105939-synth_doped.json,0,True,m-3,2,0,0,0,0,0,0,0,0,1,0,1.0,False
Fe1Se0.5Te0.5,1,0.0,2.0,False,Fe2Se1Te1,Fe2Se1Te1,13.675625,Ferrite,True,Fe50Se25Te25,Fe-Se-Te,3,Supercon,Fe1Te0.5Se0.5,MP-mp-1225136,Fe2Te1Se1,Fe-Se-Te,Fe50Se25Te25,P 4 m m,tetragonal,3.755398,3.755398,5.937717,data/final/MP/cifs/Fe1Se0.5Te0.5-MP-mp-1225136.cif,data/source/MP/raw/cifs/mp-1225136.cif,mp-1225136,0.0,,2019-01-13 01:17:25.998000,6.310824077785493,,,{'GGA': {'task_id': 'mp-1764167'}},0.0802741556250001,4.86336573,520.0,-24.0729629,-6.018240725,{'tags': []},-24.0729629,-6.018240725,-0.3469333980859375,['bandstructure'],True,[],True,2021-05-12 10:58:45.495000,FM,4,5,mp-1225136,,Fe2TeSe,"{'functional': 'PBE', 'labels': ['Fe_pv', 'Te', 'Se'], 'pot_type': 'paw'}","{'Fe': 2.0, 'Te': 1.0, 'Se': 1.0}",GGA,mp-1225136,"['mp-1225136', 'mp-1425562', 'mp-1764167', 'mp-1784460', 'mp-1615275']",0.1061773,"{'Fe': 2.0, 'Te': 1.0, 'Se': 1.0}",83.73970680084179,[],FM,True,99,1,"[0.1, 0.1, -0.0, -0.0]",0.0012679444920021,0.1061773,2,0.1061773,MP,data/source/MP/cleaned/cifs/MP-mp-1225136.cif,False,,data/final/MP/graphs/Fe1Se0.5Te0.5-MP-mp-1225136.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
Ba2Cu1Tl1O5,1,0.0,1.0,True,Ba2Cu1Tl1O5,Ba2Cu1Tl1O5,95.0,Cuprate,True,Ba22.222Cu11.111Tl11.111O55.55555555555556,Ba-Cu-Tl-O,4,Supercon,Tl1Ba2Cu1O5,MP-mp-20942,Ba2Tl1Cu1O5,Ba-Cu-Tl-O,Ba22.222Cu11.111Tl11.111O55.55555555555556,P 4/m m m,tetragonal,3.817261,3.817261,9.866732,data/final/MP/cifs/Ba2Cu1Tl1O5-MP-mp-20942.cif,data/source/MP/raw/cifs/mp-20942.cif,mp-20942,0.0,,2015-01-22 19:45:14,7.190638062517283,10.17188/1196135,"@misc{osti_1196135,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2TlCuO5 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196135"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704252'}},0.065783808888888,2.51456414,520.0,-48.53075924,-5.392306582222222,{'tags': ['Thallium(III) dibarium copper(III) oxide']},-48.53075924,-5.392306582222222,-1.8806847487037044,"['xas', 'bandstructure']",True,[66583],True,2021-05-12 10:56:57.051000,NM,9,9,mp-20942,oxide,Ba2TlCuO5,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Tl_d', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Tl': 1.0, 'Cu': 1.0, 'O': 5.0}",GGA,mp-20942,"['mp-923520', 'mp-922736', 'mp-917400', 'mp-1183375', 'mp-1433607', 'mp-1704252', 'mp-1788250', 'mp-1588727', 'mp-20942']",0.1466806,"{'Ba': 2.0, 'Tl': 1.0, 'Cu': 1.0, 'O': 5.0}",143.77290321905463,[],NM,False,123,0,"[0.0, 0.0, 0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0010202242336062,0.1466806,0,0.1466806,MP,data/source/MP/cleaned/cifs/MP-mp-20942.cif,False,,data/final/MP/graphs/Ba2Cu1Tl1O5-MP-mp-20942.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ba2Ca1Cu2Hg1O6.08,2,0.0066225165562914,0.9869684210526316,True,Ba1.974Ca0.987Cu1.974Hg0.987O6,Ba2Ca1Cu2Hg1O6,92.0,Cuprate,True,Ba16.556Ca8.278Cu16.556Hg8.278O50.33112582781457,Ba-Ca-Cu-Hg-O,5,Supercon,Hg1Ba2Ca1Cu2O6.08,MP-mp-6879,Ba2Ca1Cu2Hg1O6,Ba-Ca-Cu-Hg-O,Ba16.667Ca8.333Cu16.667Hg8.333O50,P 4/m m m,tetragonal,3.904834,3.904834,13.058604,data/final/MP/cifs/Ba2Ca1Cu2Hg1O6.08-MP-mp-6879-synth_doped.cif,data/source/MP/raw/cifs/mp-6879.cif,mp-6879,0.0,,2011-05-14 23:17:39,6.158075338837193,10.17188/1284432,"@misc{osti_1284432,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2CaCu2HgO6 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1284432"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698891'}},0.017586347638888,3.04291167,520.0,-64.08791228,-5.3406593566666665,"{'tags': ['High pressure experimental phase', 'Mercury dibarium calcium dicopper oxide', 'Mercury barium calcium copper oxide (1/2/1/2/6)']}",-64.08791228,-5.3406593566666665,-2.0147092504166664,"['bandstructure', 'elasticity']",True,"[83087, 75729, 75727, 75726, 75725, 75728]",True,2021-05-12 10:56:27.046000,NM,12,12,mp-6879,oxide,Ba2CaCu2HgO6,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ca_sv', 'Cu_pv', 'Hg', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Hg': 1.0, 'O': 6.0}",GGA,mp-6879,"['mp-917434', 'mp-924375', 'mp-6879', 'mp-923788', 'mvc-16307', 'mp-1045026', 'mp-1045039', 'mp-1422313', 'mp-1698891', 'mp-1833979', 'mp-1592102', 'mp-1045044']",0.0305618,"{'Ba': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Hg': 1.0, 'O': 6.0}",199.11404926320108,[],NM,False,123,0,"[0.0, 0.0, 0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001534889181004,0.0305618,0,0.0305618,MP,data/source/MP/cleaned/cifs/MP-mp-6879.cif,True,,data/final/MP/graphs/Ba2Ca1Cu2Hg1O6.08-MP-mp-6879-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Au0.3Te0.7,3,0.0666666666666666,3.0,False,Au0.9Te2.1,Au1Te2,1.99,Other,True,Au30Te70,Au-Te,2,Supercon,Au0.3Te0.7,MP-mp-567525,Te2Au1,Au-Te,Au33.333Te66.667,C 1 2/m 1,monoclinic,4.228509889999999,4.228509889999999,5.15701111,data/final/MP/cifs/Au0.3Te0.7-MP-mp-567525-synth_doped.cif,data/source/MP/raw/cifs/mp-567525.cif,mp-567525,0.0,,2014-02-16 11:21:24,9.349466095623004,10.17188/1272560,"@misc{osti_1272560,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Te2Au (SG:12) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1272560"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668681'}},0.0177770462499995,6.52239204,520.0,-9.77688527,-3.2589617566666664,"{'tags': ['Gold telluride (1/2)', 'Gold ditelluride', 'Calaverite, average structure', 'High pressure experimental phase', 'Calaverite']}",-9.77688527,-3.2589617566666664,-0.3534672899999993,"['xas', 'bandstructure']",True,"[64681, 64682, 72435, 659325, 151373, 72434, 72437, 66625, 66626, 612390, 65105, 659328, 65104, 659326, 72438, 72436, 659327, 72439]",True,2021-05-12 10:57:23.123000,NM,3,7,mp-567525,,Te2Au,"{'functional': 'PBE', 'labels': ['Te', 'Au'], 'pot_type': 'paw'}","{'Te': 2.0, 'Au': 1.0}",GGA,mp-567525,"['mp-567525', 'mp-1441005', 'mp-1668681', 'mp-1799624', 'mp-1934226', 'mp-1595493', 'mp-1592789']",0.0002727,"{'Te': 2.0, 'Au': 1.0}",80.30835608746618,[],NM,False,12,0,"[0, 0, 0]",3.3956615884777227e-06,0.0002727,0,0.0002727,MP,data/source/MP/cleaned/cifs/MP-mp-567525.cif,True,,data/final/MP/graphs/Au0.3Te0.7-MP-mp-567525-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
B2Ir0.12Mg0.88,3,0.08,1.0,True,B2Ir0.12Mg0.88,B2Mg1,18.0,Other,True,B66.667Ir4Mg29.333,B-Ir-Mg,3,Supercon,Mg0.88Ir0.12B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B2Ir0.12Mg0.88-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B2Ir0.12Mg0.88-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ce1Co1Ge3,1,0.0,1.0,True,Ce1Co1Ge3,Ce1Co1Ge3,0.676666667,Heavy_fermion,True,Ce20Co20Ge60,Ce-Co-Ge,3,Supercon,Ce1Co1Ge3,MP-mp-21116,Ce1Co1Ge3,Ce-Co-Ge,Ce20Co20Ge60,I 4 m m,tetragonal,4.309834002674428,4.309834002674427,5.767702850000001,data/final/MP/cifs/Ce1Co1Ge3-MP-mp-21116.cif,data/source/MP/raw/cifs/mp-21116.cif,mp-21116,0.0,,2014-02-21 09:52:09,7.612299927607442,10.17188/1196393,"@misc{osti_1196393,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeCoGe3 (SG:107) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196393"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704660'}},0.0,6.2434267,520.0,-29.79328834,-5.958657668,"{'tags': ['Cerium cobalt germanide (1/1/3)', 'Cerium cobalt germanium (1/1/3)']}",-29.79328834,-5.958657668,-0.5765595650000002,"['xas', 'bandstructure']",True,"[620734, 106374, 190701]",True,2021-05-12 10:56:57.051000,FM,5,12,mp-21116,,CeCoGe3,"{'functional': 'PBE', 'labels': ['Ce', 'Co', 'Ge_d'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Co': 1.0, 'Ge': 3.0}",GGA,mp-21116,"['mp-993592', 'mp-991682', 'mp-21116', 'mp-1071099', 'mp-1070810', 'mp-1070945', 'mp-1441245', 'mp-1704660', 'mp-1798234', 'mp-994930', 'mp-1596894', 'mp-1071050']",0.1163719,"{'Ce': 1.0, 'Co': 1.0, 'Ge': 3.0}",90.95721982198276,[],FM,True,107,1,"[0.1, 0.0, 0.0, 0.0, 0.0]",0.0012794135553808,0.1163719,1,0.1163719,MP,data/source/MP/cleaned/cifs/MP-mp-21116.cif,False,,data/final/MP/graphs/Ce1Co1Ge3-MP-mp-21116.json,0,True,4mm,0,0,0,0,5,0,0,0,0,1,0,1.0,False
Ba6.62Si46,3,0.0340989303361025,0.2608728490739525,False,Ba1.727Si12,Ba2Si12,5.0,Other,True,Ba12.581Si87.419,Ba-Si,2,Supercon,Ba6.62Si46,MP-mp-1480,Ba2Si12,Ba-Si,Ba14.286Si85.714,C m c m,orthorhombic,4.504218002155348,5.70181207,12.007895,data/final/MP/cifs/Ba6.62Si46-MP-mp-1480-synth_doped.cif,data/source/MP/raw/cifs/mp-1480.cif,mp-1480,0.0,,2011-05-13 14:58:38,3.5851357009979075,10.17188/1190902,"@misc{osti_1190902,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BaSi6 (SG:63) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1190902"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1676787'}},0.1132404973214287,6.94706542,520.0,-70.08572671,-5.006123336428572,{'tags': ['Barium hexasilicide']},-70.08572671,-5.006123336428572,-0.020858343571429,"['xas', 'bandstructure']",True,"[245296, 245295, 710014]",True,2021-05-12 10:56:53.126000,NM,14,11,mp-1480,,BaSi6,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Si'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Si': 6.0}",GGA,mp-1480,"['mp-915185', 'mp-1001475', 'mp-1001236', 'mp-1480', 'mp-1143447', 'mp-1264071', 'mp-1381521', 'mp-1676787', 'mp-1925742', 'mp-1007985', 'mp-1604242']",0.0011983,"{'Ba': 2.0, 'Si': 12.0}",283.3138327163368,[],NM,False,63,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",8.459170443680933e-06,0.0011983,0,0.0023966,MP,data/source/MP/cleaned/cifs/MP-mp-1480.cif,True,,data/final/MP/graphs/Ba6.62Si46-MP-mp-1480-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ba2Cu1Hg1O4.21,2,0.02557856272838,0.9500296912114014,True,Ba1.9Cu0.95Hg0.95O4,Ba2Cu1Hg1O4,80.0,Cuprate,True,Ba24.361Cu12.18Hg12.18O51.278928136419,Ba-Cu-Hg-O,4,Supercon,Hg1Ba2Cu1O4.21,MP-mp-6562,Ba2Cu1Hg1O4,Ba-Cu-Hg-O,Ba25Cu12.5Hg12.5O50,P 4/m m m,tetragonal,3.933714,3.933714,9.827602,data/final/MP/cifs/Ba2Cu1Hg1O4.21-MP-mp-6562-synth_doped.cif,data/source/MP/raw/cifs/mp-6562.cif,mp-6562,0.0,,2011-05-13 18:18:06,6.582036471328142,10.17188/1281336,"@misc{osti_1281336,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2CuHgO4 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281336"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697135'}},0.0234340381250053,2.58068675,520.0,-40.91481298,-5.1143516225,"{'tags': ['Mercury dibarium copper oxide', 'High pressure experimental phase']}",-40.91481298,-5.1143516225,-1.953767533125,"['xas', 'bandstructure']",True,"[75722, 75720, 75724, 75721, 75723]",True,2021-05-12 10:57:32.679000,NM,8,8,mp-6562,oxide,Ba2CuHgO4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Cu_pv', 'Hg', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",GGA,mp-6562,"['mp-6562', 'mp-990899', 'mp-992892', 'mp-1435690', 'mp-1697135', 'mp-1878488', 'mp-994198', 'mp-1592659']",0.0003984,"{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",152.07335344042525,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0, 0, 0]",2.619788352047311e-06,0.0003984,0,0.0003984,MP,data/source/MP/cleaned/cifs/MP-mp-6562.cif,True,,data/final/MP/graphs/Ba2Cu1Hg1O4.21-MP-mp-6562-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B2C1La0.06Lu0.94Ni2,2,0.02,1.0,True,B2C1La0.06Lu0.94Ni2,B2C1Lu1Ni2,15.1,Other,True,B33.333C16.667La1Lu15.667Ni33.333,B-C-La-Lu-Ni,5,Supercon,Lu0.94La0.06Ni2B2C1,MP-mp-6544,Lu1Ni2B2C1,B-C-Lu-Ni,B33.333C16.667Lu16.667Ni33.333,I 4/m m m,tetragonal,3.4660159989239463,3.4660159989239463,5.81490896,data/final/MP/cifs/B2C1La0.06Lu0.94Ni2-MP-mp-6544-synth_doped.cif,data/source/MP/raw/cifs/mp-6544.cif,mp-6544,0.0,,2011-05-13 04:17:06,8.54504130524706,10.17188/1281287,"@misc{osti_1281287,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LuNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281287"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702891'}},0.0,6.71335166,520.0,-41.78223818,-6.963706363333333,{'tags': []},-41.78223818,-6.963706363333333,-0.5192416763888884,"['xas', 'bandstructure']",True,"[75609, 83230, 79564]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6544,,LuNi2B2C,"{'functional': 'PBE', 'labels': ['Lu_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Lu': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6544,"['mp-1000584', 'mp-1007055', 'mp-6544', 'mp-1441469', 'mp-1702891', 'mp-1783160', 'mp-1011794', 'mp-1588498']",0.0023161,"{'Lu': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",63.34823894903922,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",3.656139520884231e-05,0.0023161,0,0.0023161,MP,data/source/MP/cleaned/cifs/MP-mp-6544.cif,True,,data/final/MP/graphs/B2C1La0.06Lu0.94Ni2-MP-mp-6544-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ba0.96K0.04Sb2Ti2O1,2,0.0133333333333333,1.0,True,Ba0.96K0.04Sb2Ti2O1,Ba1Sb2Ti2O1,3.88,Oxide,True,Ba16K0.667Sb33.333Ti33.333O16.666666666666668,Ba-K-Sb-Ti-O,5,Supercon,Ba0.96K0.04Ti2Sb2O1,MP-mp-1070806,Ba1Ti2Sb2O1,Ba-Sb-Ti-O,Ba16.667Sb33.333Ti33.333O16.666666666666668,P 4/m m m,tetragonal,4.113474,4.113474,8.312382,data/final/MP/cifs/Ba0.96K0.04Sb2Ti2O1-MP-mp-1070806-synth_doped.cif,data/source/MP/raw/cifs/mp-1070806.cif,mp-1070806,0.0,,2018-03-22 04:02:04,5.8154485533321445,,,{'GGA': {'task_id': 'mp-1702174'}},0.0,5.89751533,520.0,-39.14932631,-6.524887718333333,{'tags': []},-39.14932631,-6.524887718333333,-1.5507346602777776,['bandstructure'],True,"[430061, 237789, 430060]",True,2021-05-12 10:58:14.654000,NM,6,16,mp-1070806,oxide,BaTi2Sb2O,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ti_pv', 'Sb', 'O'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Ti': 2.0, 'Sb': 2.0, 'O': 1.0}",GGA,mp-1070806,"['mp-1071055', 'mp-1071068', 'mp-1071083', 'mp-1071088', 'mp-1070806', 'mp-1071124', 'mp-1070846', 'mp-1070900', 'mp-1071137', 'mp-1423542', 'mp-1702174', 'mp-1785425', 'mp-1588663', 'mp-1070899', 'mp-1071129', 'mp-1071119']",0.001055,"{'Ba': 1.0, 'Ti': 2.0, 'Sb': 2.0, 'O': 1.0}",140.65105900950408,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0]",7.500832254158225e-06,0.001055,0,0.001055,MP,data/source/MP/cleaned/cifs/MP-mp-1070806.cif,True,,data/final/MP/graphs/Ba0.96K0.04Sb2Ti2O1-MP-mp-1070806-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Mo15Na2Se19,1,0.0,2.0,False,Mo30Na4Se38,Mo30Na4Se38,0.0,Chevrel,True,Mo41.667Na5.556Se52.778,Mo-Na-Se,3,Supercon,Na2Mo15Se19,MP-mp-1199740,Na4Mo30Se38,Mo-Na-Se,Mo41.667Na5.556Se52.778,R -3 c,trigonal,9.756431526127498,9.756431526127498,20.40120484,data/final/MP/cifs/Mo15Na2Se19-MP-mp-1199740.cif,data/source/MP/raw/cifs/mp-1199740.cif,mp-1199740,0.0,,2019-01-12 04:16:40.163000,6.133671067493281,,,,0.0420780162500111,4.09266109,520.0,-504.33198973,-7.004610968472222,{'tags': ['Sodium molybdenum selenide (2/15/19)']},-504.33198973,-7.004610968472222,-0.8161661320176294,[],False,[643976],True,2021-05-12 11:00:08.243000,NM,72,2,mp-1199740,,Na2Mo15Se19,"{'functional': 'PBE', 'labels': ['Na_pv', 'Mo_pv', 'Se'], 'pot_type': 'paw'}","{'Na': 2.0, 'Mo': 15.0, 'Se': 19.0}",GGA,mp-1199740,"['mp-1199740', 'mp-1327824']",0.00474405,"{'Na': 4.0, 'Mo': 30.0, 'Se': 38.0}",1616.402205307399,[],NM,False,1,0,"[0.0, 0.0, 0.0, 0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, 0.0, -0.0, -0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",5.86988805685006e-06,0.00474405,0,0.0094881,MP,data/source/MP/cleaned/cifs/MP-mp-1199740.cif,False,,data/final/MP/graphs/Mo15Na2Se19-MP-mp-1199740.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ba2Cu4Pr0.05Y0.95O8,2,0.0066666666666666,1.0,True,Ba2Cu4Pr0.05Y0.95O8,Ba2Cu4Y1O8,77.0,Cuprate,True,Ba13.333Cu26.667Pr0.333Y6.333O53.333333333333336,Ba-Cu-Pr-Y-O,5,Supercon,Y0.95Pr0.05Ba2Cu4O8,MP-mp-6790,Ba2Y1Cu4O8,Ba-Cu-Y-O,Ba13.333Cu26.667Y6.667O53.333333333333336,C m m m,orthorhombic,3.889922,3.899603999537882,13.88942687,data/final/MP/cifs/Ba2Cu4Pr0.05Y0.95O8-MP-mp-6790-synth_doped.cif,data/source/MP/raw/cifs/mp-6790.cif,mp-6790,0.0,,2011-05-16 03:21:24,5.936250568336678,10.17188/1283441,"@misc{osti_1283441,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Y(CuO2)4 (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1283441"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686864'}},0.0,3.31391536,520.0,-91.58381472,-6.105587648,"{'tags': ['Yttrium barium copper oxide (1/2/4/8)', 'High pressure experimental phase']}",-91.58381472,-6.105587648,-2.0529924817777783,"['xas', 'bandstructure']",True,"[72261, 85273, 74251, 400273, 85277, 85275, 400280, 67632, 85272, 67631, 83920, 66613, 85279, 400277, 75689, 74259, 85278, 85280, 66603, 94265, 400276, 88873, 71417, 75712, 97052, 66605, 72258, 85281, 85274, 400279, 66604, 69698]",True,2021-05-12 10:57:34.594000,NM,15,10,mp-6790,oxide,Ba2Y(CuO2)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-6790,"['mp-1000664', 'mp-6790', 'mp-1007136', 'mp-1237713', 'mp-1440937', 'mp-1686864', 'mp-1834179', 'mp-1011883', 'mp-1590064', 'mp-1590433']",0.0004643,"{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",208.60454115924333,[],NM,False,65,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.225742533790601e-06,0.0004643,0,0.0004643,MP,data/source/MP/cleaned/cifs/MP-mp-6790.cif,True,,data/final/MP/graphs/Ba2Cu4Pr0.05Y0.95O8-MP-mp-6790-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
As2Ba0.68Co0.046Fe1.954K0.32,3,0.0904,2.0,False,As4Ba1.36Co0.092Fe3.908K0.64,As4Ba1Fe4K1,35.0,Ferrite,True,As40Ba13.6Co0.92Fe39.08K6.4,As-Ba-Co-Fe-K,5,Supercon,Ba0.68K0.32Fe1.954Co0.046As2,MP-mp-1223517,K1Ba1Fe4As4,As-Ba-Fe-K,As40Ba10Fe40K10,C m m m,orthorhombic,5.479027,5.480024002658328,7.13170472,data/final/MP/cifs/As2Ba0.68Co0.046Fe1.954K0.32-MP-mp-1223517-synth_doped.cif,data/source/MP/raw/cifs/mp-1223517.cif,mp-1223517,0.0,,2019-01-12 23:54:03.876000,5.87534599912672,,,{'GGA': {'task_id': 'mp-1743010'}},0.0132513644999994,4.21185628,520.0,-59.66633886,-5.966633886,{'tags': []},-59.66633886,-5.966633886,-0.4120461663000007,[],False,[],True,2021-05-12 11:00:52.054000,FM,10,4,mp-1223517,,KBa(FeAs)4,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",GGA,mp-1223517,"['mp-1223517', 'mp-1396881', 'mp-1743010', 'mp-1827585']",0.9947188,"{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",197.6961518155852,[],FM,True,65,1,"[0.0, 0.0, 0.3, 0.3, 0.3, 0.3, 0.0, 0.0, 0.0, 0.0]",0.0050315536790412,0.9947188,4,0.9947188,MP,data/source/MP/cleaned/cifs/MP-mp-1223517.cif,True,,data/final/MP/graphs/As2Ba0.68Co0.046Fe1.954K0.32-MP-mp-1223517-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ce2In8Pd1,1,0.0,1.0,True,Ce2In8Pd1,Ce2In8Pd1,0.69,Heavy_fermion,True,Ce18.182In72.727Pd9.091,Ce-In-Pd,3,Supercon,Ce2Pd1In8,MP-mp-1102172,Ce2In8Pd1,Ce-In-Pd,Ce18.182In72.727Pd9.091,P 4/m m m,tetragonal,4.732873,4.732873,12.199147,data/final/MP/cifs/Ce2In8Pd1-MP-mp-1102172.cif,data/source/MP/raw/cifs/mp-1102172.cif,mp-1102172,0.0,,2018-07-18 13:44:23,7.931323519048292,,,{'GGA': {'task_id': 'mp-1697032'}},0.0,7.80355898,520.0,-43.64673672,-3.967885156363636,"{'tags': ['Ce2PdIn8', 'Ho2CoGa8', 'Cerium palladium indide (2/1/8)']}",-43.64673672,-3.967885156363636,-0.4170187963636364,['bandstructure'],True,[247864],True,2021-05-12 10:58:20.361000,FM,11,5,mp-1102172,,Ce2In8Pd,"{'functional': 'PBE', 'labels': ['Ce', 'In_d', 'Pd'], 'pot_type': 'paw'}","{'Ce': 2.0, 'In': 8.0, 'Pd': 1.0}",GGA,mp-1102172,"['mp-1102172', 'mp-1413198', 'mp-1697032', 'mp-1881230', 'mp-1597523']",0.1316405,"{'Ce': 2.0, 'In': 8.0, 'Pd': 1.0}",273.26195210230424,[],FM,True,123,1,"[0.1, 0.1, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0004817373914928,0.1316405,2,0.1316405,MP,data/source/MP/cleaned/cifs/MP-mp-1102172.cif,False,,data/final/MP/graphs/Ce2In8Pd1-MP-mp-1102172.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
As2Ba0.68Fe2K0.32,3,0.072,2.0,False,As4Ba1.36Fe4K0.64,As4Ba1Fe4K1,37.75,Ferrite,True,As40Ba13.6Fe40K6.4,As-Ba-Fe-K,4,Supercon,Ba0.68K0.32Fe2As2,MP-mp-1223517,K1Ba1Fe4As4,As-Ba-Fe-K,As40Ba10Fe40K10,C m m m,orthorhombic,5.479027,5.480024002658328,7.13170472,data/final/MP/cifs/As2Ba0.68Fe2K0.32-MP-mp-1223517-synth_doped.cif,data/source/MP/raw/cifs/mp-1223517.cif,mp-1223517,0.0,,2019-01-12 23:54:03.876000,5.87534599912672,,,{'GGA': {'task_id': 'mp-1743010'}},0.0132513644999994,4.21185628,520.0,-59.66633886,-5.966633886,{'tags': []},-59.66633886,-5.966633886,-0.4120461663000007,[],False,[],True,2021-05-12 11:00:52.054000,FM,10,4,mp-1223517,,KBa(FeAs)4,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",GGA,mp-1223517,"['mp-1223517', 'mp-1396881', 'mp-1743010', 'mp-1827585']",0.9947188,"{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",197.6961518155852,[],FM,True,65,1,"[0.0, 0.0, 0.3, 0.3, 0.3, 0.3, 0.0, 0.0, 0.0, 0.0]",0.0050315536790412,0.9947188,4,0.9947188,MP,data/source/MP/cleaned/cifs/MP-mp-1223517.cif,True,,data/final/MP/graphs/As2Ba0.68Fe2K0.32-MP-mp-1223517-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
As2Fe1.84Ni0.16Sr1,3,0.0639999999999999,1.0,True,As2Fe1.84Ni0.16Sr1,As2Fe2Sr1,8.65,Ferrite,True,As40Fe36.8Ni3.2Sr20,As-Fe-Ni-Sr,4,Supercon,Sr1Fe1.84Ni0.16As2,MP-mp-4488,Sr1Fe2As2,As-Fe-Sr,As40Fe40Sr20,I 4/m m m,tetragonal,3.9729799997357778,3.9729799997357778,6.45523327,data/final/MP/cifs/As2Fe1.84Ni0.16Sr1-MP-mp-4488-synth_doped.cif,data/source/MP/raw/cifs/mp-4488.cif,mp-4488,0.0,,2011-05-13 03:37:13,6.319998834487784,10.17188/1208187,"@misc{osti_1208187,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr(FeAs)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208187"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672865'}},0.0,5.13397273,520.0,-30.61898897,-6.123797794,"{'tags': ['Strontium diiron arsenide - HT', 'Strontium diiron arsenide', 'Strontium diiron diarsenide', 'Iron strontium arsenide (2/1/2)', 'Strontium diiron arsenide - LT']}",-30.61898897,-6.123797794,-0.5342483613333335,"['xas', 'elasticity', 'bandstructure']",True,"[182330, 181993, 610527, 163209, 163208, 163869]",True,2021-05-12 10:56:20.740000,NM,5,8,mp-4488,,Sr(FeAs)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Fe': 2.0, 'As': 2.0}",GGA,mp-4488,"['mp-906356', 'mp-920135', 'mp-919110', 'mp-4488', 'mp-1439153', 'mp-1672865', 'mp-1873948', 'mp-1592272']",0.0029206,"{'Sr': 1.0, 'Fe': 2.0, 'As': 2.0}",91.7377588211838,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",3.183640016422098e-05,0.0029206,0,0.0029206,MP,data/source/MP/cleaned/cifs/MP-mp-4488.cif,True,,data/final/MP/graphs/As2Fe1.84Ni0.16Sr1-MP-mp-4488-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Sn1Ta3,1,0.0,2.0,False,Sn2Ta6,Sn2Ta6,6.6925,Other,True,Sn25Ta75,Sn-Ta,2,Supercon,Sn1Ta3,MP-mp-30871,Ta6Sn2,Sn-Ta,Sn25Ta75,P m -3 n,cubic,5.325375,5.325375,5.325375,data/final/MP/cifs/Sn1Ta3-MP-mp-30871.cif,data/source/MP/raw/cifs/mp-30871.cif,mp-30871,0.0,,2014-02-24 02:29:24,14.54767435761192,10.17188/1205224,"@misc{osti_1205224,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ta3Sn (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1205224"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696644'}},0.0,7.11922506,520.0,-79.42493136,-9.92811642,{'tags': ['Tin tantalum (1/3)']},-79.42493136,-9.92811642,-0.0323902337500019,"['xas', 'elasticity', 'bandstructure']",True,[106076],True,2021-05-12 10:56:18.721000,NM,8,8,mp-30871,,Ta3Sn,"{'functional': 'PBE', 'labels': ['Ta_pv', 'Sn_d'], 'pot_type': 'paw'}","{'Ta': 3.0, 'Sn': 1.0}",GGA,mp-30871,"['mp-942099', 'mp-932839', 'mp-943103', 'mp-30871', 'mp-1428765', 'mp-1696644', 'mp-1780640', 'mp-1588383']",0.000628,"{'Ta': 6.0, 'Sn': 2.0}",151.02560544966212,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",8.316470549880586e-06,0.000628,0,0.001256,MP,data/source/MP/cleaned/cifs/MP-mp-30871.cif,False,,data/final/MP/graphs/Sn1Ta3-MP-mp-30871.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Co1Ge3Pr1,1,0.0,1.0,True,Co1Ge3Pr1,Co1Ge3Pr1,0.0,Heavy_fermion,True,Co20Ge60Pr20,Co-Ge-Pr,3,Supercon,Pr1Co1Ge3,MP-mp-13125,Pr1Co1Ge3,Co-Ge-Pr,Co20Ge60Pr20,I 4 m m,tetragonal,4.340507999040246,4.340507999040246,5.841250640000001,data/final/MP/cifs/Co1Ge3Pr1-MP-mp-13125.cif,data/source/MP/raw/cifs/mp-13125.cif,mp-13125,0.0,,2011-05-28 12:56:28,7.408758465831841,10.17188/1189399,"@misc{osti_1189399,
    author = ""Persson, Kristin"",
    title = ""Materials Data on PrCoGe3 (SG:107) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189399"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697620'}},0.0,4.87678305,520.0,-28.60567876,-5.721135752,{'tags': ['Praseodymium cobalt germanide (1/1/3)']},-28.60567876,-5.721135752,-0.5694756509999997,"['xas', 'bandstructure']",True,"[161875, 623567]",True,2021-05-12 10:56:53.126000,NM,5,9,mp-13125,,PrCoGe3,"{'functional': 'PBE', 'labels': ['Pr_3', 'Co', 'Ge_d'], 'pot_type': 'paw'}","{'Pr': 1.0, 'Co': 1.0, 'Ge': 3.0}",GGA,mp-13125,"['mp-1001465', 'mp-1001221', 'mp-915061', 'mp-13125', 'mp-1438377', 'mp-1697620', 'mp-1798161', 'mp-1007956', 'mp-1593855']",0.0027718,"{'Pr': 1.0, 'Co': 1.0, 'Ge': 3.0}",93.6335293986992,[],NM,False,107,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",2.960264360213797e-05,0.0027718,0,0.0027718,MP,data/source/MP/cleaned/cifs/MP-mp-13125.cif,False,,data/final/MP/graphs/Co1Ge3Pr1-MP-mp-13125.json,0,True,4mm,0,0,0,0,5,0,0,0,0,1,0,1.0,False
C0.5N0.36Nb1,3,0.1129032258064516,2.0,False,C1N0.72Nb2,C1N1Nb2,15.6,Other,True,C26.882N19.355Nb53.763,C-N-Nb,3,Supercon,Nb1C0.5N0.36,MP-mp-1220725,Nb2C1N1,C-N-Nb,C25N25Nb50,R -3 m,trigonal,3.176830066338471,3.176830066338471,5.50452744,data/final/MP/cifs/C0.5N0.36Nb1-MP-mp-1220725-synth_doped.cif,data/source/MP/raw/cifs/mp-1220725.cif,mp-1220725,0.0,,2019-01-12 21:31:38.750000,7.754501067535733,,,{'GGA': {'task_id': 'mp-1766607'}},0.0753444154166675,7.65744358,520.0,-40.59990484,-10.14997621,{'tags': []},-40.59990484,-10.14997621,-0.7987547837499989,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,4,5,mp-1220725,,Nb2CN,"{'functional': 'PBE', 'labels': ['Nb_pv', 'C', 'N'], 'pot_type': 'paw'}","{'Nb': 2.0, 'C': 1.0, 'N': 1.0}",GGA,mp-1220725,"['mp-1220725', 'mp-1422536', 'mp-1766607', 'mp-1794614', 'mp-1612365']",0.0016814,"{'Nb': 2.0, 'C': 1.0, 'N': 1.0}",45.36104297370486,[],NM,False,166,0,"[0, 0, 0, 0]",3.706704894273889e-05,0.0016814,0,0.0016814,MP,data/source/MP/cleaned/cifs/MP-mp-1220725.cif,True,,data/final/MP/graphs/C0.5N0.36Nb1-MP-mp-1220725-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Au0.35Te0.65,2,0.0333333333333332,3.0,False,Au1.05Te1.95,Au1Te2,1.58,Other,True,Au35Te65,Au-Te,2,Supercon,Au0.35Te0.65,MP-mp-567525,Te2Au1,Au-Te,Au33.333Te66.667,C 1 2/m 1,monoclinic,4.228509889999999,4.228509889999999,5.15701111,data/final/MP/cifs/Au0.35Te0.65-MP-mp-567525-synth_doped.cif,data/source/MP/raw/cifs/mp-567525.cif,mp-567525,0.0,,2014-02-16 11:21:24,9.349466095623004,10.17188/1272560,"@misc{osti_1272560,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Te2Au (SG:12) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1272560"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668681'}},0.0177770462499995,6.52239204,520.0,-9.77688527,-3.2589617566666664,"{'tags': ['Gold telluride (1/2)', 'Gold ditelluride', 'Calaverite, average structure', 'High pressure experimental phase', 'Calaverite']}",-9.77688527,-3.2589617566666664,-0.3534672899999993,"['xas', 'bandstructure']",True,"[64681, 64682, 72435, 659325, 151373, 72434, 72437, 66625, 66626, 612390, 65105, 659328, 65104, 659326, 72438, 72436, 659327, 72439]",True,2021-05-12 10:57:23.123000,NM,3,7,mp-567525,,Te2Au,"{'functional': 'PBE', 'labels': ['Te', 'Au'], 'pot_type': 'paw'}","{'Te': 2.0, 'Au': 1.0}",GGA,mp-567525,"['mp-567525', 'mp-1441005', 'mp-1668681', 'mp-1799624', 'mp-1934226', 'mp-1595493', 'mp-1592789']",0.0002727,"{'Te': 2.0, 'Au': 1.0}",80.30835608746618,[],NM,False,12,0,"[0, 0, 0]",3.3956615884777227e-06,0.0002727,0,0.0002727,MP,data/source/MP/cleaned/cifs/MP-mp-567525.cif,True,,data/final/MP/graphs/Au0.35Te0.65-MP-mp-567525-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
Cu8La2Sr6O16,1,0.0,1.0,True,Cu8La2Sr6O16,Cu8La2Sr6O16,0.0,Cuprate,True,Cu25La6.25Sr18.75O50,Cu-La-Sr-O,4,Supercon,La2Sr6Cu8O16,MP-mp-1218623,Sr6La2Cu8O16,Cu-La-Sr-O,Cu25La6.25Sr18.75O50,P m c 21,orthorhombic,3.666652,11.057815,11.144372,data/final/MP/cifs/Cu8La2Sr6O16-MP-mp-1218623.cif,data/source/MP/raw/cifs/mp-1218623.cif,mp-1218623,0.0,,2019-01-12 19:45:38.157000,5.761955386763951,,,,0.0280249943750003,4.54929654,520.0,-191.46129931,-5.9831656034375,{'tags': []},-191.46129931,-5.9831656034375,-2.202602966875,[],False,[],True,2021-05-12 11:00:42.526000,NM,32,3,mp-1218623,oxide,Sr3La(CuO2)4,"{'functional': 'PBE', 'labels': ['Sr_sv', 'La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 3.0, 'La': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-1218623,"['mp-1218623', 'mp-1355489', 'mp-1822555']",0.00092775,"{'Sr': 6.0, 'La': 2.0, 'Cu': 8.0, 'O': 16.0}",451.8503401044033,[],NM,False,26,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.106448165052334e-06,0.00092775,0,0.0018555,MP,data/source/MP/cleaned/cifs/MP-mp-1218623.cif,False,,data/final/MP/graphs/Cu8La2Sr6O16-MP-mp-1218623.json,0,True,mm2,0,0,0,6,0,0,0,1,0,0,0,1.0,False
Ca1Pt1Si3,1,0.0,1.0,True,Ca1Pt1Si3,Ca1Pt1Si3,2.3,Other,True,Ca20Pt20Si60,Ca-Pt-Si,3,Supercon,Ca1Pt1Si3,MP-mp-1069604,Ca1Si3Pt1,Ca-Pt-Si,Ca20Pt20Si60,I 4 m m,tetragonal,4.238777998300379,4.238777998300379,5.82355375,data/final/MP/cifs/Ca1Pt1Si3-MP-mp-1069604.cif,data/source/MP/raw/cifs/mp-1069604.cif,mp-1069604,0.0,,2018-03-22 01:21:27,5.912420270718709,,,{'GGA': {'task_id': 'mp-1674394'}},0.0,7.20231954,520.0,-27.56942824,-5.5138856480000005,{'tags': ['Calcium platinum silicide (1/1/3)']},-27.56942824,-5.5138856480000005,-0.6007957180000005,['bandstructure'],True,"[180963, 185378, 180964, 181448]",True,2021-05-12 10:58:14.654000,NM,5,20,mp-1069604,,CaSi3Pt,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Si', 'Pt'], 'pot_type': 'paw'}","{'Ca': 1.0, 'Si': 3.0, 'Pt': 1.0}",GGA,mp-1069604,"['mp-1069605', 'mp-1069617', 'mp-1069645', 'mp-1069649', 'mp-1069735', 'mp-1069699', 'mp-1069604', 'mp-1069623', 'mp-1069721', 'mp-1070371', 'mp-1070399', 'mp-1070428', 'mp-1437983', 'mp-1674394', 'mp-1782983', 'mp-1588395', 'mp-1069642', 'mp-1069647', 'mp-1069744', 'mp-1070420']",0.0008265,"{'Ca': 1.0, 'Si': 3.0, 'Pt': 1.0}",89.71062163351527,[],NM,False,107,0,"[0, 0, 0, 0, 0]",9.212955890289195e-06,0.0008265,0,0.0008265,MP,data/source/MP/cleaned/cifs/MP-mp-1069604.cif,False,,data/final/MP/graphs/Ca1Pt1Si3-MP-mp-1069604.json,0,True,4mm,0,0,0,0,5,0,0,0,0,1,0,1.0,False
Al0.95Ge0.05Nb3,2,0.025,2.0,False,Al1.9Ge0.1Nb6,Al2Nb6,20.0,Other,True,Al23.75Ge1.25Nb75,Al-Ge-Nb,3,Supercon,Nb3Al0.95Ge0.05,MP-mp-796,Nb6Al2,Al-Nb,Al25Nb75,P m -3 n,cubic,5.215254,5.215254,5.215254,data/final/MP/cifs/Al0.95Ge0.05Nb3-MP-mp-796-synth_doped.cif,data/source/MP/raw/cifs/mp-796.cif,mp-796,0.0,,2011-05-13 16:07:37,7.157298025966356,,,{'GGA': {'task_id': 'mp-1686893'}},0.0460773865000003,5.52947534,520.0,-69.48918494,-8.6861481175,"{'tags': ['Aluminium niobium (1/3)', 'Niobium aluminide (3/1)', 'Aluminum niobium (1/3)']}",-69.48918494,-8.6861481175,-0.1737753800000003,"['bandstructure', 'elasticity']",True,"[608675, 608654, 608688, 608668, 608669, 608685, 608676, 608683, 58014, 608657, 107856, 608655, 608666, 608691, 608656, 608665, 608673, 608653, 608661]",True,2021-05-12 10:56:31.128000,NM,8,10,mp-796,,Nb3Al,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Al': 1.0}",GGA,mp-796,"['mp-911586', 'mp-927906', 'mp-796', 'mp-927472', 'mp-1260512', 'mp-1440919', 'mp-1686893', 'mp-1927652', 'mp-1591599', 'mp-1587739']",0.16323955,"{'Nb': 6.0, 'Al': 2.0}",141.8490379078192,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0023015954483396,0.16323955,0,0.3264791,MP,data/source/MP/cleaned/cifs/MP-mp-796.cif,True,,data/final/MP/graphs/Al0.95Ge0.05Nb3-MP-mp-796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Cs2Mo6Se6,1,0.0,1.0,True,Cs2Mo6Se6,Cs2Mo6Se6,0.0,Chevrel,True,Cs14.286Mo42.857Se42.857,Cs-Mo-Se,3,Supercon,Cs2Mo6Se6,MP-mp-1104663,Cs2Mo6Se6,Cs-Mo-Se,Cs14.286Mo42.857Se42.857,P 63/m,hexagonal,4.53725,10.100487998147866,10.10048696,data/final/MP/cifs/Cs2Mo6Se6-MP-mp-1104663.cif,data/source/MP/raw/cifs/mp-1104663.cif,mp-1104663,0.4912999999999998,,2018-07-18 22:43:48,5.447992520807047,,,{'GGA': {'task_id': 'mp-1669216'}},0.0,3.8020581,520.0,-98.00443412,-7.000316722857143,"{'tags': ['CsMo3Se3', 'Cesium molybdenum selenide (1/3/3)', 'TlFe3Te3', 'Chevrel phase']}",-98.00443412,-7.000316722857143,-0.9283073092803258,['bandstructure'],True,"[604515, 603826, 603651]",True,2021-05-12 10:58:20.361000,NM,14,8,mp-1104663,,Cs(MoSe)3,"{'functional': 'PBE', 'labels': ['Cs_sv', 'Mo_pv', 'Se'], 'pot_type': 'paw'}","{'Cs': 1.0, 'Mo': 3.0, 'Se': 3.0}",GGA,mp-1104663,"['mp-1104663', 'mp-1104749', 'mp-1105279', 'mp-1184127', 'mp-1431936', 'mp-1669216', 'mp-1841204', 'mp-1603132']",0.00461395,"{'Cs': 2.0, 'Mo': 6.0, 'Se': 6.0}",400.8740977960575,[],NM,False,176,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",2.301944688053815e-05,0.00461395,0,0.0092279,MP,data/source/MP/cleaned/cifs/MP-mp-1104663.cif,False,,data/final/MP/graphs/Cs2Mo6Se6-MP-mp-1104663.json,0,True,6/m,0,3,0,0,0,0,0,1,0,0,0,1.0,False
Bi2Ca0.95Ce0.05Cu2Sr2O8,2,0.0066666666666666,2.0,False,Bi4Ca1.9Ce0.1Cu4Sr4O16,Bi4Ca2Cu4Sr4O16,80.0,Cuprate,True,Bi13.333Ca6.333Ce0.333Cu13.333Sr13.333O53.333333333333336,Bi-Ca-Ce-Cu-Sr-O,6,Supercon,Bi2Sr2Ca0.95Ce0.05Cu2O8,MP-mp-1218930,Sr4Ca2Cu4Bi4O16,Bi-Ca-Cu-Sr-O,Bi13.333Ca6.667Cu13.333Sr13.333O53.333333333333336,C c c 2,orthorhombic,5.417115,5.472898000129128,16.11398919,data/final/MP/cifs/Bi2Ca0.95Ce0.05Cu2Sr2O8-MP-mp-1218930-synth_doped.cif,data/source/MP/raw/cifs/mp-1218930.cif,mp-1218930,0.0,,2019-01-12 20:01:06.544000,6.266668983881059,,,,0.039252223722225,4.51768334,520.0,-173.15021002,-5.771673667333333,{'tags': []},-173.15021002,-5.771673667333333,-2.074956548222222,[],False,[],True,2021-05-12 11:00:42.526000,NM,30,3,mp-1218930,oxide,Sr2CaCu2(BiO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",GGA,mp-1218930,"['mp-1218930', 'mp-1359698', 'mp-1817714']",0.00011165,"{'Sr': 4.0, 'Ca': 2.0, 'Cu': 4.0, 'Bi': 4.0, 'O': 16.0}",470.7976286073367,[],NM,False,37,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.743014544498498e-07,0.00011165,0,0.0002233,MP,data/source/MP/cleaned/cifs/MP-mp-1218930.cif,True,,data/final/MP/graphs/Bi2Ca0.95Ce0.05Cu2Sr2O8-MP-mp-1218930-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Nb1Rh3,1,0.0,6.0,False,Nb6Rh18,Nb6Rh18,0.0,Other,True,Nb25Rh75,Nb-Rh,2,Supercon,Nb1Rh3,MP-mp-1191559,Nb6Rh18,Nb-Rh,Nb25Rh75,P 63/m m c,hexagonal,5.544780003332605,5.54477971,13.507159,data/final/MP/cifs/Nb1Rh3-MP-mp-1191559.cif,data/source/MP/raw/cifs/mp-1191559.cif,mp-1191559,0.0,,2019-01-11 21:48:12.924000,11.126422364979316,,,{'GGA': {'task_id': 'mp-1688000'}},0.0,6.492902,520.0,-205.36611675,-8.55692153125,{'tags': ['Rhodium niobium (3/1)']},-205.36611675,-8.55692153125,-0.5083643687500002,['bandstructure'],True,[645261],True,2021-05-12 10:58:35.561000,NM,24,5,mp-1191559,,NbRh3,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Rh_pv'], 'pot_type': 'paw'}","{'Nb': 1.0, 'Rh': 3.0}",GGA,mp-1191559,"['mp-1191559', 'mp-1433087', 'mp-1688000', 'mp-1836865', 'mp-1612083']",0.0001613333333333,"{'Nb': 6.0, 'Rh': 18.0}",359.63607729624965,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.69160982757192e-06,0.0001613333333333,0,0.000968,MP,data/source/MP/cleaned/cifs/MP-mp-1191559.cif,False,,data/final/MP/graphs/Nb1Rh3-MP-mp-1191559.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Er1Fe2Ge2,1,0.0,1.0,True,Er1Fe2Ge2,Er1Fe2Ge2,0.0,Other,True,Er20Fe40Ge40,Er-Fe-Ge,3,Supercon,Er1Fe2Ge2,MP-mp-5451,Er1Fe2Ge2,Er-Fe-Ge,Er20Fe40Ge40,I 4/m m m,tetragonal,3.9536420006449102,3.9536420006449102,5.81906944,data/final/MP/cifs/Er1Fe2Ge2-MP-mp-5451.cif,data/source/MP/raw/cifs/mp-5451.cif,mp-5451,0.0,,2011-05-13 12:46:53,8.830491184163773,10.17188/1266987,"@misc{osti_1266987,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Er(FeGe)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1266987"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687750'}},0.0,4.80216727,520.0,-32.99591036,-6.5991820720000005,{'tags': ['Erbium iron germanide (1/2/2)']},-32.99591036,-6.5991820720000005,-0.4484237880000009,"['xas', 'elasticity', 'bandstructure']",True,"[260818, 260817, 630455, 656393, 260816]",True,2021-05-12 10:56:22.739000,FM,5,8,mp-5451,,Er(FeGe)2,"{'functional': 'PBE', 'labels': ['Er_3', 'Fe_pv', 'Ge_d'], 'pot_type': 'paw'}","{'Er': 1.0, 'Fe': 2.0, 'Ge': 2.0}",GGA,mp-5451,"['mp-1001942', 'mp-1008336', 'mp-5451', 'mp-1439701', 'mp-1687750', 'mp-1799986', 'mp-1012626', 'mp-1593054']",1.8404673,"{'Er': 1.0, 'Fe': 2.0, 'Ge': 2.0}",79.77459158194732,[],FM,True,139,1,"[-0.0, 1.0, 1.0, 0.0, 0.0]",0.023070845785646,1.8404673,2,1.8404673,MP,data/source/MP/cleaned/cifs/MP-mp-5451.cif,False,,data/final/MP/graphs/Er1Fe2Ge2-MP-mp-5451.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Gd0.1Pd2Sn1Y0.9,2,0.0499999999999999,1.0,True,Gd0.1Pd2Sn1Y0.9,Pd2Sn1Y1,0.0,Other,True,Gd2.5Pd50Sn25Y22.5,Gd-Pd-Sn-Y,4,Supercon,Pd2Y0.9Gd0.1Sn1,MP-mp-5538,Y1Sn1Pd2,Pd-Sn-Y,Pd50Sn25Y25,F m -3 m,cubic,4.81595014,4.81595014,4.81595014,data/final/MP/cifs/Gd0.1Pd2Sn1Y0.9-MP-mp-5538-synth_doped.cif,data/source/MP/raw/cifs/mp-5538.cif,mp-5538,0.0,,2011-05-13 01:04:13,8.839720826473608,10.17188/1267618,"@misc{osti_1267618,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YSnPd2 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1267618"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687523'}},0.0,6.33853657,520.0,-24.32859047,-6.0821476175,"{'tags': ['Palladium yttrium stannide (2/1/1)', 'Palladium tin yttrium (2/1/1)']}",-24.32859047,-6.0821476175,-0.873195970416667,"['xas', 'elasticity', 'bandstructure']",True,"[105699, 648949, 105700, 424011, 648950]",True,2021-05-12 10:56:22.739000,NM,4,12,mp-5538,,YSnPd2,"{'functional': 'PBE', 'labels': ['Y_sv', 'Sn_d', 'Pd'], 'pot_type': 'paw'}","{'Y': 1.0, 'Sn': 1.0, 'Pd': 2.0}",GGA,mp-5538,"['mp-1008093', 'mp-1001657', 'mp-5538', 'mp-1065654', 'mp-1065644', 'mp-1065683', 'mp-1439031', 'mp-1687523', 'mp-1801498', 'mp-1012418', 'mp-1593849', 'mp-1065696']",0.0001592,"{'Y': 1.0, 'Sn': 1.0, 'Pd': 2.0}",78.98251295612837,[],NM,False,225,0,"[0, 0, 0, 0]",2.015636044505563e-06,0.0001592,0,0.0001592,MP,data/source/MP/cleaned/cifs/MP-mp-5538.cif,True,,data/final/MP/graphs/Gd0.1Pd2Sn1Y0.9-MP-mp-5538-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ge1Te1,1,0.0,1.0,True,Ge1Te1,Ge1Te1,0.178,Other,True,Ge50Te50,Ge-Te,2,Supercon,Ge1Te1,MP-mp-938,Ge1Te1,Ge-Te,Ge50Te50,R 3 m,trigonal,4.2306661843580935,4.2306661843580935,4.37516386,data/final/MP/cifs/Ge1Te1-MP-mp-938.cif,data/source/MP/raw/cifs/mp-938.cif,mp-938,0.8215000000000003,,2011-05-12 18:44:01,5.9096523360046005,10.17188/1272924,"@misc{osti_1272924,
    author = ""Persson, Kristin"",
    title = ""Materials Data on GeTe (SG:160) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1272924"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668824'}},0.0,5.39520466,520.0,-7.95077254,-3.97538627,"{'tags': ['Germanium telluride', 'Germanium telluride (1/1) - alpha', 'Germanium(II) telluride', 'Germanium telluride (1/1)']}",-7.95077254,-3.97538627,-0.3032218774999995,"['piezo', 'xas', 'bandstructure', 'diel', 'elasticity']",True,"[159907, 188458, 56039, 56040, 56041, 659806, 659808, 43202, 655497, 659805, 165414, 56038]",True,2021-05-12 10:56:35.166000,NM,2,20,mp-938,,GeTe,"{'functional': 'PBE', 'labels': ['Ge_d', 'Te'], 'pot_type': 'paw'}","{'Ge': 1.0, 'Te': 1.0}",GGA,mp-938,"['mp-655245', 'mp-655250', 'mp-655231', 'mp-938', 'mp-1057193', 'mp-1057199', 'mp-1057210', 'mp-1060737', 'mp-1060747', 'mp-1060770', 'mp-1141488', 'mp-1119920', 'mp-1440604', 'mp-1668824', 'mp-1790742', 'mp-1863530', 'mp-1595868', 'mp-1596468', 'mp-1057206', 'mp-1060757']",1.27e-05,"{'Ge': 1.0, 'Te': 1.0}",56.264958374993846,[],NM,False,160,0,"[0, 0]",2.257177534080312e-07,1.27e-05,0,1.27e-05,MP,data/source/MP/cleaned/cifs/MP-mp-938.cif,False,,data/final/MP/graphs/Ge1Te1-MP-mp-938.json,0,True,3m,0,0,0,0,0,0,5,1,0,0,0,1.0,False
Ca3Ir4Sn13,1,0.0,2.0,False,Ca6Ir8Sn26,Ca6Ir8Sn26,6.95,Other,True,Ca15Ir20Sn65,Ca-Ir-Sn,3,Supercon,Ca3Ir4Sn13,MP-mp-1200211,Ca6Sn26Ir8,Ca-Ir-Sn,Ca15Ir20Sn65,P m -3 n,cubic,9.851465,9.851465,9.851465,data/final/MP/cifs/Ca3Ir4Sn13-MP-mp-1200211.cif,data/source/MP/raw/cifs/mp-1200211.cif,mp-1200211,0.0,,2019-01-12 04:39:46.317000,8.448886780919485,,,{'GGA': {'task_id': 'mp-1685886'}},0.0,7.80212759,520.0,-204.50237473,-5.11255936825,"{'tags': ['Calcium iridium stannide (3/4/13)', 'Ca3Ir4Sn13', 'Yb3Rh4Sn13']}",-204.50237473,-5.11255936825,-0.4378115964999999,[],False,[619385],True,2021-05-12 11:00:08.243000,NM,40,3,mp-1200211,,Ca3Sn13Ir4,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Sn_d', 'Ir'], 'pot_type': 'paw'}","{'Ca': 3.0, 'Sn': 13.0, 'Ir': 4.0}",GGA,mp-1200211,"['mp-1200211', 'mp-1368450', 'mp-1685886']",9.185e-05,"{'Ca': 6.0, 'Sn': 26.0, 'Ir': 8.0}",956.0981023115928,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.921350952960391e-07,9.185e-05,0,0.0001837,MP,data/source/MP/cleaned/cifs/MP-mp-1200211.cif,False,,data/final/MP/graphs/Ca3Ir4Sn13-MP-mp-1200211.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Al2Mg2,1,0.0,0.5,False,Al1Mg1,Al1Mg1,0.84,Other,True,Al50Mg50,Al-Mg,2,Supercon,Al2Mg2,MP-mp-1039141,Mg1Al1,Al-Mg,Al50Mg50,P 4/m m m,tetragonal,3.014748,3.014748,4.23242,data/final/MP/cifs/Al2Mg2-MP-mp-1039141.cif,data/source/MP/raw/cifs/mp-1039141.cif,mp-1039141,0.0,,2017-05-31 12:15:27,2.213918844848538,,,{'GGA': {'task_id': 'mp-1675370'}},0.0245434587500028,5.4911394,520.0,-5.34736822,-2.67368411,{'tags': ['intermetallic']},-5.34736822,-2.67368411,-0.0007561699999998,['elasticity'],False,[],True,2021-05-12 10:56:10.715000,NM,2,5,mp-1039141,,MgAl,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Al'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Al': 1.0}",GGA,mp-1039141,"['mp-1039141', 'mp-1437129', 'mp-1675370', 'mp-1773686', 'mp-1791833']",3e-07,"{'Mg': 1.0, 'Al': 1.0}",38.4672189471404,[],NM,False,123,0,"[0, 0]",7.798848167637072e-09,3e-07,0,3e-07,MP,data/source/MP/cleaned/cifs/MP-mp-1039141.cif,False,,data/final/MP/graphs/Al2Mg2-MP-mp-1039141.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Bi2Ca1Cu1.952Ni0.048Sr2O8,2,0.0064,2.0,False,Bi4Ca2Cu3.904Ni0.096Sr4O16,Bi4Ca2Cu4Sr4O16,74.0,Cuprate,True,Bi13.333Ca6.667Cu13.013Ni0.32Sr13.333O53.333333333333336,Bi-Ca-Cu-Ni-Sr-O,6,Supercon,Bi2Sr2Ca1Cu1.952Ni0.048O8,MP-mp-1218930,Sr4Ca2Cu4Bi4O16,Bi-Ca-Cu-Sr-O,Bi13.333Ca6.667Cu13.333Sr13.333O53.333333333333336,C c c 2,orthorhombic,5.417115,5.472898000129128,16.11398919,data/final/MP/cifs/Bi2Ca1Cu1.952Ni0.048Sr2O8-MP-mp-1218930-synth_doped.cif,data/source/MP/raw/cifs/mp-1218930.cif,mp-1218930,0.0,,2019-01-12 20:01:06.544000,6.266668983881059,,,,0.039252223722225,4.51768334,520.0,-173.15021002,-5.771673667333333,{'tags': []},-173.15021002,-5.771673667333333,-2.074956548222222,[],False,[],True,2021-05-12 11:00:42.526000,NM,30,3,mp-1218930,oxide,Sr2CaCu2(BiO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",GGA,mp-1218930,"['mp-1218930', 'mp-1359698', 'mp-1817714']",0.00011165,"{'Sr': 4.0, 'Ca': 2.0, 'Cu': 4.0, 'Bi': 4.0, 'O': 16.0}",470.7976286073367,[],NM,False,37,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.743014544498498e-07,0.00011165,0,0.0002233,MP,data/source/MP/cleaned/cifs/MP-mp-1218930.cif,True,,data/final/MP/graphs/Bi2Ca1Cu1.952Ni0.048Sr2O8-MP-mp-1218930-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Ca0.8Cu2Pr0.2Sr2Tl1O7,3,0.0307692307692307,1.0,True,Ca0.8Cu2Pr0.2Sr2Tl1O7,Ca1Cu2Sr2Tl1O7,58.0,Cuprate,True,Ca6.154Cu15.385Pr1.538Sr15.385Tl7.692O53.84615384615385,Ca-Cu-Pr-Sr-Tl-O,6,Supercon,Tl1Sr2Ca0.8Pr0.2Cu2O7,MP-mp-20824,Sr2Ca1Tl1Cu2O7,Ca-Cu-Sr-Tl-O,Ca7.692Cu15.385Sr15.385Tl7.692O53.84615384615385,P 4/m m m,tetragonal,3.781958,3.781958,12.290585,data/final/MP/cifs/Ca0.8Cu2Pr0.2Sr2Tl1O7-MP-mp-20824-synth_doped.cif,data/source/MP/raw/cifs/mp-20824.cif,mp-20824,0.0,,2014-02-22 14:11:23,6.222853038840967,10.17188/1196027,"@misc{osti_1196027,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr2CaTlCu2O7 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196027"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701359'}},0.0167020139423028,3.36479313,520.0,-72.36482639,-5.566525106923077,{'tags': ['Thallium(III) calcium distrontium dicopper oxide']},-72.36482639,-5.566525106923077,-2.04557354474359,"['xas', 'bandstructure']",True,[74165],True,2021-05-12 10:56:57.051000,NM,13,8,mp-20824,oxide,Sr2CaTlCu2O7,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Tl_d', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ca': 1.0, 'Tl': 1.0, 'Cu': 2.0, 'O': 7.0}",GGA,mp-20824,"['mp-993717', 'mp-992012', 'mp-20824', 'mp-1420602', 'mp-1701359', 'mp-1787898', 'mp-995037', 'mp-1599885']",0.0332603,"{'Sr': 2.0, 'Ca': 1.0, 'Tl': 1.0, 'Cu': 2.0, 'O': 7.0}",175.7947729718531,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0001891995958567,0.0332603,0,0.0332603,MP,data/source/MP/cleaned/cifs/MP-mp-20824.cif,True,,data/final/MP/graphs/Ca0.8Cu2Pr0.2Sr2Tl1O7-MP-mp-20824-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
As2Eu0.73Fe2La0.27,3,0.108,1.0,True,As2Eu0.73Fe2La0.27,As2Eu1Fe2,0.0,Ferrite,True,As40Eu14.6Fe40La5.4,As-Eu-Fe-La,4,Supercon,Eu0.73La0.27Fe2As2,MP-mp-20890,Eu1Fe2As2,As-Eu-Fe,As40Eu20Fe40,I 4/m m m,tetragonal,3.9736679999368567,3.9736679999368567,6.07120609,data/final/MP/cifs/As2Eu0.73Fe2La0.27-MP-mp-20890-synth_doped.cif,data/source/MP/raw/cifs/mp-20890.cif,mp-20890,0.0,,2014-02-21 09:03:25,8.079887417044961,10.17188/1196086,"@misc{osti_1196086,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Eu(FeAs)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196086"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687595'}},0.0,5.69045342,520.0,-39.43180547,-7.886361094,"{'tags': ['High pressure experimental phase', 'Europium diiron diarsenide - HP', 'Europium diiron diarsenide', 'Europium iron arsenide (1/2/2)']}",-39.43180547,-7.886361094,-0.5763016570000005,"['xas', 'bandstructure']",True,"[169689, 169687, 185355, 169691, 163211, 185356, 610431, 169690, 169688, 163210]",True,2021-05-12 10:56:57.051000,FM,5,16,mp-20890,,Eu(FeAs)2,"{'functional': 'PBE', 'labels': ['Eu', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Eu': 1.0, 'Fe': 2.0, 'As': 2.0}",GGA,mp-20890,"['mp-991161', 'mp-993140', 'mp-20890', 'mp-1069324', 'mp-1069480', 'mp-1069596', 'mp-1069907', 'mp-1070115', 'mp-1069978', 'mp-1442076', 'mp-1687595', 'mp-1782260', 'mp-994461', 'mp-1594012', 'mp-1069557', 'mp-1070074']",6.9579645,"{'Eu': 1.0, 'Fe': 2.0, 'As': 2.0}",84.97992844321493,[],FM,True,139,1,"[6.7, -0.0, -0.0, 0.0, 0.0]",0.0818777401613068,6.9579645,1,6.9579645,MP,data/source/MP/cleaned/cifs/MP-mp-20890.cif,True,,data/final/MP/graphs/As2Eu0.73Fe2La0.27-MP-mp-20890-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Co0.8Ga0.2Zr2,3,0.1333333333333333,2.0,False,Co1.6Ga0.4Zr4,Co2Zr4,5.29,Other,True,Co26.667Ga6.667Zr66.667,Co-Ga-Zr,3,Supercon,Zr2Co0.8Ga0.2,MP-mp-628,Zr4Co2,Co-Zr,Co33.333Zr66.667,I 4/m c m,tetragonal,5.27792884001752,5.27792884,5.277928840000001,data/final/MP/cifs/Co0.8Ga0.2Zr2-MP-mp-628-synth_doped.cif,data/source/MP/raw/cifs/mp-628.cif,mp-628,0.0,,2011-05-13 12:16:44,7.17077101131263,10.17188/1278899,"@misc{osti_1278899,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Zr2Co (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278899"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677545'}},0.0,4.51380976,520.0,-49.95120762,-8.325201269999999,"{'tags': ['Cobalt zirconium (1/2)', 'Zirconium cobalt (2/1)']}",-49.95120762,-8.325201269999999,-0.2572949183333328,"['xas', 'elasticity', 'bandstructure']",True,"[625671, 191386, 625688, 102740, 625665]",True,2021-05-12 10:56:27.046000,NM,6,20,mp-628,,Zr2Co,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Co'], 'pot_type': 'paw'}","{'Zr': 2.0, 'Co': 1.0}",GGA,mp-628,"['mp-928347', 'mp-912327', 'mp-928866', 'mp-628', 'mp-1071352', 'mp-1071381', 'mp-1071431', 'mp-1071762', 'mp-1071803', 'mp-1071859', 'mp-1071883', 'mp-1071742', 'mp-1071925', 'mp-1441633', 'mp-1677545', 'mp-1802810', 'mp-1591799', 'mp-1071792', 'mp-1071416', 'mp-1071915']",0.0001226,"{'Zr': 4.0, 'Co': 2.0}",111.79353060019714,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0]",2.1933290654975308e-06,0.0001226,0,0.0002452,MP,data/source/MP/cleaned/cifs/MP-mp-628.cif,True,,data/final/MP/graphs/Co0.8Ga0.2Zr2-MP-mp-628-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Mg1Zn1,1,0.0,2.0,False,Mg2Zn2,Mg2Zn2,0.925,Other,True,Mg50Zn50,Mg-Zn,2,Supercon,Mg1Zn1,MP-mp-978268,Mg2Zn2,Mg-Zn,Mg50Zn50,P m m a,orthorhombic,3.148879,4.656355,4.952332,data/final/MP/cifs/Mg1Zn1-MP-mp-978268.cif,data/source/MP/raw/cifs/mp-978268.cif,mp-978268,0.0,,2015-08-14 13:46:17,4.103245538652447,10.17188/1315883,"@misc{osti_1315883,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MgZn (SG:51) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1315883"",
    place = ""United States"",
    year = ""2016"",
    month = ""9"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1005653'}},0.0198271586092397,3.51790924,520.0,-6.07291868,-1.51822967,{'tags': []},-6.07291868,-1.51822967,-0.0882178399999999,"['xas', 'elasticity', 'bandstructure']",True,[],True,2021-05-12 10:56:37.246000,NM,4,7,mp-978268,,MgZn,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Zn'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Zn': 1.0}",GGA,mp-978268,"['mp-978268', 'mp-1005620', 'mp-978586', 'mp-1005653', 'mp-1415129', 'mp-1800208', 'mp-1010980']",0.0001491,"{'Mg': 2.0, 'Zn': 2.0}",72.61256993646889,[],NM,False,51,0,"[0, 0, 0, 0]",4.106726979377055e-06,0.0001491,0,0.0002982,MP,data/source/MP/cleaned/cifs/MP-mp-978268.cif,False,,data/final/MP/graphs/Mg1Zn1-MP-mp-978268.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Gd0.005In1La2.995,2,0.0024999999999999,1.0,True,Gd0.005In1La2.995,In1La3,8.5,Other,True,Gd0.125In25La74.875,Gd-In-La,3,Supercon,La2.9952Gd0.0048In1,MP-mp-20909,La3In1,In-La,In25La75,P m -3 m,cubic,5.076766,5.076766,5.076766,data/final/MP/cifs/Gd0.005In1La2.995-MP-mp-20909-synth_doped.cif,data/source/MP/raw/cifs/mp-20909.cif,mp-20909,0.0,,2014-02-21 06:52:52,6.7455760598452565,10.17188/1196104,"@misc{osti_1196104,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La3In (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196104"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671685'}},0.0,8.16935076,520.0,-18.73796121,-4.6844903025,"{'tags': ['Indium lanthanum (1/3)', 'Lanthanum indium (3/1)']}",-18.73796121,-4.6844903025,-0.2945640412500001,"['xas', 'bandstructure']",True,"[639844, 51950, 639851, 639840, 603208, 107019]",True,2021-05-12 10:56:57.051000,NM,4,8,mp-20909,,La3In,"{'functional': 'PBE', 'labels': ['La', 'In_d'], 'pot_type': 'paw'}","{'La': 3.0, 'In': 1.0}",GGA,mp-20909,"['mp-906743', 'mp-921394', 'mp-920373', 'mp-20909', 'mp-1476042', 'mp-1671685', 'mp-1778647', 'mp-1590323']",0.0489742,"{'La': 3.0, 'In': 1.0}",130.84629766481785,[],NM,False,221,0,"[0, 0, 0, 0]",0.0003742880071811,0.0489742,0,0.0489742,MP,data/source/MP/cleaned/cifs/MP-mp-20909.cif,True,,data/final/MP/graphs/Gd0.005In1La2.995-MP-mp-20909-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Bi2Ca1Cu2Sr2O8.194,2,0.0119169847746918,1.9526296558457408,False,Bi3.905Ca1.953Cu3.905Sr3.905O16,Bi4Ca2Cu4Sr4O16,92.0,Cuprate,True,Bi13.163Ca6.582Cu13.163Sr13.163O53.92918257206793,Bi-Ca-Cu-Sr-O,5,Supercon,Bi2Sr2Ca1Cu2O8.194,MP-mp-1218930,Sr4Ca2Cu4Bi4O16,Bi-Ca-Cu-Sr-O,Bi13.333Ca6.667Cu13.333Sr13.333O53.333333333333336,C c c 2,orthorhombic,5.417115,5.472898000129128,16.11398919,data/final/MP/cifs/Bi2Ca1Cu2Sr2O8.194-MP-mp-1218930-synth_doped.cif,data/source/MP/raw/cifs/mp-1218930.cif,mp-1218930,0.0,,2019-01-12 20:01:06.544000,6.266668983881059,,,,0.039252223722225,4.51768334,520.0,-173.15021002,-5.771673667333333,{'tags': []},-173.15021002,-5.771673667333333,-2.074956548222222,[],False,[],True,2021-05-12 11:00:42.526000,NM,30,3,mp-1218930,oxide,Sr2CaCu2(BiO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",GGA,mp-1218930,"['mp-1218930', 'mp-1359698', 'mp-1817714']",0.00011165,"{'Sr': 4.0, 'Ca': 2.0, 'Cu': 4.0, 'Bi': 4.0, 'O': 16.0}",470.7976286073367,[],NM,False,37,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.743014544498498e-07,0.00011165,0,0.0002233,MP,data/source/MP/cleaned/cifs/MP-mp-1218930.cif,True,,data/final/MP/graphs/Bi2Ca1Cu2Sr2O8.194-MP-mp-1218930-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Ir4La3Sn13,1,0.0,2.0,False,Ir8La6Sn26,Ir8La6Sn26,2.55,Other,True,Ir20La15Sn65,Ir-La-Sn,3,Supercon,La3Ir4Sn13,MP-mp-1197480,La6Sn26Ir8,Ir-La-Sn,Ir20La15Sn65,P m -3 n,cubic,9.882799,9.882799,9.882799,data/final/MP/cifs/Ir4La3Sn13-MP-mp-1197480.cif,data/source/MP/raw/cifs/mp-1197480.cif,mp-1197480,0.0,,2019-01-12 02:26:57.413000,9.38886739024838,,,,0.0,8.87590658,520.0,-226.5253279,-5.6631331975000005,"{'tags': ['Yb3Rh4Sn13', 'La3Ir4Sn13', 'Lanthanum iridium stannide (3/4/13)']}",-226.5253279,-5.6631331975000005,-0.5488243419999996,[],False,"[640766, 603036]",True,2021-05-12 11:00:01.375000,NM,40,3,mp-1197480,,La3Sn13Ir4,"{'functional': 'PBE', 'labels': ['La', 'Sn_d', 'Ir'], 'pot_type': 'paw'}","{'La': 3.0, 'Sn': 13.0, 'Ir': 4.0}",GGA,mp-1197480,"['mp-1197480', 'mp-1202530', 'mp-1330625']",0.0005224,"{'La': 6.0, 'Sn': 26.0, 'Ir': 8.0}",965.2501723503742,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.0824136891433262e-06,0.0005224,0,0.0010448,MP,data/source/MP/cleaned/cifs/MP-mp-1197480.cif,False,,data/final/MP/graphs/Ir4La3Sn13-MP-mp-1197480.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Co1Ge1U1,1,0.0,4.0,False,Co4Ge4U4,Co4Ge4U4,0.5995,Heavy_fermion,True,Co33.333Ge33.333U33.333,Co-Ge-U,3,Supercon,U1Co1Ge1,MP-mp-20671,U4Co4Ge4,Co-Ge-U,Co33.333Ge33.333U33.333,P n m a,orthorhombic,4.28722,6.693007,7.099451,data/final/MP/cifs/Co1Ge1U1-MP-mp-20671.cif,data/source/MP/raw/cifs/mp-20671.cif,mp-20671,0.0,,2014-02-22 17:09:25,12.050961791187769,10.17188/1195831,"@misc{osti_1195831,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UCoGe (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195831"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696056'}},0.0092126219444441,8.81618313,520.0,-96.12146646,-8.010122205,"{'tags': ['Uranium nickel germanium (1/1/1)', 'Uranium cobalt germanium (1/1/1)', 'Uranium cobalt germanide (1/1/1)', 'Uranium cobalt germanium hydride (1/1/1/0.1)']}",-96.12146646,-8.010122205,-0.3358703183333335,"['xas', 'bandstructure']",True,"[55538, 184392, 184389, 184388]",True,2021-05-12 10:56:57.051000,NM,12,11,mp-20671,,UCoGe,"{'functional': 'PBE', 'labels': ['U', 'Co', 'Ge_d'], 'pot_type': 'paw'}","{'U': 1.0, 'Co': 1.0, 'Ge': 1.0}",GGA,mp-20671,"['mp-921572', 'mp-906970', 'mp-920534', 'mp-20671', 'mp-1102081', 'mp-1102694', 'mp-1103716', 'mp-1433082', 'mp-1696056', 'mp-1832133', 'mp-1602688']",0.006528975,"{'U': 4.0, 'Co': 4.0, 'Ge': 4.0}",203.71444041881864,[],NM,False,62,0,"[0.0, 0.0, 0.0, 0.0, -0.0, -0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0]",0.0001281985702452,0.006528975,0,0.0261159,MP,data/source/MP/cleaned/cifs/MP-mp-20671.cif,False,,data/final/MP/graphs/Co1Ge1U1-MP-mp-20671.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ca0.35Cu2Ga1Sr2Y0.65O7,2,0.023076923076923,2.0,False,Ca0.7Cu4Ga2Sr4Y1.3O14,Ca1Cu4Ga2Sr4Y1O14,27.0,Cuprate,True,Ca2.692Cu15.385Ga7.692Sr15.385Y5O53.84615384615385,Ca-Cu-Ga-Sr-Y-O,6,Supercon,Y0.65Ca0.35Sr2Cu2Ga1O7,MP-mp-1218546,Sr4Ca1Y1Ga2Cu4O14,Ca-Cu-Ga-Sr-Y-O,Ca3.846Cu15.385Ga7.692Sr15.385Y3.846O53.84615384615385,C 1 2 1,monoclinic,5.395410001165968,5.50183153,12.23851722,data/final/MP/cifs/Ca0.35Cu2Ga1Sr2Y0.65O7-MP-mp-1218546-synth_doped.cif,data/source/MP/raw/cifs/mp-1218546.cif,mp-1218546,0.0,,2019-01-12 19:41:46.800000,5.2818649947650655,,,,0.0215927057772509,2.78925142,520.0,-159.54941305,-6.1365158865384615,{'tags': []},-159.54941305,-6.1365158865384615,-2.392803671089744,[],False,[],True,2021-05-12 11:00:42.526000,FM,26,3,mp-1218546,oxide,Sr4CaYGa2(Cu2O7)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Y_sv', 'Ga_d', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 4.0, 'Ca': 1.0, 'Y': 1.0, 'Ga': 2.0, 'Cu': 4.0, 'O': 14.0}",GGA,mp-1218546,"['mp-1218546', 'mp-1379849', 'mp-1841784']",0.4705663,"{'Sr': 4.0, 'Ca': 1.0, 'Y': 1.0, 'Ga': 2.0, 'Cu': 4.0, 'O': 14.0}",344.9071967816306,[],FM,True,5,2,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.1, 0.1, 0.1, 0.1, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0013643272868496,0.4705663,4,0.4705663,MP,data/source/MP/cleaned/cifs/MP-mp-1218546.cif,True,,data/final/MP/graphs/Ca0.35Cu2Ga1Sr2Y0.65O7-MP-mp-1218546-synth_doped.json,0,True,2,0,0,1,0,0,0,0,0,1,0,0,1.0,False
B2Ce0.003La0.997Rh3,2,0.001,1.0,True,B2Ce0.003La0.997Rh3,B2La1Rh3,0.38,Other,True,B33.333Ce0.05La16.617Rh50,B-Ce-La-Rh,4,Supercon,La0.9973Ce0.0027Rh3B2,MP-mp-3465,La1B2Rh3,B-La-Rh,B33.333La16.667Rh50,P 6/m m m,hexagonal,3.13752,5.541107997759512,5.54110861,data/final/MP/cifs/B2Ce0.003La0.997Rh3-MP-mp-3465-synth_doped.cif,data/source/MP/raw/cifs/mp-3465.cif,mp-3465,0.0,,2011-05-13 09:45:31,9.339795548460776,10.17188/1206863,"@misc{osti_1206863,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaB2Rh3 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1206863"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1667941'}},0.0176076749999998,8.40828919,520.0,-44.33565588,-7.38927598,{'tags': ['Lanthanum rhodium boride (1/3/2)']},-44.33565588,-7.38927598,-0.6579902705555547,"['xas', 'bandstructure']",True,"[614645, 614643, 614650, 44431, 614648]",True,2021-05-12 10:57:06.958000,NM,6,8,mp-3465,,LaB2Rh3,"{'functional': 'PBE', 'labels': ['La', 'B', 'Rh_pv'], 'pot_type': 'paw'}","{'La': 1.0, 'B': 2.0, 'Rh': 3.0}",GGA,mp-3465,"['mp-926134', 'mp-910270', 'mp-925718', 'mp-3465', 'mp-1438662', 'mp-1667941', 'mp-1781364', 'mp-1593610']",0.0038346,"{'La': 1.0, 'B': 2.0, 'Rh': 3.0}",83.42773028686825,[],NM,False,191,0,"[0, 0, 0, 0, 0, 0]",4.5963134641379263e-05,0.0038346,0,0.0038346,MP,data/source/MP/cleaned/cifs/MP-mp-3465.cif,True,,data/final/MP/graphs/B2Ce0.003La0.997Rh3-MP-mp-3465-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
La0.91Nd0.09Pt1Si1,3,0.0599999999999999,2.0,False,La1.82Nd0.18Pt2Si2,La2Pt2Si2,1.73,Other,True,La30.333Nd3Pt33.333Si33.333,La-Nd-Pt-Si,4,Supercon,La0.91Nd0.09Pt1Si1,MP-mp-1206485,La2Si2Pt2,La-Pt-Si,La33.333Pt33.333Si33.333,I 41 m d,tetragonal,4.277808001286174,4.277808001286175,7.94541446,data/final/MP/cifs/La0.91Nd0.09Pt1Si1-MP-mp-1206485-synth_doped.cif,data/source/MP/raw/cifs/mp-1206485.cif,mp-1206485,0.0,,2019-01-12 09:47:13.211000,8.943745313538361,,,{'GGA': {'task_id': 'mp-1734531'}},0.0,7.90579938,520.0,-39.77896993,-6.629828321666667,{'tags': ['LaPtSi']},-39.77896993,-6.629828321666667,-1.1287520433333331,['bandstructure'],True,[],True,2021-05-12 10:58:37.524000,NM,6,5,mp-1206485,,LaSiPt,"{'functional': 'PBE', 'labels': ['La', 'Si', 'Pt'], 'pot_type': 'paw'}","{'La': 1.0, 'Si': 1.0, 'Pt': 1.0}",GGA,mp-1206485,"['mp-1206485', 'mp-1387492', 'mp-1734531', 'mp-1788111', 'mp-1628393']",1.825e-05,"{'La': 2.0, 'Si': 2.0, 'Pt': 2.0}",134.4491846861766,[],NM,False,109,0,"[0, 0, 0, 0, 0, 0]",2.714780315343388e-07,1.825e-05,0,3.65e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1206485.cif,True,,data/final/MP/graphs/La0.91Nd0.09Pt1Si1-MP-mp-1206485-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,0,0,1,0,1.0,False
Cu1Rh2Se4,1,0.0,2.0,False,Cu2Rh4Se8,Cu2Rh4Se8,3.4625,Other,True,Cu14.286Rh28.571Se57.143,Cu-Rh-Se,3,Supercon,Cu1Rh2Se4,MP-mp-15614,Cu2Rh4Se8,Cu-Rh-Se,Cu14.286Rh28.571Se57.143,F d -3 m,cubic,7.355548180000001,7.35554818,7.35554818,data/final/MP/cifs/Cu1Rh2Se4-MP-mp-15614.cif,data/source/MP/raw/cifs/mp-15614.cif,mp-15614,0.0,,2011-06-05 07:24:52,6.906389184589765,10.17188/1191272,"@misc{osti_1191272,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Cu(RhSe2)2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191272"",
    place = ""United States"",
    year = ""2015"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696606'}},0.0,4.3275914,520.0,-70.96322011,-5.068801436428571,"{'tags': ['Copper rhodium selenide (1/2/4)', 'Copper dirhodium tetraselenide']}",-70.96322011,-5.068801436428571,-0.6511631049107142,"['xas', 'bandstructure']",True,"[41903, 628775, 628777, 602898]",True,2021-05-12 10:56:53.126000,NM,14,8,mp-15614,,Cu(RhSe2)2,"{'functional': 'PBE', 'labels': ['Cu_pv', 'Rh_pv', 'Se'], 'pot_type': 'paw'}","{'Cu': 1.0, 'Rh': 2.0, 'Se': 4.0}",GGA,mp-15614,"['mp-920967', 'mp-942426', 'mp-942820', 'mp-15614', 'mp-1422873', 'mp-1696606', 'mp-1860746', 'mp-1604721']",0.00066735,"{'Cu': 2.0, 'Rh': 4.0, 'Se': 8.0}",281.40391576118253,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.743004362216169e-06,0.00066735,0,0.0013347,MP,data/source/MP/cleaned/cifs/MP-mp-15614.cif,False,,data/final/MP/graphs/Cu1Rh2Se4-MP-mp-15614.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Cr0.8Rh0.2,3,0.1,8.0,False,Cr6.4Rh1.6,Cr6Rh2,0.5,Other,True,Cr80Rh20,Cr-Rh,2,Supercon,Cr0.8Rh0.2,MP-mp-958,Cr6Rh2,Cr-Rh,Cr75Rh25,P m -3 n,cubic,4.63773,4.63773,4.63773,data/final/MP/cifs/Cr0.8Rh0.2-MP-mp-958-synth_doped.cif,data/source/MP/raw/cifs/mp-958.cif,mp-958,0.0,,2011-05-14 15:38:07,8.61954536112071,10.17188/1313350,"@misc{osti_1313350,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Cr3Rh (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1313350"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697049'}},0.113421036666665,6.94723457,520.0,-72.02893318,-9.0036166475,{'tags': ['Chromium rhodium (3/1)']},-72.02893318,-9.0036166475,0.0772459225000012,"['xas', 'bandstructure']",True,"[626569, 626570]",True,2021-05-12 10:57:55.580000,FM,8,8,mp-958,,Cr3Rh,"{'functional': 'PBE', 'labels': ['Cr_pv', 'Rh_pv'], 'pot_type': 'paw'}","{'Cr': 3.0, 'Rh': 1.0}",GGA,mp-958,"['mp-958', 'mp-944403', 'mp-943758', 'mp-933553', 'mp-1429787', 'mp-1697049', 'mp-1797860', 'mp-1588324']",0.69366955,"{'Cr': 6.0, 'Rh': 2.0}",99.75079914067096,[],FM,True,223,1,"[0.2, 0.2, 0.2, 0.2, 0.2, 0.2, 0.0, 0.0]",0.0139080499800662,0.69366955,6,1.3873391,MP,data/source/MP/cleaned/cifs/MP-mp-958.cif,True,,data/final/MP/graphs/Cr0.8Rh0.2-MP-mp-958-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Nb0.69Tc0.31,2,0.0466666666666666,3.0,False,Nb2.07Tc0.93,Nb2Tc1,0.0,Other,True,Nb69Tc31,Nb-Tc,2,Supercon,Nb0.69Tc0.31,MP-mp-1220634,Nb2Tc1,Nb-Tc,Nb66.667Tc33.333,F m m m,orthorhombic,2.8474816447962827,2.84748165,6.93688475,data/final/MP/cifs/Nb0.69Tc0.31-MP-mp-1220634-synth_doped.cif,data/source/MP/raw/cifs/mp-1220634.cif,mp-1220634,0.0,,2019-01-12 21:27:02.721000,9.224802959508164,,,{'GGA': {'task_id': 'mp-1764199'}},0.0,6.05831365,520.0,-30.9172003,-10.305733433333334,{'tags': []},-30.9172003,-10.305733433333334,-0.1179901033333337,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,3,5,mp-1220634,,Nb2Tc,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Tc_pv'], 'pot_type': 'paw'}","{'Nb': 2.0, 'Tc': 1.0}",GGA,mp-1220634,"['mp-1220634', 'mp-1416614', 'mp-1764199', 'mp-1793592', 'mp-1609927']",0.0052341,"{'Nb': 2.0, 'Tc': 1.0}",51.08858992958881,[],NM,False,69,0,"[0, 0, 0]",0.0001024514477149,0.0052341,0,0.0052341,MP,data/source/MP/cleaned/cifs/MP-mp-1220634.cif,True,,data/final/MP/graphs/Nb0.69Tc0.31-MP-mp-1220634-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,0,0,1,1.0,False
B2Ru1Tm1,1,0.0,4.0,False,B8Ru4Tm4,B8Ru4Tm4,0.0,Other,True,B50Ru25Tm25,B-Ru-Tm,3,Supercon,Tm1Ru1B2,MP-mp-1188615,Tm4B8Ru4,B-Ru-Tm,B50Ru25Tm25,P n m a,orthorhombic,5.286564,5.857847,6.31439,data/final/MP/cifs/B2Ru1Tm1-MP-mp-1188615.cif,data/source/MP/raw/cifs/mp-1188615.cif,mp-1188615,0.0,,2019-01-11 19:34:35.633000,9.90587223252964,,,,0.0,6.0339418,520.0,-118.86671867,-7.429169916875,"{'tags': ['TmRuB2', 'Thulium ruthenium boride (1/1/2)', 'LuRuB2']}",-118.86671867,-7.429169916875,-0.6519177618749996,[],False,[615385],True,2021-05-12 10:59:52.436000,NM,16,3,mp-1188615,,TmB2Ru,"{'functional': 'PBE', 'labels': ['Tm_3', 'B', 'Ru_pv'], 'pot_type': 'paw'}","{'Tm': 1.0, 'B': 2.0, 'Ru': 1.0}",GGA,mp-1188615,"['mp-1188615', 'mp-1826876', 'mp-1986226']",0.002691025,"{'Tm': 4.0, 'B': 8.0, 'Ru': 4.0}",195.5432911639047,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.504714549873007e-05,0.002691025,0,0.0107641,MP,data/source/MP/cleaned/cifs/MP-mp-1188615.cif,False,,data/final/MP/graphs/B2Ru1Tm1-MP-mp-1188615.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Cu2Fe1Sr2Y1O7.6,2,0.0407239819004524,1.8420210526315792,False,Cu3.684Fe1.842Sr3.684Y1.842O14,Cu4Fe2Sr4Y2O14,0.0,Cuprate,True,Cu14.706Fe7.353Sr14.706Y7.353O55.88235294117647,Cu-Fe-Sr-Y-O,5,Supercon,Fe1Sr2Y1Cu2O7.6,MP-mvc-771,Sr4Y2Fe2Cu4O14,Cu-Fe-Sr-Y-O,Cu15.385Fe7.692Sr15.385Y7.692O53.84615384615385,I m a 2,orthorhombic,5.428009999807786,5.524618000554629,12.28734132,data/final/MP/cifs/Cu2Fe1Sr2Y1O7.6-MP-mvc-771-synth_doped.cif,data/source/MP/raw/cifs/mvc-771.cif,mvc-771,0.0,,2017-12-02 01:24:31,5.309669206142082,10.17188/1322699,"@misc{osti_1322699,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr2YFeCu2O7 (SG:46) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1322699"",
    place = ""United States"",
    year = ""2014"",
    month = ""9"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-1680490'}},0.0199638557692258,3.37539656,520.0,-169.36345348,-6.51397898,{'tags': []},-169.36345348,-6.51397898,-2.353624607307692,"['xas', 'bandstructure']",True,[],True,2021-05-12 10:58:07.127000,FM,26,8,mvc-771,oxide,Sr2YFeCu2O7,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Y_sv', 'Fe_pv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Y': 1.0, 'Fe': 1.0, 'Cu': 2.0, 'O': 7.0}",GGA+U,mvc-771,"['mvc-771', 'mp-1042547', 'mp-1042574', 'mp-1345426', 'mp-1655657', 'mp-1680490', 'mp-1836639', 'mp-1042570']",4.95893815,"{'Sr': 4.0, 'Y': 2.0, 'Fe': 2.0, 'Cu': 4.0, 'O': 14.0}",349.6910649548837,[],FM,True,5,5,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 4.2, 4.2, -0.0, -0.0, 0.0, 0.0, 0.2, 0.2, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0283618236035844,4.95893815,4,9.9178763,MP,data/source/MP/cleaned/cifs/MP-mvc-771.cif,True,,data/final/MP/graphs/Cu2Fe1Sr2Y1O7.6-MP-mvc-771-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,0,1,0,1.0,False
Ir4Sn13Sr3,1,0.0,2.0,False,Ir8Sn26Sr6,Ir8Sn26Sr6,5.016666667,Other,True,Ir20Sn65Sr15,Ir-Sn-Sr,3,Supercon,Sr3Ir4Sn13,MP-mp-1196422,Sr6Sn26Ir8,Ir-Sn-Sr,Ir20Sn65Sr15,P m -3 n,cubic,9.950479,9.950479,9.950479,data/final/MP/cifs/Ir4Sn13Sr3-MP-mp-1196422.cif,data/source/MP/raw/cifs/mp-1196422.cif,mp-1196422,0.0,,2019-01-12 01:35:47.198000,8.679951136900906,,,{'GGA': {'task_id': 'mp-1678752'}},0.0,7.52991374,520.0,-203.07136587,-5.07678414675,"{'tags': ['Yb3Rh4Sn13', 'Sr3Ir4Sn13', 'Strontium iridium stannide (3/4/13)']}",-203.07136587,-5.07678414675,-0.4494523389999997,[],False,[641056],True,2021-05-12 10:59:59.077000,NM,40,3,mp-1196422,,Sr3Sn13Ir4,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Sn_d', 'Ir'], 'pot_type': 'paw'}","{'Sr': 3.0, 'Sn': 13.0, 'Ir': 4.0}",GGA,mp-1196422,"['mp-1196422', 'mp-1371601', 'mp-1678752']",0.00196895,"{'Sr': 6.0, 'Sn': 26.0, 'Ir': 8.0}",985.2171484414235,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.996986863484471e-06,0.00196895,0,0.0039379,MP,data/source/MP/cleaned/cifs/MP-mp-1196422.cif,False,,data/final/MP/graphs/Ir4Sn13Sr3-MP-mp-1196422.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
La1Ru3Si2,1,0.0,1.0,True,La1Ru3Si2,La1Ru3Si2,7.316,Other,True,La16.667Ru50Si33.333,La-Ru-Si,3,Supercon,La1Ru3Si2,MP-mp-29240,La2Si4Ru6,La-Ru-Si,La16.667Ru50Si33.333,P 6/m m m,hexagonal,3.6088705,5.693851997310984,5.69385245,data/final/MP/cifs/La1Ru3Si2-MP-mp-29240.cif,data/source/MP/raw/cifs/mp-29240.cif,mp-29240,0.0,,2014-02-24 11:42:03,8.166084465628895,10.17188/1203620,"@misc{osti_1203620,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaSi2Ru3 (SG:193) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1203620"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1719509'}},0.0844490616666675,8.56766587,520.0,-95.13702135,-7.9280851125,{'tags': []},-95.13702135,-7.9280851125,-0.6361177608333328,"['xas', 'bandstructure']",True,[],True,2021-05-12 10:57:03.017000,NM,12,10,mp-29240,,LaSi2Ru3,"{'functional': 'PBE', 'labels': ['La', 'Si', 'Ru_pv'], 'pot_type': 'paw'}","{'La': 1.0, 'Si': 2.0, 'Ru': 3.0}",GGA,mp-29240,"['mp-925171', 'mp-924493', 'mp-909454', 'mp-29240', 'mp-1172476', 'mp-1254946', 'mp-1406081', 'mp-1719509', 'mp-1834844', 'mp-1618500']",0.00014945,"{'La': 2.0, 'Si': 4.0, 'Ru': 6.0}",202.6489324904347,[],NM,False,38,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, 0.0, 0.0, 0.0, -0.0]",1.4749645918520125e-06,0.00014945,0,0.0002989,MP,data/source/MP/cleaned/cifs/MP-mp-29240.cif,False,,data/final/MP/graphs/La1Ru3Si2-MP-mp-29240.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
B4Ru4Sm1,1,0.0,4.0,False,B16Ru16Sm4,B16Ru16Sm4,0.0,Other,True,B44.444Ru44.444Sm11.111,B-Ru-Sm,3,Supercon,Sm1Ru4B4,MP-mp-1199012,Sm4B16Ru16,B-Ru-Sm,B44.444Ru44.444Sm11.111,I 41/a c d,tetragonal,7.534709997316075,7.534709997316075,9.23877457,data/final/MP/cifs/B4Ru4Sm1-MP-mp-1199012.cif,data/source/MP/raw/cifs/mp-1199012.cif,mp-1199012,0.0,,2019-01-12 03:41:09.474000,9.267733382087696,,,{'GGA': {'task_id': 'mp-1754417'}},0.0,6.82056525,520.0,-291.15790645,-8.087719623611111,{'tags': ['Samarium ruthenium boride (1/4/4)']},-291.15790645,-8.087719623611111,-0.4728627526851849,['bandstructure'],True,"[615367, 421309]",True,2021-05-12 10:58:37.524000,NM,36,6,mp-1199012,,Sm(BRu)4,"{'functional': 'PBE', 'labels': ['Sm_3', 'B', 'Ru_pv'], 'pot_type': 'paw'}","{'Sm': 1.0, 'B': 4.0, 'Ru': 4.0}",GGA,mp-1199012,"['mp-1199012', 'mp-1200111', 'mp-1411036', 'mp-1754417', 'mp-1814575', 'mp-1621057']",0.000164475,"{'Sm': 4.0, 'B': 16.0, 'Ru': 16.0}",428.5016404178986,[],NM,False,142,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.5353500148993113e-06,0.000164475,0,0.0006579,MP,data/source/MP/cleaned/cifs/MP-mp-1199012.cif,False,,data/final/MP/graphs/B4Ru4Sm1-MP-mp-1199012.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ge0.23V0.77,2,0.04,8.0,False,Ge1.84V6.16,Ge2V6,6.4,Other,True,Ge23V77,Ge-V,2,Supercon,Ge0.23V0.77,MP-mp-1221,V6Ge2,Ge-V,Ge25V75,P m -3 n,cubic,4.766075,4.766075,4.766075,data/final/MP/cifs/Ge0.23V0.77-MP-mp-1221-synth_doped.cif,data/source/MP/raw/cifs/mp-1221.cif,mp-1221,0.0,,2011-05-14 09:51:59,6.9163131280226695,10.17188/1188652,"@misc{osti_1188652,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Ge (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188652"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668516'}},0.0,6.92904659,520.0,-66.42968935,-8.30371116875,"{'tags': ['Vanadium germanium (3/1)', 'Germanium vanadium (1/3)', 'Vanadium germanide (3/1)']}",-66.42968935,-8.30371116875,-0.3350246525000004,"['xas', 'elasticity', 'bandstructure']",True,"[638096, 186004, 638087, 20212, 603983, 638107, 56052, 638103, 638102, 638101, 638083, 638099, 638105, 638106, 638082, 638097, 638090]",True,2021-05-12 10:56:12.755000,FM,8,10,mp-1221,,V3Ge,"{'functional': 'PBE', 'labels': ['V_pv', 'Ge_d'], 'pot_type': 'paw'}","{'V': 3.0, 'Ge': 1.0}",GGA,mp-1221,"['mp-927353', 'mp-911391', 'mp-927792', 'mp-1221', 'mp-1078697', 'mp-1440633', 'mp-1668516', 'mp-1925837', 'mp-1587840', 'mp-1589746']",0.35270295,"{'V': 6.0, 'Ge': 2.0}",108.26363799652664,[],FM,True,223,1,"[0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.0, 0.0]",0.006515630853109,0.35270295,6,0.7054059,MP,data/source/MP/cleaned/cifs/MP-mp-1221.cif,True,,data/final/MP/graphs/Ge0.23V0.77-MP-mp-1221-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Li0.33S2Ta1,3,0.0875160875160875,2.0,False,Li0.66S4Ta2,Li1S4Ta2,0.0,Other,True,Li9.91S60.06Ta30.03,Li-S-Ta,3,Supercon,Li0.33Ta1S2,MP-mp-1222716,Li1Ta2S4,Li-S-Ta,Li14.286S57.143Ta28.571,P -3 m 1,trigonal,3.3596840039043614,3.35968427,12.893463,data/final/MP/cifs/Li0.33S2Ta1-MP-mp-1222716-synth_doped.cif,data/source/MP/raw/cifs/mp-1222716.cif,mp-1222716,0.0,,2019-01-12 23:12:45.039000,6.549270254009936,,,,0.0208887642857211,4.85665521,520.0,-50.48824773,-7.212606818571428,{'tags': []},-50.48824773,-7.212606818571428,-1.475710019404762,[],False,[],True,2021-05-12 11:00:49.659000,NM,7,3,mp-1222716,,Li(TaS2)2,"{'functional': 'PBE', 'labels': ['Li_sv', 'Ta_pv', 'S'], 'pot_type': 'paw'}","{'Li': 1.0, 'Ta': 2.0, 'S': 4.0}",GGA,mp-1222716,"['mp-1222716', 'mp-1397525', 'mp-1804721']",0.0039848,"{'Li': 1.0, 'Ta': 2.0, 'S': 4.0}",126.03672742850776,[],NM,False,164,0,"[0, 0, 0, 0, 0, 0, 0]",3.161618110292741e-05,0.0039848,0,0.0039848,MP,data/source/MP/cleaned/cifs/MP-mp-1222716.cif,True,,data/final/MP/graphs/Li0.33S2Ta1-MP-mp-1222716-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
As2Ba0.78Fe2K0.22,3,0.112,2.0,False,As4Ba1.56Fe4K0.44,As4Ba1Fe4K1,23.5,Ferrite,True,As40Ba15.6Fe40K4.4,As-Ba-Fe-K,4,Supercon,Ba0.78K0.22Fe2As2,MP-mp-1223517,K1Ba1Fe4As4,As-Ba-Fe-K,As40Ba10Fe40K10,C m m m,orthorhombic,5.479027,5.480024002658328,7.13170472,data/final/MP/cifs/As2Ba0.78Fe2K0.22-MP-mp-1223517-synth_doped.cif,data/source/MP/raw/cifs/mp-1223517.cif,mp-1223517,0.0,,2019-01-12 23:54:03.876000,5.87534599912672,,,{'GGA': {'task_id': 'mp-1743010'}},0.0132513644999994,4.21185628,520.0,-59.66633886,-5.966633886,{'tags': []},-59.66633886,-5.966633886,-0.4120461663000007,[],False,[],True,2021-05-12 11:00:52.054000,FM,10,4,mp-1223517,,KBa(FeAs)4,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",GGA,mp-1223517,"['mp-1223517', 'mp-1396881', 'mp-1743010', 'mp-1827585']",0.9947188,"{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",197.6961518155852,[],FM,True,65,1,"[0.0, 0.0, 0.3, 0.3, 0.3, 0.3, 0.0, 0.0, 0.0, 0.0]",0.0050315536790412,0.9947188,4,0.9947188,MP,data/source/MP/cleaned/cifs/MP-mp-1223517.cif,True,,data/final/MP/graphs/As2Ba0.78Fe2K0.22-MP-mp-1223517-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
B6Tb1,1,0.0,1.0,True,B6Tb1,B6Tb1,0.0,Other,True,B85.714Tb14.286,B-Tb,2,Supercon,B6Tb1,MP-mp-12763,Tb1B6,B-Tb,B85.714Tb14.286,P m -3 m,cubic,4.09975,4.09975,4.09975,data/final/MP/cifs/B6Tb1-MP-mp-12763.cif,data/source/MP/raw/cifs/mp-12763.cif,mp-12763,0.0,,2011-05-27 18:55:50,5.392873956484563,10.17188/1189172,"@misc{osti_1189172,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TbB6 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189172"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699596'}},0.0201847799999965,6.61589085,520.0,-47.62324627,-6.803320895714286,"{'tags': ['Terbium boride (1/6)', 'Terbium octahedro-hexaboride']}",-47.62324627,-6.803320895714286,-0.416075649285714,"['xas', 'elasticity', 'bandstructure']",True,"[150622, 615549, 615536, 615547]",True,2021-05-12 10:56:12.755000,NM,7,8,mp-12763,,TbB6,"{'functional': 'PBE', 'labels': ['Tb_3', 'B'], 'pot_type': 'paw'}","{'Tb': 1.0, 'B': 6.0}",GGA,mp-12763,"['mp-1001339', 'mp-1000429', 'mp-12763', 'mp-1476199', 'mp-1699596', 'mp-1800886', 'mp-1007677', 'mp-1590947']",2.51e-05,"{'Tb': 1.0, 'B': 6.0}",68.90839326873439,[],NM,False,221,0,"[0, 0, 0, 0, 0, 0, 0]",3.642517088174302e-07,2.51e-05,0,2.51e-05,MP,data/source/MP/cleaned/cifs/MP-mp-12763.cif,False,,data/final/MP/graphs/B6Tb1-MP-mp-12763.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ga26.5V73.5,2,0.03,0.08,False,Ga2.12V5.88,Ga2V6,13.6,Other,True,Ga26.5V73.5,Ga-V,2,Supercon,Ga26.5V73.5,MP-mp-22568,V6Ga2,Ga-V,Ga25V75,P m -3 n,cubic,4.789645,4.789645,4.789645,data/final/MP/cifs/Ga26.5V73.5-MP-mp-22568-synth_doped.cif,data/source/MP/raw/cifs/mp-22568.cif,mp-22568,0.0,,2014-02-22 11:36:40,6.726541666276222,10.17188/1198793,"@misc{osti_1198793,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Ga (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198793"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686867'}},0.0,5.67452231,520.0,-61.95244347,-7.74405543375,{'tags': ['Gallium vanadium (1/3)']},-61.95244347,-7.74405543375,-0.1741018756249994,"['xas', 'elasticity', 'bandstructure']",True,"[635643, 635628, 635619, 635634, 104021, 635646, 635604, 635610, 635617, 635624, 635626, 635605, 635631, 635625, 635636, 635603, 104020, 635616, 635607]",True,2021-05-12 10:56:16.728000,FM,8,9,mp-22568,,V3Ga,"{'functional': 'PBE', 'labels': ['V_pv', 'Ga_d'], 'pot_type': 'paw'}","{'V': 3.0, 'Ga': 1.0}",GGA,mp-22568,"['mp-941343', 'mp-941663', 'mp-934924', 'mp-22568', 'mp-1440749', 'mp-1686867', 'mp-1804076', 'mp-1593784', 'mp-1595713']",0.09063635,"{'V': 6.0, 'Ga': 2.0}",109.87780534443452,[],FM,True,131,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.0, -0.0, -0.0]",0.0016497662965852,0.09063635,2,0.1812727,MP,data/source/MP/cleaned/cifs/MP-mp-22568.cif,True,,data/final/MP/graphs/Ga26.5V73.5-MP-mp-22568-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Tc2Y1,1,0.0,4.0,False,Tc8Y4,Tc8Y4,8.8,Other,True,Tc66.667Y33.333,Tc-Y,2,Supercon,Tc2Y1,MP-mp-1102030,Y4Tc8,Tc-Y,Tc66.667Y33.333,P 63/m m c,hexagonal,5.384979999077505,5.38498045,8.891158,data/final/MP/cifs/Tc2Y1-MP-mp-1102030.cif,data/source/MP/raw/cifs/mp-1102030.cif,mp-1102030,0.0,,2018-07-18 13:17:21,8.475264447792267,,,{'GGA': {'task_id': 'mp-1698017'}},0.0,6.10427224,520.0,-110.87160494,-9.239300411666669,"{'tags': ['YTc2', 'Technetium yttrium (2/1)', 'MgZn2', 'Friauf-Laves phase, Frank-Kasper phase', 'Yttrium technetium (1/2)']}",-110.87160494,-9.239300411666669,-0.1767301005555547,['bandstructure'],True,"[423220, 653038]",True,2021-05-12 10:58:18.470000,NM,12,6,mp-1102030,,YTc2,"{'functional': 'PBE', 'labels': ['Y_sv', 'Tc_pv'], 'pot_type': 'paw'}","{'Y': 1.0, 'Tc': 2.0}",GGA,mp-1102030,"['mp-1102030', 'mp-1102798', 'mp-1430618', 'mp-1698017', 'mp-1933886', 'mp-1599564']",0.00357385,"{'Y': 4.0, 'Tc': 8.0}",223.28379115113856,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.402345609728378e-05,0.00357385,0,0.0142954,MP,data/source/MP/cleaned/cifs/MP-mp-1102030.cif,False,,data/final/MP/graphs/Tc2Y1-MP-mp-1102030.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Fe1Se0.94,2,0.0309278350515464,2.0,False,Fe2Se1.88,Fe2Se2,8.545,Ferrite,True,Fe51.546Se48.454,Fe-Se,2,Supercon,Fe1Se0.94,MP-mp-20311,Fe2Se2,Fe-Se,Fe50Se50,P 4/n m m,tetragonal,3.688905,3.688905,5.854194,data/final/MP/cifs/Fe1Se0.94-MP-mp-20311-synth_doped.cif,data/source/MP/raw/cifs/mp-20311.cif,mp-20311,0.0,,2013-10-20 07:09:24,5.619828229873189,10.17188/1195438,"@misc{osti_1195438,
    author = ""Persson, Kristin"",
    title = ""Materials Data on FeSe (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195438"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668877'}},0.0,3.48880228,520.0,-25.01949237,-6.2548730925,"{'tags': ['Iron selenide - NN AFM', 'Iron selenide - orthorhombic, LT', 'Iron selenide', 'Iron sulfide', 'Iron selenide (1/1) - nonmagnetic', 'Iron selenide - tetragonal', 'Iron selenide - alpha LT', 'Iron selenide - LT', 'High pressure experimental phase', 'Iron selenide - alpha']}",-25.01949237,-6.2548730925,-0.5079131286718743,"['xas', 'elasticity', 'bandstructure']",True,"[196301, 196298, 196299, 196297, 290701, 165958, 185464, 163561, 169257, 163560, 977900, 169311, 169303, 26889, 166440, 162901, 169283, 165957, 169271, 977903, 169259, 977901, 185465, 165959, 169306, 169267, 163557, 169287, 169297, 169289, 163556, 169299, 163562, 166441, 182544, 163559, 169269, 169263, 169265, 169315, 169255, 166439, 169293, 169313, 163555, 169291, 169301, 165960, 169253, 169295, 169970, 163558, 169285, 169261, 169309]",True,2021-05-12 10:56:14.760000,NM,4,55,mp-20311,,FeSe,"{'functional': 'PBE', 'labels': ['Fe_pv', 'Se'], 'pot_type': 'paw'}","{'Fe': 1.0, 'Se': 1.0}",GGA,mp-20311,"['mp-684656', 'mp-20311', 'mp-1063646', 'mp-1063662', 'mp-1063681', 'mp-1063669', 'mp-1063680', 'mp-1063695', 'mp-1063686', 'mp-1063699', 'mp-1063715', 'mp-1063717', 'mp-1063876', 'mp-1063734', 'mp-1063891', 'mp-1063735', 'mp-1063910', 'mp-1063918', 'mp-1063922', 'mp-1063931', 'mp-1063774', 'mp-1063781', 'mp-1064091', 'mp-1064111', 'mp-1063801', 'mp-1064112', 'mp-1064180', 'mp-1064138', 'mp-1064153', 'mp-1065102', 'mp-1065123', 'mp-1065075', 'mp-1065161', 'mp-1065131', 'mp-1065030', 'mp-1065055', 'mp-1065085', 'mp-1065094', 'mp-1440814', 'mp-1668877', 'mp-1799618', 'mp-1593782', 'mp-1592730', 'mp-1065081', 'mp-1065148', 'mp-1063928', 'mp-1063726', 'mp-1063683', 'mp-1063709', 'mp-1063911', 'mp-1063795', 'mp-1065121', 'mp-1063725', 'mp-1064139', 'mp-1064165']",3.455e-05,"{'Fe': 2.0, 'Se': 2.0}",79.66398961559156,[],NM,False,129,0,"[0, 0, 0, 0]",8.673931638803586e-07,3.455e-05,0,6.91e-05,MP,data/source/MP/cleaned/cifs/MP-mp-20311.cif,True,,data/final/MP/graphs/Fe1Se0.94-MP-mp-20311-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ga1Hf1Ni2,1,0.0,1.0,True,Ga1Hf1Ni2,Ga1Hf1Ni2,1.12,Other,True,Ga25Hf25Ni50,Ga-Hf-Ni,3,Supercon,Ni2Hf1Ga1,MP-mp-3498,Hf1Ga1Ni2,Ga-Hf-Ni,Ga25Hf25Ni50,F m -3 m,cubic,4.29388472,4.29388472,4.29388472,data/final/MP/cifs/Ga1Hf1Ni2-MP-mp-3498.cif,data/source/MP/raw/cifs/mp-3498.cif,mp-3498,0.0,,2011-05-13 05:38:02,10.844734010232928,10.17188/1206914,"@misc{osti_1206914,
    author = ""Persson, Kristin"",
    title = ""Materials Data on HfGaNi2 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1206914"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1674262'}},0.0088062910322594,6.52792079,520.0,-26.77410379,-6.6935259475,{'tags': ['Gallium hafnium nickel (1/1/2)']},-26.77410379,-6.6935259475,-0.5571363893750005,"['xas', 'elasticity', 'bandstructure']",True,"[634320, 103734]",True,2021-05-12 10:56:20.740000,NM,4,8,mp-3498,,HfGaNi2,"{'functional': 'PBE', 'labels': ['Hf_pv', 'Ga_d', 'Ni_pv'], 'pot_type': 'paw'}","{'Hf': 1.0, 'Ga': 1.0, 'Ni': 2.0}",GGA,mp-3498,"['mp-993706', 'mp-991995', 'mp-3498', 'mp-1437561', 'mp-1674262', 'mp-1866022', 'mp-994999', 'mp-1589078']",0.0001747,"{'Hf': 1.0, 'Ga': 1.0, 'Ni': 2.0}",55.98041870536456,[],NM,False,225,0,"[0, 0, 0, 0]",3.1207340716667166e-06,0.0001747,0,0.0001747,MP,data/source/MP/cleaned/cifs/MP-mp-3498.cif,False,,data/final/MP/graphs/Ga1Hf1Ni2-MP-mp-3498.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Cu1Nd2O3.5,1,0.0,2.0,False,Cu2Nd4O7,Cu2Nd4O7,0.0,Cuprate,True,Cu15.385Nd30.769O53.84615384615385,Cu-Nd-O,3,Supercon,Nd2Cu1O3.5,MP-mp-556595,Nd4Cu2O7,Cu-Nd-O,Cu15.385Nd30.769O53.84615384615385,C 1 2/m 1,monoclinic,3.7978860033097055,6.683628989999999,8.52856418,data/final/MP/cifs/Cu1Nd2O3.5-MP-mp-556595.cif,data/source/MP/raw/cifs/mp-556595.cif,mp-556595,1.5356,,2014-03-21 20:28:57,6.923066663379779,10.17188/1269438,"@misc{osti_1269438,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nd4Cu2O7 (SG:12) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1269438"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697187'}},0.0432586082692321,3.64252208,520.0,-96.32942668,-7.409955898461538,{'tags': []},-96.32942668,-7.409955898461538,-3.017824112692307,"['xas', 'bandstructure']",True,[86841],True,2021-05-12 10:57:17.297000,NM,13,5,mp-556595,oxide,Nd4Cu2O7,"{'functional': 'PBE', 'labels': ['Nd_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Nd': 4.0, 'Cu': 2.0, 'O': 7.0}",GGA,mp-556595,"['mp-556595', 'mp-1421995', 'mp-1697187', 'mp-1832488', 'mp-1597914']",0.000782,"{'Nd': 4.0, 'Cu': 2.0, 'O': 7.0}",195.73587866680631,[],NM,False,12,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.995179653962004e-06,0.000782,0,0.000782,MP,data/source/MP/cleaned/cifs/MP-mp-556595.cif,False,,data/final/MP/graphs/Cu1Nd2O3.5-MP-mp-556595.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
Ba2Cu3Lu0.85Pr0.15O7,2,0.023076923076923,1.0,True,Ba2Cu3Lu0.85Pr0.15O7,Ba2Cu3Lu1O7,89.7,Cuprate,True,Ba15.385Cu23.077Lu6.538Pr1.154O53.84615384615385,Ba-Cu-Lu-Pr-O,5,Supercon,Lu0.85Pr0.15Ba2Cu3O7,MP-mp-20324,Ba2Lu1Cu3O7,Ba-Cu-Lu-O,Ba15.385Cu23.077Lu7.692O53.84615384615385,P m m m,orthorhombic,3.818903,3.898469,11.801871,data/final/MP/cifs/Ba2Cu3Lu0.85Pr0.15O7-MP-mp-20324-synth_doped.cif,data/source/MP/raw/cifs/mp-20324.cif,mp-20324,0.0,,2014-02-22 11:14:13,7.109359718686039,10.17188/1195446,"@misc{osti_1195446,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2LuCu3O7 (SG:47) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195446"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1705063'}},0.0403003135096193,3.25942075,520.0,-79.03066785,-6.079282142307692,{'tags': ['Lutetium barium copper oxide (1/2/3/7)']},-79.03066785,-6.079282142307692,-2.1959560480769227,['bandstructure'],True,[161972],True,2021-05-12 10:58:49.477000,NM,13,8,mp-20324,oxide,Ba2LuCu3O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Lu_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Lu': 1.0, 'Cu': 3.0, 'O': 7.0}",GGA,mp-20324,"['mp-991834', 'mp-992281', 'mp-20324', 'mp-1421391', 'mp-1705063', 'mp-1786269', 'mp-993914', 'mp-1597533']",0.0008559,"{'Ba': 2.0, 'Lu': 1.0, 'Cu': 3.0, 'O': 7.0}",175.70477973623184,[],NM,False,47,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.871239139224771e-06,0.0008559,0,0.0008559,MP,data/source/MP/cleaned/cifs/MP-mp-20324.cif,True,,data/final/MP/graphs/Ba2Cu3Lu0.85Pr0.15O7-MP-mp-20324-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
As1Co0.025Fe0.975Li1,2,0.0166666666666666,2.0,False,As2Co0.05Fe1.95Li2,As2Fe2Li2,13.4,Ferrite,True,As33.333Co0.833Fe32.5Li33.333,As-Co-Fe-Li,4,Supercon,Li1Fe0.975Co0.025As1,MP-mp-21471,Li2Fe2As2,As-Fe-Li,As33.333Fe33.333Li33.333,P 4/n m m,tetragonal,3.790629,3.790629,6.107451,data/final/MP/cifs/As1Co0.025Fe0.975Li1-MP-mp-21471-synth_doped.cif,data/source/MP/raw/cifs/mp-21471.cif,mp-21471,0.0,,2013-10-29 11:57:13,5.21140049061562,10.17188/1196927,"@misc{osti_1196927,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LiFeAs (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196927"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686578'}},0.0,4.20304559,520.0,-32.72438031,-5.454063385,"{'tags': ['Lithium iron arsenide', 'Iron lithium arsenide']}",-32.72438031,-5.454063385,-0.4413801444444445,"['xas', 'elasticity']",False,"[290700, 168206, 610480, 169175, 162250, 162056, 166457, 163870]",True,2021-05-12 10:56:16.728000,FM,6,18,mp-21471,,LiFeAs,"{'functional': 'PBE', 'labels': ['Li_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Li': 1.0, 'Fe': 1.0, 'As': 1.0}",GGA,mp-21471,"['mp-917215', 'mp-674647', 'mp-919059', 'mp-920059', 'mp-1071407', 'mp-21471', 'mp-1071451', 'mp-38403', 'mp-33848', 'mp-37001', 'mp-34336', 'mp-36599', 'mp-36822', 'mp-36276', 'mp-1439936', 'mp-1686578', 'mp-1784376', 'mp-1071444']",0.2682074,"{'Li': 2.0, 'Fe': 2.0, 'As': 2.0}",87.75715855248485,[],FM,True,129,1,"[-0.0, -0.0, 0.3, 0.3, -0.0, -0.0]",0.0061124905232567,0.2682074,2,0.5364148,MP,data/source/MP/cleaned/cifs/MP-mp-21471.cif,True,,data/final/MP/graphs/As1Co0.025Fe0.975Li1-MP-mp-21471-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
F0.06Fe1La1P1O0.94,2,0.03,2.0,False,F0.12Fe2La2P2O1.88,Fe2La2P2O2,6.8,Ferrite,True,F1.5Fe25La25P25O23.5,F-Fe-La-P-O,5,Supercon,La1Fe1P1F0.06O0.94,MP-mp-510668,La2Fe2P2O2,Fe-La-P-O,Fe25La25P25O25,P 4/n m m,tetragonal,4.068879,4.068879,9.084981,data/final/MP/cifs/F0.06Fe1La1P1O0.94-MP-mp-510668-synth_doped.cif,data/source/MP/raw/cifs/mp-510668.cif,mp-510668,0.0,,2014-02-26 04:17:37,5.337337070142887,,,{'GGA+U': {'task_id': 'mp-1704083'}},0.3903949226041714,6.29241646,520.0,-55.52669053,-6.94083631625,{'tags': []},-55.52669053,-6.94083631625,-1.734766549583334,"['xas', 'bandstructure']",True,"[162724, 420381, 391428]",True,2021-05-12 10:57:15.388000,FM,8,7,mp-510668,oxide,LaFePO,"{'functional': 'PBE', 'labels': ['La', 'Fe_pv', 'P', 'O'], 'pot_type': 'paw'}","{'La': 1.0, 'Fe': 1.0, 'P': 1.0, 'O': 1.0}",GGA+U,mp-510668,"['mp-542977', 'mp-510668', 'mp-1422599', 'mp-1704083', 'mp-1768909', 'mp-1779846', 'mp-1595432']",3.95130975,"{'La': 2.0, 'Fe': 2.0, 'P': 2.0, 'O': 2.0}",150.40891327693348,[],FM,True,129,1,"[0.0, 0.0, 3.7, 3.7, 0.0, 0.0, 0.0, 0.0]",0.0525408988591631,3.95130975,2,7.9026195,MP,data/source/MP/cleaned/cifs/MP-mp-510668.cif,True,,data/final/MP/graphs/F0.06Fe1La1P1O0.94-MP-mp-510668-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
In0.05Sn0.95Te1,2,0.05,1.0,True,In0.05Sn0.95Te1,Sn1Te1,1.273333333,Other,True,In2.5Sn47.5Te50,In-Sn-Te,3,Supercon,Sn0.95In0.05Te1,MP-mp-1883,Sn1Te1,Sn-Te,Sn50Te50,F m -3 m,cubic,4.53766968,4.53766968,4.53766968,data/final/MP/cifs/In0.05Sn0.95Te1-MP-mp-1883-synth_doped.cif,data/source/MP/raw/cifs/mp-1883.cif,mp-1883,0.6623999999999999,,2011-05-12 18:43:07,6.19081042904143,10.17188/1193534,"@misc{osti_1193534,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SnTe (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1193534"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686906'}},0.0,6.06645058,520.0,-7.72519638,-3.86259819,"{'tags': ['Tin telluride (1/1)', 'Tin telluride']}",-7.72519638,-3.86259819,-0.4971617975000004,"['eos', 'elasticity', 'bandstructure', 'xas']",True,"[52489, 652760, 652744, 652756, 652761, 600865, 652763, 652745, 652742, 604177, 600813, 652741, 601065, 652750, 652755, 652753, 652751, 652749, 652752, 600136, 652754, 652746, 652759]",True,2021-05-12 10:56:14.760000,NM,2,9,mp-1883,,SnTe,"{'functional': 'PBE', 'labels': ['Sn_d', 'Te'], 'pot_type': 'paw'}","{'Sn': 1.0, 'Te': 1.0}",GGA,mp-1883,"['mp-663289', 'mp-655511', 'mp-657302', 'mp-1883', 'mp-1440781', 'mp-1686906', 'mp-1784332', 'mp-1596407', 'mp-1596974']",0.0,"{'Sn': 1.0, 'Te': 1.0}",66.06685541129963,[],NM,False,225,0,"[0, 0]",0.0,0.0,0,0.0,MP,data/source/MP/cleaned/cifs/MP-mp-1883.cif,True,,data/final/MP/graphs/In0.05Sn0.95Te1-MP-mp-1883-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
B4Ho0.745Lu0.255Rh4,3,0.0566666666666666,2.0,False,B8Ho1.49Lu0.51Rh8,B8Ho2Rh8,0.0,Other,True,B44.444Ho8.278Lu2.833Rh44.444,B-Ho-Lu-Rh,4,Supercon,Lu0.255Ho0.745Rh4B4,MP-mp-1189784,Ho2B8Rh8,B-Ho-Rh,B44.444Ho11.111Rh44.444,P 42/n m c,tetragonal,5.334437,5.334437,7.442515,data/final/MP/cifs/B4Ho0.745Lu0.255Rh4-MP-mp-1189784-synth_doped.cif,data/source/MP/raw/cifs/mp-1189784.cif,mp-1189784,0.0,,2019-01-11 20:27:24.618000,9.719214946416653,,,{'GGA': {'task_id': 'mp-1671459'}},0.0130335600000011,6.87149626,520.0,-131.93964083,-7.329980046111111,{'tags': ['Holmium rhodium boride (1/4/4)']},-131.93964083,-7.329980046111111,-0.5791792201851851,['bandstructure'],True,[601533],True,2021-05-12 10:58:33.577000,NM,18,5,mp-1189784,,Ho(BRh)4,"{'functional': 'PBE', 'labels': ['Ho_3', 'B', 'Rh_pv'], 'pot_type': 'paw'}","{'Ho': 1.0, 'B': 4.0, 'Rh': 4.0}",GGA,mp-1189784,"['mp-1189784', 'mp-1430146', 'mp-1671459', 'mp-1786743', 'mp-1604112']",0.00025395,"{'Ho': 2.0, 'B': 8.0, 'Rh': 8.0}",211.7858301043884,[],NM,False,137,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.39817744062319e-06,0.00025395,0,0.0005079,MP,data/source/MP/cleaned/cifs/MP-mp-1189784.cif,True,,data/final/MP/graphs/B4Ho0.745Lu0.255Rh4-MP-mp-1189784-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ce1In5Ir0.736Pt0.264,3,0.0754285714285714,1.0,True,Ce1In5Ir0.736Pt0.264,Ce1In5Ir1,0.0,Heavy_fermion,True,Ce14.286In71.429Ir10.514Pt3.771,Ce-In-Ir-Pt,4,Supercon,Ce1Ir0.736Pt0.264In5,MP-mp-20975,Ce1In5Ir1,Ce-In-Ir,Ce14.286In71.429Ir14.286,P 4/m m m,tetragonal,4.724199,4.724199,7.575801,data/final/MP/cifs/Ce1In5Ir0.736Pt0.264-MP-mp-20975-synth_doped.cif,data/source/MP/raw/cifs/mp-20975.cif,mp-20975,0.0,,2014-02-21 16:15:16,8.902153726103897,10.17188/1196209,"@misc{osti_1196209,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeIn5Ir (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196209"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688300'}},0.0,8.1498488,520.0,-31.20695684,-4.458136691428572,{'tags': ['Cerium iridium indide (1/1/5)']},-31.20695684,-4.458136691428572,-0.3824312307142854,"['xas', 'bandstructure']",True,[150225],True,2021-05-12 10:56:57.051000,FM,7,8,mp-20975,,CeIn5Ir,"{'functional': 'PBE', 'labels': ['Ce', 'In_d', 'Ir'], 'pot_type': 'paw'}","{'Ce': 1.0, 'In': 5.0, 'Ir': 1.0}",GGA,mp-20975,"['mp-919528', 'mp-918523', 'mp-905302', 'mp-20975', 'mp-1300982', 'mp-1688300', 'mp-1832383', 'mp-1591628']",0.1040192,"{'Ce': 1.0, 'In': 5.0, 'Ir': 1.0}",169.077152414387,[],FM,True,123,1,"[0.1, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0006152173638757,0.1040192,1,0.1040192,MP,data/source/MP/cleaned/cifs/MP-mp-20975.cif,True,,data/final/MP/graphs/Ce1In5Ir0.736Pt0.264-MP-mp-20975-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
As1.89Eu1Fe2P0.11,2,0.044,1.0,True,As1.89Eu1Fe2P0.11,As2Eu1Fe2,0.0,Ferrite,True,As37.8Eu20Fe40P2.2,As-Eu-Fe-P,4,Supercon,Eu1Fe2As1.89P0.11,MP-mp-20890,Eu1Fe2As2,As-Eu-Fe,As40Eu20Fe40,I 4/m m m,tetragonal,3.9736679999368567,3.9736679999368567,6.07120609,data/final/MP/cifs/As1.89Eu1Fe2P0.11-MP-mp-20890-synth_doped.cif,data/source/MP/raw/cifs/mp-20890.cif,mp-20890,0.0,,2014-02-21 09:03:25,8.079887417044961,10.17188/1196086,"@misc{osti_1196086,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Eu(FeAs)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196086"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687595'}},0.0,5.69045342,520.0,-39.43180547,-7.886361094,"{'tags': ['High pressure experimental phase', 'Europium diiron diarsenide - HP', 'Europium diiron diarsenide', 'Europium iron arsenide (1/2/2)']}",-39.43180547,-7.886361094,-0.5763016570000005,"['xas', 'bandstructure']",True,"[169689, 169687, 185355, 169691, 163211, 185356, 610431, 169690, 169688, 163210]",True,2021-05-12 10:56:57.051000,FM,5,16,mp-20890,,Eu(FeAs)2,"{'functional': 'PBE', 'labels': ['Eu', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Eu': 1.0, 'Fe': 2.0, 'As': 2.0}",GGA,mp-20890,"['mp-991161', 'mp-993140', 'mp-20890', 'mp-1069324', 'mp-1069480', 'mp-1069596', 'mp-1069907', 'mp-1070115', 'mp-1069978', 'mp-1442076', 'mp-1687595', 'mp-1782260', 'mp-994461', 'mp-1594012', 'mp-1069557', 'mp-1070074']",6.9579645,"{'Eu': 1.0, 'Fe': 2.0, 'As': 2.0}",84.97992844321493,[],FM,True,139,1,"[6.7, -0.0, -0.0, 0.0, 0.0]",0.0818777401613068,6.9579645,1,6.9579645,MP,data/source/MP/cleaned/cifs/MP-mp-20890.cif,True,,data/final/MP/graphs/As1.89Eu1Fe2P0.11-MP-mp-20890-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Al43Nb4Y6,1,0.0,2.0,False,Al86Nb8Y12,Al86Nb8Y12,0.86,Other,True,Al81.132Nb7.547Y11.321,Al-Nb-Y,3,Supercon,Y6Nb4Al43,MP-mp-1207860,Y12Nb8Al86,Al-Nb-Y,Al81.132Nb7.547Y11.321,P 63/m c m,hexagonal,11.142366001789178,11.14236599,17.778938,data/final/MP/cifs/Al43Nb4Y6-MP-mp-1207860.cif,data/source/MP/raw/cifs/mp-1207860.cif,mp-1207860,0.0225999999999997,,2019-01-12 10:53:13.767000,3.588095273876575,,,,0.0,7.0701111,520.0,-516.17329293,-4.869559367264151,"{'tags': ['Y6Nb4Al43', 'Ho6Mo4Al43']}",-516.17329293,-4.869559367264151,-0.3362799799056608,[],False,[],True,2021-05-12 11:00:19.396000,NM,106,2,mp-1207860,,Y6Nb4Al43,"{'functional': 'PBE', 'labels': ['Y_sv', 'Nb_pv', 'Al'], 'pot_type': 'paw'}","{'Y': 6.0, 'Nb': 4.0, 'Al': 43.0}",GGA,mp-1207860,"['mp-1207860', 'mp-1335241']",0.18243015,"{'Y': 12.0, 'Nb': 8.0, 'Al': 86.0}",1911.5747543146472,[],NM,False,193,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0001908689676804,0.18243015,0,0.3648603,MP,data/source/MP/cleaned/cifs/MP-mp-1207860.cif,False,,data/final/MP/graphs/Al43Nb4Y6-MP-mp-1207860.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
B2C1Er1Fe0.035Ni1.965,2,0.0116666666666666,1.0,True,B2C1Er1Fe0.035Ni1.965,B2C1Er1Ni2,7.31,Other,True,B33.333C16.667Er16.667Fe0.583Ni32.75,B-C-Er-Fe-Ni,5,Supercon,Er1Ni1.965Fe0.035B2C1,MP-mp-6098,Er1Ni2B2C1,B-C-Er-Ni,B33.333C16.667Er16.667Ni33.333,I 4/m m m,tetragonal,3.5122880026935177,3.5122880026935173,5.77805085,data/final/MP/cifs/B2C1Er1Fe0.035Ni1.965-MP-mp-6098-synth_doped.cif,data/source/MP/raw/cifs/mp-6098.cif,mp-6098,0.0,,2011-05-13 04:24:02,8.212015229638553,10.17188/1277667,"@misc{osti_1277667,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ErNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277667"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700042'}},0.0,6.72687579,520.0,-41.84324782,-6.973874636666667,{'tags': []},-41.84324782,-6.973874636666667,-0.5216152347222227,"['xas', 'elasticity', 'bandstructure']",True,"[246431, 79576, 56651]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-6098,,ErNi2B2C,"{'functional': 'PBE', 'labels': ['Er_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Er': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6098,"['mp-1006980', 'mp-1000513', 'mp-6098', 'mp-1441533', 'mp-1700042', 'mp-1793903', 'mp-1011723', 'mp-1589040']",0.0020747,"{'Er': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",64.35860973581151,[],NM,False,139,0,"[0.0, -0.0, -0.0, 0.0, 0.0, 0.0]",3.2236557136900987e-05,0.0020747,0,0.0020747,MP,data/source/MP/cleaned/cifs/MP-mp-6098.cif,True,,data/final/MP/graphs/B2C1Er1Fe0.035Ni1.965-MP-mp-6098-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Bi1Mg1,1,0.0,1.0,True,Bi1Mg1,Bi1Mg1,0.7,Other,True,Bi50Mg50,Bi-Mg,2,Supercon,Bi1Mg1,MP-mp-1039305,Mg1Bi1,Bi-Mg,Bi50Mg50,R -3 m,trigonal,3.9150079745346833,3.9150079745346833,4.80804242,data/final/MP/cifs/Bi1Mg1-MP-mp-1039305.cif,data/source/MP/raw/cifs/mp-1039305.cif,mp-1039305,0.0,,2018-05-03 13:34:16,6.877108466466584,,,,0.071162881666666,4.85196552,520.0,-5.67592314,-2.83796157,{'tags': ['intermetallic']},-5.67592314,-2.83796157,-0.0928043899999999,['elasticity'],False,[],True,2021-05-12 10:56:10.715000,NM,2,4,mp-1039305,,MgBi,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Bi'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Bi': 1.0}",GGA,mp-1039305,"['mp-1039305', 'mp-1095003', 'mp-1415562', 'mp-1794861']",0.0018899,"{'Mg': 1.0, 'Bi': 1.0}",56.328836786028006,[],NM,False,166,0,"[0, 0]",3.355119877903776e-05,0.0018899,0,0.0018899,MP,data/source/MP/cleaned/cifs/MP-mp-1039305.cif,False,,data/final/MP/graphs/Bi1Mg1-MP-mp-1039305.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
B2Ho1Ru1,1,0.0,4.0,False,B8Ho4Ru4,B8Ho4Ru4,0.0,Other,True,B50Ho25Ru25,B-Ho-Ru,3,Supercon,Ho1Ru1B2,MP-mp-1181033,Ho4B8Ru4,B-Ho-Ru,B50Ho25Ru25,P n m a,orthorhombic,5.305839,5.901142,6.345615,data/final/MP/cifs/B2Ho1Ru1-MP-mp-1181033.cif,data/source/MP/raw/cifs/mp-1181033.cif,mp-1181033,0.0,,2019-01-11 10:07:47.787000,9.615410322506753,,,{'GGA': {'task_id': 'mp-1672586'}},0.0,6.03947183,520.0,-118.81532539,-7.425957836875,"{'tags': ['Holmium ruthenium boride (1/1/2)', 'LuRuB2', 'HoRuB2']}",-118.81532539,-7.425957836875,-0.6220623202083324,['bandstructure'],True,[614509],True,2021-05-12 10:58:25.879000,NM,16,5,mp-1181033,,HoB2Ru,"{'functional': 'PBE', 'labels': ['Ho_3', 'B', 'Ru_pv'], 'pot_type': 'paw'}","{'Ho': 1.0, 'B': 2.0, 'Ru': 1.0}",GGA,mp-1181033,"['mp-1181033', 'mp-1428893', 'mp-1672586', 'mp-1832810', 'mp-1598671']",7.9375e-05,"{'Ho': 4.0, 'B': 8.0, 'Ru': 4.0}",198.684437904097,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.598011416240129e-06,7.9375e-05,0,0.0003175,MP,data/source/MP/cleaned/cifs/MP-mp-1181033.cif,False,,data/final/MP/graphs/B2Ho1Ru1-MP-mp-1181033.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Co1Ge3Nd1,1,0.0,1.0,True,Co1Ge3Nd1,Co1Ge3Nd1,0.0,Other,True,Co20Ge60Nd20,Co-Ge-Nd,3,Supercon,Nd1Co1Ge3,MP-mp-14625,Nd1Co1Ge3,Co-Ge-Nd,Co20Ge60Nd20,I 4 m m,tetragonal,4.325545997758106,4.325545997758107,5.82596401,data/final/MP/cifs/Co1Ge3Nd1-MP-mp-14625.cif,data/source/MP/raw/cifs/mp-14625.cif,mp-14625,0.0,,2011-05-28 12:36:11,7.536983184134543,10.17188/1190795,"@misc{osti_1190795,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NdCoGe3 (SG:107) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1190795"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704266'}},0.0,4.83549395,520.0,-28.58182517,-5.716365034,"{'tags': ['Neodymium cobalt germanide (1/1/3)', 'Neodymium cobalt germanide']}",-28.58182517,-5.716365034,-0.5672561199999997,"['xas', 'elasticity', 'bandstructure']",True,"[623542, 50359]",True,2021-05-12 10:56:12.755000,NM,5,9,mp-14625,,NdCoGe3,"{'functional': 'PBE', 'labels': ['Nd_3', 'Co', 'Ge_d'], 'pot_type': 'paw'}","{'Nd': 1.0, 'Co': 1.0, 'Ge': 3.0}",GGA,mp-14625,"['mp-932560', 'mp-916102', 'mp-931535', 'mp-14625', 'mp-1115823', 'mp-1476004', 'mp-1704266', 'mp-1797100', 'mp-1638406']",0.0001042,"{'Nd': 1.0, 'Co': 1.0, 'Ge': 3.0}",92.7751866989654,[],NM,False,107,0,"[0, 0, 0, 0, 0]",1.123145139422953e-06,0.0001042,0,0.0001042,MP,data/source/MP/cleaned/cifs/MP-mp-14625.cif,False,,data/final/MP/graphs/Co1Ge3Nd1-MP-mp-14625.json,0,True,4mm,0,0,0,0,5,0,0,0,0,1,0,1.0,False
Be0.24Si0.76V3,3,0.12,2.0,False,Be0.48Si1.52V6,Si2V6,15.6,Other,True,Be6Si19V75,Be-Si-V,3,Supercon,V3Si0.76Be0.24,MP-mp-2567,V6Si2,Si-V,Si25V75,P m -3 n,cubic,4.702381,4.702381,4.702381,data/final/MP/cifs/Be0.24Si0.76V3-MP-mp-2567-synth_doped.cif,data/source/MP/raw/cifs/mp-2567.cif,mp-2567,0.0,,2011-05-13 19:15:43,5.778142190030859,10.17188/1200874,"@misc{osti_1200874,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Si (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1200874"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668672'}},0.0,7.30599425,520.0,-69.05773321,-8.63221665125,{'tags': ['Vanadium silicide (3/1)']},-69.05773321,-8.63221665125,-0.4452085937499994,"['xas', 'elasticity', 'bandstructure']",True,"[652491, 87328, 652522, 652502, 652510, 652520, 600518, 186003, 652507, 652513, 652497, 601150, 652514, 652487, 22412, 652509, 652529, 652532, 652499, 652539, 652537, 652533, 652512, 652538, 652490, 652493, 652494, 652511, 652519, 87329, 652526, 652500]",True,2021-05-12 10:56:18.721000,FM,8,13,mp-2567,,V3Si,"{'functional': 'PBE', 'labels': ['V_pv', 'Si'], 'pot_type': 'paw'}","{'V': 3.0, 'Si': 1.0}",GGA,mp-2567,"['mp-920081', 'mp-906309', 'mp-919083', 'mp-2567', 'mp-1078474', 'mp-1078852', 'mp-1138781', 'mp-1145907', 'mp-1440678', 'mp-1668672', 'mp-1795955', 'mp-1593554', 'mp-1596575']",0.8382519,"{'V': 6.0, 'Si': 2.0}",103.98086881866836,[],FM,True,131,1,"[0.2, 0.3, 0.3, 0.2, 0.3, 0.3, 0.0, 0.0]",0.0161231947669493,0.8382519,6,1.6765038,MP,data/source/MP/cleaned/cifs/MP-mp-2567.cif,True,,data/final/MP/graphs/Be0.24Si0.76V3-MP-mp-2567-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Si1Zr1,1,0.0,4.0,False,Si4Zr4,Si4Zr4,0.0,Other,True,Si50Zr50,Si-Zr,2,Supercon,Si1Zr1,MP-mp-893,Zr4Si4,Si-Zr,Si50Zr50,P n m a,orthorhombic,3.803331,5.328118,7.030146,data/final/MP/cifs/Si1Zr1-MP-mp-893.cif,data/source/MP/raw/cifs/mp-893.cif,mp-893,0.0,,2011-05-13 11:07:54,5.5626509889834965,10.17188/1312835,"@misc{osti_1312835,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrSi (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1312835"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698212'}},0.0,6.90800899,520.0,-63.35876587,-7.91984573375,"{'tags': ['Zirconium silicide', 'Zirconium silicide (1/1)']}",-63.35876587,-7.91984573375,-0.8978384087500002,"['xas', 'elasticity', 'bandstructure']",True,"[652609, 16771, 652613, 43245]",True,2021-05-12 10:56:33.121000,NM,8,10,mp-893,,ZrSi,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Si'], 'pot_type': 'paw'}","{'Zr': 1.0, 'Si': 1.0}",GGA,mp-893,"['mp-912244', 'mp-928807', 'mp-928271', 'mp-893', 'mp-1125250', 'mp-1138328', 'mp-1431730', 'mp-1698212', 'mp-1780493', 'mp-1588280']",0.0008038,"{'Zr': 4.0, 'Si': 4.0}",142.46307104930645,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0]",2.256865569665573e-05,0.0008038,0,0.0032152,MP,data/source/MP/cleaned/cifs/MP-mp-893.cif,False,,data/final/MP/graphs/Si1Zr1-MP-mp-893.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Pd0.2Ti0.8,3,0.1,8.0,False,Pd1.6Ti6.4,Pd2Ti6,4.71,Other,True,Pd20Ti80,Pd-Ti,2,Supercon,Pd0.2Ti0.8,MP-mp-1079796,Ti6Pd2,Pd-Ti,Pd25Ti75,P m -3 n,cubic,5.062402,5.062402,5.062402,data/final/MP/cifs/Pd0.2Ti0.8-MP-mp-1079796-synth_doped.cif,data/source/MP/raw/cifs/mp-1079796.cif,mp-1079796,0.0,,2018-04-16 08:50:50,6.400084291337905,,,{'GGA': {'task_id': 'mp-1753631'}},0.0,5.87293662,520.0,-60.50496802,-7.5631210025,{'tags': ['Titanium palladium (3/1)']},-60.50496802,-7.5631210025,-0.3465315374999997,['bandstructure'],True,[167644],True,2021-05-12 10:58:16.596000,NM,8,5,mp-1079796,,Ti3Pd,"{'functional': 'PBE', 'labels': ['Ti_pv', 'Pd'], 'pot_type': 'paw'}","{'Ti': 3.0, 'Pd': 1.0}",GGA,mp-1079796,"['mp-1079796', 'mp-1389837', 'mp-1753631', 'mp-1788391', 'mp-1624029']",0.06889515,"{'Ti': 6.0, 'Pd': 2.0}",129.73880313804727,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0010620592811649,0.06889515,0,0.1377903,MP,data/source/MP/cleaned/cifs/MP-mp-1079796.cif,True,,data/final/MP/graphs/Pd0.2Ti0.8-MP-mp-1079796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Bi1.15K0.85O3,3,0.0599999999999999,1.0,True,Bi1.15K0.85O3,Bi1K1O3,7.4,Oxide,True,Bi23K17O60,Bi-K-O,3,Supercon,K0.85Bi1.15O3,MP-mp-982040,K1Bi1O3,Bi-K-O,Bi20K20O60,P m -3 m,cubic,4.284204,4.284204,4.284204,data/final/MP/cifs/Bi1.15K0.85O3-MP-mp-982040-synth_doped.cif,data/source/MP/raw/cifs/mp-982040.cif,mp-982040,0.0,,2015-10-12 11:25:13,6.252348761231978,10.17188/1316390,"@misc{osti_1316390,
    author = ""Persson, Kristin"",
    title = ""Materials Data on KBiO3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1316390"",
    place = ""United States"",
    year = ""2016"",
    month = ""9"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1717462'}},0.0928686834999998,1.80216133,520.0,-25.20286901,-5.040573802,{'tags': []},-25.20286901,-5.040573802,-1.4839105476,"['xas', 'elasticity']",False,[],True,2021-05-12 10:56:37.246000,NM,5,9,mp-982040,oxide,KBiO3,"{'functional': 'PBE', 'labels': ['K_sv', 'Bi', 'O'], 'pot_type': 'paw'}","{'K': 1.0, 'Bi': 1.0, 'O': 3.0}",GGA,mp-982040,"['mp-982222', 'mp-1006156', 'mp-982040', 'mp-1006117', 'mp-1431172', 'mp-1717462', 'mp-1798749', 'mp-1011221', 'mp-1585048']",0.0005425,"{'K': 1.0, 'Bi': 1.0, 'O': 3.0}",78.63401066432932,[],NM,False,221,0,"[0, 0, 0, 0, 0]",6.899050365315956e-06,0.0005425,0,0.0005425,MP,data/source/MP/cleaned/cifs/MP-mp-982040.cif,True,,data/final/MP/graphs/Bi1.15K0.85O3-MP-mp-982040-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Au1Tl2,1,0.0,2.0,False,Au2Tl4,Au2Tl4,4.25,Other,True,Au33.333Tl66.667,Au-Tl,2,Supercon,Au1Tl2,MP-mp-30571,Tl4Au2,Au-Tl,Au33.333Tl66.667,I 4/m c m,tetragonal,5.762949998976243,6.014874690853105,6.01487469,data/final/MP/cifs/Au1Tl2-MP-mp-30571.cif,data/source/MP/raw/cifs/mp-30571.cif,mp-30571,0.0,,2014-02-19 18:08:48,12.5224110446022,10.17188/1204962,"@misc{osti_1204962,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Tl2Au (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1204962"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700972'}},0.0,5.54471971,520.0,-16.22732356,-2.7045539266666663,{'tags': ['Gold thallium (1/2)']},-16.22732356,-2.7045539266666663,-0.0381646488888887,"['xas', 'elasticity', 'bandstructure']",True,[102798],True,2021-05-12 10:56:18.721000,NM,6,8,mp-30571,,Tl2Au,"{'functional': 'PBE', 'labels': ['Tl_d', 'Au'], 'pot_type': 'paw'}","{'Tl': 2.0, 'Au': 1.0}",GGA,mp-30571,"['mp-941231', 'mp-934752', 'mp-30571', 'mp-941518', 'mp-1429140', 'mp-1700972', 'mp-1927675', 'mp-1594062']",0.00017575,"{'Tl': 4.0, 'Au': 2.0}",160.6469532867618,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0]",2.188027801389779e-06,0.00017575,0,0.0003515,MP,data/source/MP/cleaned/cifs/MP-mp-30571.cif,False,,data/final/MP/graphs/Au1Tl2-MP-mp-30571.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ti0.5V0.5,1,0.0,2.0,False,Ti1V1,Ti1V1,6.381666666666667,Other,True,Ti50V50,Ti-V,2,Supercon,Ti0.5V0.5,MP-mp-1216646,Ti1V1,Ti-V,Ti50V50,C m m m,orthorhombic,2.70340358,2.70340358,4.412961,data/final/MP/cifs/Ti0.5V0.5-MP-mp-1216646.cif,data/source/MP/raw/cifs/mp-1216646.cif,mp-1216646,0.0,,2019-01-12 18:07:09.791000,5.387500532093173,,,{'GGA': {'task_id': 'mp-1675595'}},0.1186071833333333,5.82161176,520.0,-16.74218372,-8.37109186,{'tags': []},-16.74218372,-8.37109186,0.1186071833333333,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,2,5,mp-1216646,,TiV,"{'functional': 'PBE', 'labels': ['Ti_pv', 'V_pv'], 'pot_type': 'paw'}","{'Ti': 1.0, 'V': 1.0}",GGA,mp-1216646,"['mp-1216646', 'mp-1428659', 'mp-1675595', 'mp-1792191', 'mp-1610121']",0.0553406,"{'Ti': 1.0, 'V': 1.0}",30.4548228598316,[],NM,False,65,0,"[0.0, 0.0]",0.0018171374778538,0.0553406,0,0.0553406,MP,data/source/MP/cleaned/cifs/MP-mp-1216646.cif,False,,data/final/MP/graphs/Ti0.5V0.5-MP-mp-1216646.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
B2C1La0.07Lu0.93Ni2,2,0.0233333333333333,1.0,True,B2C1La0.07Lu0.93Ni2,B2C1Lu1Ni2,13.6,Other,True,B33.333C16.667La1.167Lu15.5Ni33.333,B-C-La-Lu-Ni,5,Supercon,Lu0.93La0.07Ni2B2C1,MP-mp-6544,Lu1Ni2B2C1,B-C-Lu-Ni,B33.333C16.667Lu16.667Ni33.333,I 4/m m m,tetragonal,3.4660159989239463,3.4660159989239463,5.81490896,data/final/MP/cifs/B2C1La0.07Lu0.93Ni2-MP-mp-6544-synth_doped.cif,data/source/MP/raw/cifs/mp-6544.cif,mp-6544,0.0,,2011-05-13 04:17:06,8.54504130524706,10.17188/1281287,"@misc{osti_1281287,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LuNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281287"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702891'}},0.0,6.71335166,520.0,-41.78223818,-6.963706363333333,{'tags': []},-41.78223818,-6.963706363333333,-0.5192416763888884,"['xas', 'bandstructure']",True,"[75609, 83230, 79564]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6544,,LuNi2B2C,"{'functional': 'PBE', 'labels': ['Lu_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Lu': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6544,"['mp-1000584', 'mp-1007055', 'mp-6544', 'mp-1441469', 'mp-1702891', 'mp-1783160', 'mp-1011794', 'mp-1588498']",0.0023161,"{'Lu': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",63.34823894903922,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",3.656139520884231e-05,0.0023161,0,0.0023161,MP,data/source/MP/cleaned/cifs/MP-mp-6544.cif,True,,data/final/MP/graphs/B2C1La0.07Lu0.93Ni2-MP-mp-6544-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ca1Cu2Sr1.75Th0.25Tl1O7,3,0.0384615384615384,1.0,True,Ca1Cu2Sr1.75Th0.25Tl1O7,Ca1Cu2Sr2Tl1O7,51.6,Cuprate,True,Ca7.692Cu15.385Sr13.462Th1.923Tl7.692O53.84615384615385,Ca-Cu-Sr-Th-Tl-O,6,Supercon,Tl1Sr1.75Th0.25Ca1Cu2O7,MP-mp-20824,Sr2Ca1Tl1Cu2O7,Ca-Cu-Sr-Tl-O,Ca7.692Cu15.385Sr15.385Tl7.692O53.84615384615385,P 4/m m m,tetragonal,3.781958,3.781958,12.290585,data/final/MP/cifs/Ca1Cu2Sr1.75Th0.25Tl1O7-MP-mp-20824-synth_doped.cif,data/source/MP/raw/cifs/mp-20824.cif,mp-20824,0.0,,2014-02-22 14:11:23,6.222853038840967,10.17188/1196027,"@misc{osti_1196027,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr2CaTlCu2O7 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196027"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701359'}},0.0167020139423028,3.36479313,520.0,-72.36482639,-5.566525106923077,{'tags': ['Thallium(III) calcium distrontium dicopper oxide']},-72.36482639,-5.566525106923077,-2.04557354474359,"['xas', 'bandstructure']",True,[74165],True,2021-05-12 10:56:57.051000,NM,13,8,mp-20824,oxide,Sr2CaTlCu2O7,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Tl_d', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ca': 1.0, 'Tl': 1.0, 'Cu': 2.0, 'O': 7.0}",GGA,mp-20824,"['mp-993717', 'mp-992012', 'mp-20824', 'mp-1420602', 'mp-1701359', 'mp-1787898', 'mp-995037', 'mp-1599885']",0.0332603,"{'Sr': 2.0, 'Ca': 1.0, 'Tl': 1.0, 'Cu': 2.0, 'O': 7.0}",175.7947729718531,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0001891995958567,0.0332603,0,0.0332603,MP,data/source/MP/cleaned/cifs/MP-mp-20824.cif,True,,data/final/MP/graphs/Ca1Cu2Sr1.75Th0.25Tl1O7-MP-mp-20824-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
La1Te1,1,0.0,1.0,True,La1Te1,La1Te1,1.48,Other,True,La50Te50,La-Te,2,Supercon,La1Te1,MP-mp-1560,La1Te1,La-Te,La50Te50,F m -3 m,cubic,4.58736231,4.587362309999999,4.587362309999999,data/final/MP/cifs/La1Te1-MP-mp-1560.cif,data/source/MP/raw/cifs/mp-1560.cif,mp-1560,0.0,,2011-05-12 18:05:04,6.483075737886018,10.17188/1191255,"@misc{osti_1191255,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaTe (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191255"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1670523'}},0.0,8.13499543,520.0,-11.26644269,-5.633221345,"{'tags': ['Lanthanum(II) telluride', 'Lanthanum telluride (1/1)']}",-11.26644269,-5.633221345,-1.8045673275,"['xas', 'elasticity', 'bandstructure']",True,"[642022, 642035, 29396, 642028, 183944]",True,2021-05-12 10:56:12.755000,NM,2,12,mp-1560,,LaTe,"{'functional': 'PBE', 'labels': ['La', 'Te'], 'pot_type': 'paw'}","{'La': 1.0, 'Te': 1.0}",GGA,mp-1560,"['mp-1006935', 'mp-1000466', 'mp-1560', 'mp-1061284', 'mp-1061229', 'mp-1061244', 'mp-1442021', 'mp-1670523', 'mp-1782475', 'mp-1011655', 'mp-1587231', 'mp-1061291']",0.0034741,"{'La': 1.0, 'Te': 1.0}",68.2612331383772,[],NM,False,225,0,"[0, 0]",5.089418752452663e-05,0.0034741,0,0.0034741,MP,data/source/MP/cleaned/cifs/MP-mp-1560.cif,False,,data/final/MP/graphs/La1Te1-MP-mp-1560.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Co1Si1U1,1,0.0,2.0,False,Co2Si2U2,Co2Si2U2,0.0,Heavy_fermion,True,Co33.333Si33.333U33.333,Co-Si-U,3,Supercon,U1Co1Si1,MP-mp-1178888,U2Co2Si2,Co-Si-U,Co33.333Si33.333U33.333,C m c m,orthorhombic,3.981631998507309,4.09139314,7.027654,data/final/MP/cifs/Co1Si1U1-MP-mp-1178888.cif,data/source/MP/raw/cifs/mp-1178888.cif,mp-1178888,0.0,,2014-12-22 15:55:49,10.793308284046066,,,{'GGA': {'task_id': 'mp-1755305'}},0.0865657009523825,9.87573449,520.0,-50.06699399,-8.344498998333334,{'tags': []},-50.06699399,-8.344498998333334,-0.379151723333333,['bandstructure'],True,[],True,2021-05-12 10:58:22.271000,FM,6,13,mp-1178888,,UCoSi,"{'functional': 'PBE', 'labels': ['U', 'Co', 'Si'], 'pot_type': 'paw'}","{'U': 1.0, 'Co': 1.0, 'Si': 1.0}",GGA,mp-1178888,"['mp-923238', 'mp-907952', 'mp-922457', 'mp-1178888', 'mp-1427141', 'mp-1445158', 'mp-1659012', 'mp-1701064', 'mp-1755305', 'mp-1832418', 'mp-1835889', 'mp-1595835', 'mp-1618816']",0.0233131,"{'U': 2.0, 'Co': 2.0, 'Si': 2.0}",100.01646064443348,[],FM,True,63,1,"[-0.0, -0.0, 0.1, 0.1, -0.0, -0.0]",0.0004661852629014,0.0233131,2,0.0466262,MP,data/source/MP/cleaned/cifs/MP-mp-1178888.cif,False,,data/final/MP/graphs/Co1Si1U1-MP-mp-1178888.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
As2Fe1.92Ni0.08Sr1,2,0.032,1.0,True,As2Fe1.92Ni0.08Sr1,As2Fe2Sr1,0.0,Ferrite,True,As40Fe38.4Ni1.6Sr20,As-Fe-Ni-Sr,4,Supercon,Sr1Fe1.92Ni0.08As2,MP-mp-4488,Sr1Fe2As2,As-Fe-Sr,As40Fe40Sr20,I 4/m m m,tetragonal,3.9729799997357778,3.9729799997357778,6.45523327,data/final/MP/cifs/As2Fe1.92Ni0.08Sr1-MP-mp-4488-synth_doped.cif,data/source/MP/raw/cifs/mp-4488.cif,mp-4488,0.0,,2011-05-13 03:37:13,6.319998834487784,10.17188/1208187,"@misc{osti_1208187,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr(FeAs)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208187"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672865'}},0.0,5.13397273,520.0,-30.61898897,-6.123797794,"{'tags': ['Strontium diiron arsenide - HT', 'Strontium diiron arsenide', 'Strontium diiron diarsenide', 'Iron strontium arsenide (2/1/2)', 'Strontium diiron arsenide - LT']}",-30.61898897,-6.123797794,-0.5342483613333335,"['xas', 'elasticity', 'bandstructure']",True,"[182330, 181993, 610527, 163209, 163208, 163869]",True,2021-05-12 10:56:20.740000,NM,5,8,mp-4488,,Sr(FeAs)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Fe': 2.0, 'As': 2.0}",GGA,mp-4488,"['mp-906356', 'mp-920135', 'mp-919110', 'mp-4488', 'mp-1439153', 'mp-1672865', 'mp-1873948', 'mp-1592272']",0.0029206,"{'Sr': 1.0, 'Fe': 2.0, 'As': 2.0}",91.7377588211838,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",3.183640016422098e-05,0.0029206,0,0.0029206,MP,data/source/MP/cleaned/cifs/MP-mp-4488.cif,True,,data/final/MP/graphs/As2Fe1.92Ni0.08Sr1-MP-mp-4488-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
C1Mo0.49Nb0.51,2,0.01,2.0,False,C2Mo0.98Nb1.02,C2Mo1Nb1,12.22,Other,True,C50Mo24.5Nb25.5,C-Mo-Nb,3,Supercon,Nb0.51Mo0.49C1,MP-mp-1220406,Nb1Mo1C2,C-Mo-Nb,C50Mo25Nb25,R -3 m,trigonal,3.15243188908568,3.15243188908568,5.41032004,data/final/MP/cifs/C1Mo0.49Nb0.51-MP-mp-1220406-synth_doped.cif,data/source/MP/raw/cifs/mp-1220406.cif,mp-1220406,0.0,,2019-01-12 21:15:29.154000,8.06108271761549,,,{'GGA': {'task_id': 'mp-1765506'}},0.1721471579166671,8.66579072,520.0,-39.8816923,-9.970423075,{'tags': []},-39.8816923,-9.970423075,-0.1202957074999986,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,4,5,mp-1220406,,NbMoC2,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Mo_pv', 'C'], 'pot_type': 'paw'}","{'Nb': 1.0, 'Mo': 1.0, 'C': 2.0}",GGA,mp-1220406,"['mp-1220406', 'mp-1430842', 'mp-1765506', 'mp-1791507', 'mp-1630445']",0.0011045,"{'Nb': 1.0, 'Mo': 1.0, 'C': 2.0}",43.8496014856642,[],NM,False,166,0,"[0, 0, 0, 0]",2.518837030619527e-05,0.0011045,0,0.0011045,MP,data/source/MP/cleaned/cifs/MP-mp-1220406.cif,True,,data/final/MP/graphs/C1Mo0.49Nb0.51-MP-mp-1220406-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
As1Pd2,1,0.0,4.0,False,As4Pd8,As4Pd8,1.15,Other,True,As33.333Pd66.667,As-Pd,2,Supercon,As1Pd2,MP-mp-8073,As4Pd8,As-Pd,As33.333Pd66.667,C m c 21,orthorhombic,3.331143999727752,6.704945,8.75637269,data/final/MP/cifs/As1Pd2-MP-mp-8073.cif,data/source/MP/raw/cifs/mp-8073.cif,mp-8073,0.0,,2011-06-01 16:31:52,9.954771150775018,10.17188/1307918,"@misc{osti_1307918,
    author = ""Persson, Kristin"",
    title = ""Materials Data on AsPd2 (SG:36) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1307918"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704645'}},0.0,5.91493436,520.0,-64.50531339,-5.3754427825,"{'tags': ['Palladium arsenide (2/1) - R', 'Palladoarsenite']}",-64.50531339,-5.3754427825,-0.3691487741666665,"['bandstructure', 'elasticity']",True,[26279],True,2021-05-12 10:56:31.128000,NM,12,8,mp-8073,,AsPd2,"{'functional': 'PBE', 'labels': ['As', 'Pd'], 'pot_type': 'paw'}","{'As': 1.0, 'Pd': 2.0}",GGA,mp-8073,"['mp-920598', 'mp-921619', 'mp-907068', 'mp-8073', 'mp-1416852', 'mp-1704645', 'mp-1789203', 'mp-1599024']",4.55e-06,"{'As': 4.0, 'Pd': 8.0}",192.0041642062744,[],NM,False,36,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",9.478961081514529e-08,4.55e-06,0,1.82e-05,MP,data/source/MP/cleaned/cifs/MP-mp-8073.cif,False,,data/final/MP/graphs/As1Pd2-MP-mp-8073.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Nb0.6Pd0.4,3,0.1333333333333333,3.0,False,Nb1.8Pd1.2,Nb2Pd1,2.035,Other,True,Nb60Pd40,Nb-Pd,2,Supercon,Nb0.6Pd0.4,MP-mp-1220678,Nb2Pd1,Nb-Pd,Nb66.667Pd33.333,F m m m,orthorhombic,2.8240621319204884,2.82406213,6.78333523,data/final/MP/cifs/Nb0.6Pd0.4-MP-mp-1220678-synth_doped.cif,data/source/MP/raw/cifs/mp-1220678.cif,mp-1220678,0.0,,2019-01-12 21:29:16.302000,9.433924184220336,,,{'GGA': {'task_id': 'mp-1764792'}},0.0,5.1760297,520.0,-26.07874005,-8.69291335,{'tags': []},-26.07874005,-8.69291335,-0.2320827199999998,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,3,5,mp-1220678,,Nb2Pd,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Pd'], 'pot_type': 'paw'}","{'Nb': 2.0, 'Pd': 1.0}",GGA,mp-1220678,"['mp-1220678', 'mp-1427348', 'mp-1764792', 'mp-1792829', 'mp-1612674']",0.0072664,"{'Nb': 2.0, 'Pd': 1.0}",51.43818256797303,[],NM,False,69,0,"[0, 0, 0]",0.0001412647111005,0.0072664,0,0.0072664,MP,data/source/MP/cleaned/cifs/MP-mp-1220678.cif,True,,data/final/MP/graphs/Nb0.6Pd0.4-MP-mp-1220678-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,0,0,1,1.0,False
Ba0.65Bi1K0.35O3,2,0.0066666666666666,3.0,False,Ba1.95Bi3K1.05O9,Ba2Bi3K1O9,28.2,Oxide,True,Ba13Bi20K7O60,Ba-Bi-K-O,4,Supercon,Ba0.65K0.35Bi1O3,MP-mp-1223518,K1Ba2Bi3O9,Ba-Bi-K-O,Ba13.333Bi20K6.667O60,P -3 m 1,trigonal,6.18756400330999,6.187564340000001,7.581401,data/final/MP/cifs/Ba0.65Bi1K0.35O3-MP-mp-1223518-synth_doped.cif,data/source/MP/raw/cifs/mp-1223518.cif,mp-1223518,0.0,,2019-01-12 23:54:06.965000,7.16530091201999,,,{'GGA': {'task_id': 'mp-1729135'}},0.001551682833333,3.46143017,520.0,-85.22271396,-5.681514264,{'tags': []},-85.22271396,-5.681514264,-2.0170414252000004,[],False,[],True,2021-05-12 11:00:52.054000,NM,15,4,mp-1223518,oxide,KBa2(BiO3)3,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Bi', 'O'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 2.0, 'Bi': 3.0, 'O': 9.0}",GGA,mp-1223518,"['mp-1223518', 'mp-1391182', 'mp-1729135', 'mp-1775199']",4.99e-05,"{'K': 1.0, 'Ba': 2.0, 'Bi': 3.0, 'O': 9.0}",251.37352739849624,[],NM,False,164,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.9850936777799505e-07,4.99e-05,0,4.99e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1223518.cif,True,,data/final/MP/graphs/Ba0.65Bi1K0.35O3-MP-mp-1223518-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ge1.8La1Pt2Sn0.2,3,0.0799999999999999,1.0,True,Ge1.8La1Pt2Sn0.2,Ge2La1Pt2,1.3,Other,True,Ge36La20Pt40Sn4,Ge-La-Pt-Sn,4,Supercon,La1Pt2Ge1.8Sn0.2,MP-mp-21057,La1Ge2Pt2,Ge-La-Pt,Ge40La20Pt40,I 4/m m m,tetragonal,4.458128002603763,4.458128002603763,5.96043246,data/final/MP/cifs/Ge1.8La1Pt2Sn0.2-MP-mp-21057-synth_doped.cif,data/source/MP/raw/cifs/mp-21057.cif,mp-21057,0.0,,2014-02-21 09:25:11,11.137876633950224,10.17188/1196317,"@misc{osti_1196317,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La(GePt)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196317"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704515'}},0.0973405535000013,6.85937735,520.0,-30.67754438,-6.135508876,{'tags': ['Lanthanum platinum germanide (1/2/2)']},-30.67754438,-6.135508876,-0.8707332289999996,"['xas', 'bandstructure']",True,[53665],True,2021-05-12 10:56:57.051000,NM,5,8,mp-21057,,La(GePt)2,"{'functional': 'PBE', 'labels': ['La', 'Ge_d', 'Pt'], 'pot_type': 'paw'}","{'La': 1.0, 'Ge': 2.0, 'Pt': 2.0}",GGA,mp-21057,"['mp-993642', 'mp-991893', 'mp-21057', 'mp-1429115', 'mp-1704515', 'mp-1783057', 'mp-994947', 'mp-1591906']",0.003651,"{'La': 1.0, 'Ge': 2.0, 'Pt': 2.0}",100.53893739664449,[],NM,False,139,0,"[0, 0, 0, 0, 0]",3.631428871777447e-05,0.003651,0,0.003651,MP,data/source/MP/cleaned/cifs/MP-mp-21057.cif,True,,data/final/MP/graphs/Ge1.8La1Pt2Sn0.2-MP-mp-21057-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ge2Pd1.94Pt0.06Sr1,2,0.024,1.0,True,Ge2Pd1.94Pt0.06Sr1,Ge2Pd2Sr1,3.22,Other,True,Ge40Pd38.8Pt1.2Sr20,Ge-Pd-Pt-Sr,4,Supercon,Sr1Pd1.94Pt0.06Ge2,MP-mp-978986,Sr1Ge2Pd2,Ge-Pd-Sr,Ge40Pd40Sr20,I 4/m m m,tetragonal,4.438671999438209,4.438671999438209,6.03054834,data/final/MP/cifs/Ge2Pd1.94Pt0.06Sr1-MP-mp-978986-synth_doped.cif,data/source/MP/raw/cifs/mp-978986.cif,mp-978986,0.0,,2015-10-09 03:56:43,7.295677176868866,10.17188/1316057,"@misc{osti_1316057,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr(GePd)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1316057"",
    place = ""United States"",
    year = ""2016"",
    month = ""9"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688092'}},0.0,4.0155429,520.0,-24.8627221,-4.97254442,"{'tags': ['Strontium palladium germanide (1/2/2)', 'Strontium palladium germanium (1/2/2)', 'High pressure experimental phase']}",-24.8627221,-4.97254442,-0.7134818633333324,"['xas', 'elasticity', 'bandstructure']",True,"[165985, 181157, 181155, 181156, 168133]",True,2021-05-12 10:56:37.246000,NM,5,9,mp-978986,,Sr(GePd)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ge_d', 'Pd'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Ge': 2.0, 'Pd': 2.0}",GGA,mp-978986,"['mp-1005776', 'mp-978986', 'mp-1005866', 'mp-979737', 'mp-1438850', 'mp-1688092', 'mp-1782349', 'mp-1011093', 'mp-1589601']",0.0012593,"{'Sr': 1.0, 'Ge': 2.0, 'Pd': 2.0}",101.45304755163892,[],NM,False,139,0,"[0, 0, 0, 0, 0]",1.2412638460752248e-05,0.0012593,0,0.0012593,MP,data/source/MP/cleaned/cifs/MP-mp-978986.cif,True,,data/final/MP/graphs/Ge2Pd1.94Pt0.06Sr1-MP-mp-978986-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ag0.7Zn0.3,3,0.1,4.0,False,Ag2.8Zn1.2,Ag3Zn1,0.0125,Other,True,Ag70Zn30,Ag-Zn,2,Supercon,Ag0.7Zn0.3,MP-mp-864794,Zn1Ag3,Ag-Zn,Ag75Zn25,P m -3 m,cubic,4.100496,4.100496,4.100496,data/final/MP/cifs/Ag0.7Zn0.3-MP-mp-864794-synth_doped.cif,data/source/MP/raw/cifs/mp-864794.cif,mp-864794,0.0,,2014-08-30 01:20:16,9.369247345207052,10.17188/1310157,"@misc{osti_1310157,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZnAg3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1310157"",
    place = ""United States"",
    year = ""2016"",
    month = ""8"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1767618'}},0.0,3.28950912,520.0,-9.87077298,-2.467693245,{'tags': []},-9.87077298,-2.467693245,-0.0283403400000001,"['xas', 'elasticity', 'bandstructure']",True,[],True,2021-05-12 10:56:31.128000,NM,4,11,mp-864794,,ZnAg3,"{'functional': 'PBE', 'labels': ['Zn', 'Ag'], 'pot_type': 'paw'}","{'Zn': 1.0, 'Ag': 3.0}",GGA,mp-864794,"['mp-1002975', 'mp-1004567', 'mp-864794', 'mp-1051505', 'mp-1051511', 'mp-1418259', 'mp-1767618', 'mp-1799156', 'mp-1010234', 'mp-1615130', 'mp-1051519']",0.003042,"{'Zn': 1.0, 'Ag': 3.0}",68.9460163061188,[],NM,False,221,0,"[0, 0, 0, 0]",4.412147594566721e-05,0.003042,0,0.003042,MP,data/source/MP/cleaned/cifs/MP-mp-864794.cif,True,,data/final/MP/graphs/Ag0.7Zn0.3-MP-mp-864794-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Al1Pd2Zr1,1,0.0,1.0,True,Al1Pd2Zr1,Al1Pd2Zr1,3.3,Other,True,Al25Pd50Zr25,Al-Pd-Zr,3,Supercon,Pd2Zr1Al1,MP-mp-541047,Zr1Al1Pd2,Al-Pd-Zr,Al25Pd50Zr25,F m -3 m,cubic,4.57033518,4.570335179999999,4.57033518,data/final/MP/cifs/Al1Pd2Zr1-MP-mp-541047.cif,data/source/MP/raw/cifs/mp-541047.cif,mp-541047,0.0,,2014-03-04 22:37:49,8.143435841764896,10.17188/1264928,"@misc{osti_1264928,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrAlPd2 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1264928"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700196'}},0.0,6.07479302,520.0,-25.86549847,-6.4663746175,{'tags': ['Aluminium palladium zirconium (1/2/1)']},-25.86549847,-6.4663746175,-0.8031145974999996,"['xas', 'elasticity', 'bandstructure']",True,[58122],True,2021-05-12 10:56:22.739000,NM,4,9,mp-541047,,ZrAlPd2,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Al', 'Pd'], 'pot_type': 'paw'}","{'Zr': 1.0, 'Al': 1.0, 'Pd': 2.0}",GGA,mp-541047,"['mp-993682', 'mp-541047', 'mp-991962', 'mp-1256586', 'mp-1413021', 'mp-1700196', 'mp-1781993', 'mp-994976', 'mp-1592388']",0.0003981,"{'Zr': 1.0, 'Al': 1.0, 'Pd': 2.0}",67.5039455520289,[],NM,False,225,0,"[0, 0, 0, 0]",5.897433057348671e-06,0.0003981,0,0.0003981,MP,data/source/MP/cleaned/cifs/MP-mp-541047.cif,False,,data/final/MP/graphs/Al1Pd2Zr1-MP-mp-541047.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Te2W1,1,0.0,4.0,False,Te8W4,Te8W4,0.0,Other,True,Te66.667W33.333,Te-W,2,Supercon,Te2W1,MP-mp-22693,Te8W4,Te-W,Te66.667W33.333,P m n 21,orthorhombic,3.497941,6.338274,15.431851,data/final/MP/cifs/Te2W1-MP-mp-22693.cif,data/source/MP/raw/cifs/mp-22693.cif,mp-22693,0.0,,2014-02-22 08:14:19,8.523376397963197,10.17188/1198898,"@misc{osti_1198898,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Te2W (SG:31) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198898"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696455'}},0.0,5.87988428,520.0,-78.24936804,-6.52078067,"{'tags': ['Tungsten telluride (1/2)', 'Tungsten ditelluride']}",-78.24936804,-6.52078067,-0.3872045599999995,"['xas', 'elasticity', 'bandstructure']",True,"[653169, 14348, 73323, 653168, 653171]",True,2021-05-12 10:56:16.728000,NM,12,13,mp-22693,,Te2W,"{'functional': 'PBE', 'labels': ['Te', 'W_pv'], 'pot_type': 'paw'}","{'Te': 2.0, 'W': 1.0}",GGA,mp-22693,"['mp-922837', 'mp-923620', 'mp-917410', 'mp-22693', 'mp-1102141', 'mp-1102661', 'mp-1102873', 'mp-1179081', 'mp-1116079', 'mp-1435093', 'mp-1696455', 'mp-1841899', 'mp-1608400']",2.555e-05,"{'Te': 8.0, 'W': 4.0}",342.13815641148074,[],NM,False,31,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.987097407431129e-07,2.555e-05,0,0.0001022,MP,data/source/MP/cleaned/cifs/MP-mp-22693.cif,False,,data/final/MP/graphs/Te2W1-MP-mp-22693.json,0,True,mm2,0,0,0,6,0,0,0,1,0,0,0,1.0,False
Al0.945Nb3Si0.055,2,0.0275,2.0,False,Al1.89Nb6Si0.11,Al2Nb6,18.4,Other,True,Al23.625Nb75Si1.375,Al-Nb-Si,3,Supercon,Nb3Al0.945Si0.055,MP-mp-796,Nb6Al2,Al-Nb,Al25Nb75,P m -3 n,cubic,5.215254,5.215254,5.215254,data/final/MP/cifs/Al0.945Nb3Si0.055-MP-mp-796-synth_doped.cif,data/source/MP/raw/cifs/mp-796.cif,mp-796,0.0,,2011-05-13 16:07:37,7.157298025966356,,,{'GGA': {'task_id': 'mp-1686893'}},0.0460773865000003,5.52947534,520.0,-69.48918494,-8.6861481175,"{'tags': ['Aluminium niobium (1/3)', 'Niobium aluminide (3/1)', 'Aluminum niobium (1/3)']}",-69.48918494,-8.6861481175,-0.1737753800000003,"['bandstructure', 'elasticity']",True,"[608675, 608654, 608688, 608668, 608669, 608685, 608676, 608683, 58014, 608657, 107856, 608655, 608666, 608691, 608656, 608665, 608673, 608653, 608661]",True,2021-05-12 10:56:31.128000,NM,8,10,mp-796,,Nb3Al,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Al': 1.0}",GGA,mp-796,"['mp-911586', 'mp-927906', 'mp-796', 'mp-927472', 'mp-1260512', 'mp-1440919', 'mp-1686893', 'mp-1927652', 'mp-1591599', 'mp-1587739']",0.16323955,"{'Nb': 6.0, 'Al': 2.0}",141.8490379078192,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0023015954483396,0.16323955,0,0.3264791,MP,data/source/MP/cleaned/cifs/MP-mp-796.cif,True,,data/final/MP/graphs/Al0.945Nb3Si0.055-MP-mp-796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
As1Ca1F1Fe0.9Mn0.1,2,0.0499999999999999,2.0,False,As2Ca2F2Fe1.8Mn0.2,As2Ca2F2Fe2,0.0,Ferrite,True,As25Ca25F25Fe22.5Mn2.5,As-Ca-F-Fe-Mn,5,Supercon,Ca1Fe0.9Mn0.1As1F1,MP-mp-1079859,Ca2Fe2As2F2,As-Ca-F-Fe,As25Ca25F25Fe25,P m m n,orthorhombic,3.933336,3.981276,9.018918,data/final/MP/cifs/As1Ca1F1Fe0.9Mn0.1-MP-mp-1079859-synth_doped.cif,data/source/MP/raw/cifs/mp-1079859.cif,mp-1079859,0.0,,2018-04-16 14:43:21,4.464120586611354,,,{'GGA+U': {'task_id': 'mp-1695365'}},0.2859614887499973,4.27317878,520.0,-41.71531675,-5.21441459375,"{'tags': ['Calcium iron arsenide fluoride', 'High pressure experimental phase']}",-41.71531675,-5.21441459375,-1.632363168125,['bandstructure'],True,[186505],True,2021-05-12 10:58:16.596000,FM,8,6,mp-1079859,,CaFeAsF,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Fe_pv', 'As', 'F'], 'pot_type': 'paw'}","{'Ca': 1.0, 'Fe': 1.0, 'As': 1.0, 'F': 1.0}",GGA+U,mp-1079859,"['mp-1079859', 'mp-1475687', 'mp-1695365', 'mp-1785040', 'mp-1938652', 'mp-1594699']",3.7150606,"{'Ca': 2.0, 'Fe': 2.0, 'As': 2.0, 'F': 2.0}",141.2335160836522,[],FM,True,59,1,"[0.0, 0.0, 3.6, 3.6, 0.0, 0.0, 0.0, 0.0]",0.0526087674231601,3.7150606,2,7.4301212,MP,data/source/MP/cleaned/cifs/MP-mp-1079859.cif,True,,data/final/MP/graphs/As1Ca1F1Fe0.9Mn0.1-MP-mp-1079859-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ba2Cu3Nd0.85Pr0.15O7,2,0.023076923076923,1.0,True,Ba2Cu3Nd0.85Pr0.15O7,Ba2Cu3Nd1O7,40.7,Cuprate,True,Ba15.385Cu23.077Nd6.538Pr1.154O53.84615384615385,Ba-Cu-Nd-Pr-O,5,Supercon,Nd0.85Pr0.15Ba2Cu3O7,MP-mp-22719,Ba2Nd1Cu3O7,Ba-Cu-Nd-O,Ba15.385Cu23.077Nd7.692O53.84615384615385,P m m m,orthorhombic,3.893817,3.958458,11.89947,data/final/MP/cifs/Ba2Cu3Nd0.85Pr0.15O7-MP-mp-22719-synth_doped.cif,data/source/MP/raw/cifs/mp-22719.cif,mp-22719,0.0,,2015-01-22 21:32:23,6.532421108031168,10.17188/1198922,"@misc{osti_1198922,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2NdCu3O7 (SG:47) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198922"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704234'}},0.0180149053205083,3.13221275,520.0,-78.75337907,-6.057952236153846,"{'tags': ['Neodymium barium copper oxide (1/2/3/7)', 'Neodymium dibarium tricopper heptaoxide']}",-78.75337907,-6.057952236153846,-2.155611319615384,"['bandstructure', 'elasticity']",True,"[86960, 81169]",True,2021-05-12 10:56:16.728000,NM,13,8,mp-22719,oxide,Ba2NdCu3O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Nd_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Nd': 1.0, 'Cu': 3.0, 'O': 7.0}",GGA,mp-22719,"['mp-926068', 'mp-925655', 'mp-917559', 'mp-1427130', 'mp-1704234', 'mp-1829984', 'mp-1600543', 'mp-22719']",0.0444215,"{'Ba': 2.0, 'Nd': 1.0, 'Cu': 3.0, 'O': 7.0}",183.4126123839547,[],NM,False,47,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0002421943585155,0.0444215,0,0.0444215,MP,data/source/MP/cleaned/cifs/MP-mp-22719.cif,True,,data/final/MP/graphs/Ba2Cu3Nd0.85Pr0.15O7-MP-mp-22719-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ge0.1Si0.9V3,2,0.0499999999999999,2.0,False,Ge0.2Si1.8V6,Si2V6,14.133333333333333,Other,True,Ge2.5Si22.5V75,Ge-Si-V,3,Supercon,Si0.9V3Ge0.1,MP-mp-2567,V6Si2,Si-V,Si25V75,P m -3 n,cubic,4.702381,4.702381,4.702381,data/final/MP/cifs/Ge0.1Si0.9V3-MP-mp-2567-synth_doped.cif,data/source/MP/raw/cifs/mp-2567.cif,mp-2567,0.0,,2011-05-13 19:15:43,5.778142190030859,10.17188/1200874,"@misc{osti_1200874,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Si (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1200874"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668672'}},0.0,7.30599425,520.0,-69.05773321,-8.63221665125,{'tags': ['Vanadium silicide (3/1)']},-69.05773321,-8.63221665125,-0.4452085937499994,"['xas', 'elasticity', 'bandstructure']",True,"[652491, 87328, 652522, 652502, 652510, 652520, 600518, 186003, 652507, 652513, 652497, 601150, 652514, 652487, 22412, 652509, 652529, 652532, 652499, 652539, 652537, 652533, 652512, 652538, 652490, 652493, 652494, 652511, 652519, 87329, 652526, 652500]",True,2021-05-12 10:56:18.721000,FM,8,13,mp-2567,,V3Si,"{'functional': 'PBE', 'labels': ['V_pv', 'Si'], 'pot_type': 'paw'}","{'V': 3.0, 'Si': 1.0}",GGA,mp-2567,"['mp-920081', 'mp-906309', 'mp-919083', 'mp-2567', 'mp-1078474', 'mp-1078852', 'mp-1138781', 'mp-1145907', 'mp-1440678', 'mp-1668672', 'mp-1795955', 'mp-1593554', 'mp-1596575']",0.8382519,"{'V': 6.0, 'Si': 2.0}",103.98086881866836,[],FM,True,131,1,"[0.2, 0.3, 0.3, 0.2, 0.3, 0.3, 0.0, 0.0]",0.0161231947669493,0.8382519,6,1.6765038,MP,data/source/MP/cleaned/cifs/MP-mp-2567.cif,True,,data/final/MP/graphs/Ge0.1Si0.9V3-MP-mp-2567-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba1Sb1.9Sn0.1Ti2O1,2,0.0333333333333333,1.0,True,Ba1Sb1.9Sn0.1Ti2O1,Ba1Sb2Ti2O1,0.0,Oxide,True,Ba16.667Sb31.667Sn1.667Ti33.333O16.666666666666668,Ba-Sb-Sn-Ti-O,5,Supercon,Ba1Ti2Sb1.9Sn0.1O1,MP-mp-1070806,Ba1Ti2Sb2O1,Ba-Sb-Ti-O,Ba16.667Sb33.333Ti33.333O16.666666666666668,P 4/m m m,tetragonal,4.113474,4.113474,8.312382,data/final/MP/cifs/Ba1Sb1.9Sn0.1Ti2O1-MP-mp-1070806-synth_doped.cif,data/source/MP/raw/cifs/mp-1070806.cif,mp-1070806,0.0,,2018-03-22 04:02:04,5.8154485533321445,,,{'GGA': {'task_id': 'mp-1702174'}},0.0,5.89751533,520.0,-39.14932631,-6.524887718333333,{'tags': []},-39.14932631,-6.524887718333333,-1.5507346602777776,['bandstructure'],True,"[430061, 237789, 430060]",True,2021-05-12 10:58:14.654000,NM,6,16,mp-1070806,oxide,BaTi2Sb2O,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ti_pv', 'Sb', 'O'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Ti': 2.0, 'Sb': 2.0, 'O': 1.0}",GGA,mp-1070806,"['mp-1071055', 'mp-1071068', 'mp-1071083', 'mp-1071088', 'mp-1070806', 'mp-1071124', 'mp-1070846', 'mp-1070900', 'mp-1071137', 'mp-1423542', 'mp-1702174', 'mp-1785425', 'mp-1588663', 'mp-1070899', 'mp-1071129', 'mp-1071119']",0.001055,"{'Ba': 1.0, 'Ti': 2.0, 'Sb': 2.0, 'O': 1.0}",140.65105900950408,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0]",7.500832254158225e-06,0.001055,0,0.001055,MP,data/source/MP/cleaned/cifs/MP-mp-1070806.cif,True,,data/final/MP/graphs/Ba1Sb1.9Sn0.1Ti2O1-MP-mp-1070806-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B2C1Ho0.7Lu0.3Ni2,3,0.1,1.0,True,B2C1Ho0.7Lu0.3Ni2,B2C1Ho1Ni2,8.72,Other,True,B33.333C16.667Ho11.667Lu5Ni33.333,B-C-Ho-Lu-Ni,5,Supercon,Ho0.7Lu0.3Ni2B2C1,MP-mp-6646,Ho1Ni2B2C1,B-C-Ho-Ni,B33.333C16.667Ho16.667Ni33.333,I 4/m m m,tetragonal,3.529863997734658,3.529863997734658,5.76032203,data/final/MP/cifs/B2C1Ho0.7Lu0.3Ni2-MP-mp-6646-synth_doped.cif,data/source/MP/raw/cifs/mp-6646.cif,mp-6646,0.0,,2011-05-13 04:24:09,8.11075125231065,10.17188/1281460,"@misc{osti_1281460,
    author = ""Persson, Kristin"",
    title = ""Materials Data on HoNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281460"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1670774'}},0.0,6.70981387,520.0,-41.84364575,-6.973940958333333,{'tags': ['Holmium dinickel diboride carbide']},-41.84364575,-6.973940958333333,-0.5192332130555558,"['xas', 'elasticity', 'bandstructure']",True,"[79064, 56650, 79065, 79062, 79063, 79575]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-6646,,HoNi2B2C,"{'functional': 'PBE', 'labels': ['Ho_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Ho': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6646,"['mp-1007146', 'mp-6646', 'mp-1000682', 'mp-1439301', 'mp-1670774', 'mp-1782657', 'mp-1011887', 'mp-1589032']",0.0032459,"{'Ho': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",64.68537905730652,[],NM,False,139,0,"[0.0, -0.0, -0.0, 0.0, 0.0, 0.0]",5.017980952271099e-05,0.0032459,0,0.0032459,MP,data/source/MP/cleaned/cifs/MP-mp-6646.cif,True,,data/final/MP/graphs/B2C1Ho0.7Lu0.3Ni2-MP-mp-6646-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Be13Th0.01U0.99,2,0.0014285714285714,2.0,False,Be26Th0.02U1.98,Be26U2,0.637,Heavy_fermion,True,Be92.857Th0.071U7.071,Be-Th-U,3,Supercon,U0.99Th0.01Be13,MP-mp-1163,U2Be26,Be-U,Be92.857U7.143,F m -3 c,cubic,7.174675929999999,7.174675929999999,7.174675929999999,data/final/MP/cifs/Be13Th0.01U0.99-MP-mp-1163-synth_doped.cif,data/source/MP/raw/cifs/mp-1163.cif,mp-1163,0.0,,2011-05-15 13:39:09,4.516943134220159,10.17188/1188115,"@misc{osti_1188115,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UBe13 (SG:226) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188115"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1676276'}},0.0,5.60901004,520.0,-121.44122023,-4.337186436785714,"{'tags': ['Uranium beryllium (1/13)', 'Beryllium uranium (13/1)']}",-121.44122023,-4.337186436785714,-0.0583452042857146,"['xas', 'bandstructure']",True,"[616470, 58748, 616481, 58747, 58749, 659562, 107528, 600563, 58750, 616488, 58751]",True,2021-05-12 10:56:51.169000,NM,28,8,mp-1163,,UBe13,"{'functional': 'PBE', 'labels': ['U', 'Be_sv'], 'pot_type': 'paw'}","{'U': 1.0, 'Be': 13.0}",GGA,mp-1163,"['mp-1163', 'mp-906858', 'mp-920459', 'mp-921486', 'mp-1381018', 'mp-1676276', 'mp-1775695', 'mp-1603627']",0.0460573,"{'U': 2.0, 'Be': 26.0}",261.15110606061,[],NM,False,226,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0003527252914587,0.0460573,0,0.0921146,MP,data/source/MP/cleaned/cifs/MP-mp-1163.cif,True,,data/final/MP/graphs/Be13Th0.01U0.99-MP-mp-1163-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
La1P1Rh1,1,0.0,2.0,False,La2P2Rh2,La2P2Rh2,2.5,Other,True,La33.333P33.333Rh33.333,La-P-Rh,3,Supercon,La1Rh1P1,MP-mp-1070925,La2P2Rh2,La-P-Rh,La33.333P33.333Rh33.333,I 41 m d,tetragonal,4.137836001384373,4.137836001384373,7.816403229999999,data/final/MP/cifs/La1P1Rh1-MP-mp-1070925.cif,data/source/MP/raw/cifs/mp-1070925.cif,mp-1070925,0.0,,2018-03-22 04:17:07,7.300068409900951,,,{'GGA': {'task_id': 'mp-1698539'}},0.0,8.24454171,520.0,-43.02600188,-7.171000313333334,{'tags': ['Lanthanum rhodium phosphide (1/1/1)']},-43.02600188,-7.171000313333334,-1.2664611527777785,['bandstructure'],True,[193887],True,2021-05-12 10:58:14.654000,NM,6,8,mp-1070925,,LaPRh,"{'functional': 'PBE', 'labels': ['La', 'P', 'Rh_pv'], 'pot_type': 'paw'}","{'La': 1.0, 'P': 1.0, 'Rh': 1.0}",GGA,mp-1070925,"['mp-1070972', 'mp-1071056', 'mp-1070925', 'mp-1436393', 'mp-1698539', 'mp-1805412', 'mp-1594611', 'mp-1071044']",1.715e-05,"{'La': 2.0, 'P': 2.0, 'Rh': 2.0}",124.10012586831556,[],NM,False,109,0,"[0, 0, 0, 0, 0, 0]",2.763897277299801e-07,1.715e-05,0,3.43e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1070925.cif,False,,data/final/MP/graphs/La1P1Rh1-MP-mp-1070925.json,0,True,4mm,0,0,0,0,5,0,0,0,0,1,0,1.0,False
Bi2Ca0.92Cu2Sr2.08O8,2,0.0106666666666666,2.0,False,Bi4Ca1.84Cu4Sr4.16O16,Bi4Ca2Cu4Sr4O16,95.3,Cuprate,True,Bi13.333Ca6.133Cu13.333Sr13.867O53.333333333333336,Bi-Ca-Cu-Sr-O,5,Supercon,Bi2Sr2.08Ca0.92Cu2O8,MP-mp-1218930,Sr4Ca2Cu4Bi4O16,Bi-Ca-Cu-Sr-O,Bi13.333Ca6.667Cu13.333Sr13.333O53.333333333333336,C c c 2,orthorhombic,5.417115,5.472898000129128,16.11398919,data/final/MP/cifs/Bi2Ca0.92Cu2Sr2.08O8-MP-mp-1218930-synth_doped.cif,data/source/MP/raw/cifs/mp-1218930.cif,mp-1218930,0.0,,2019-01-12 20:01:06.544000,6.266668983881059,,,,0.039252223722225,4.51768334,520.0,-173.15021002,-5.771673667333333,{'tags': []},-173.15021002,-5.771673667333333,-2.074956548222222,[],False,[],True,2021-05-12 11:00:42.526000,NM,30,3,mp-1218930,oxide,Sr2CaCu2(BiO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",GGA,mp-1218930,"['mp-1218930', 'mp-1359698', 'mp-1817714']",0.00011165,"{'Sr': 4.0, 'Ca': 2.0, 'Cu': 4.0, 'Bi': 4.0, 'O': 16.0}",470.7976286073367,[],NM,False,37,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.743014544498498e-07,0.00011165,0,0.0002233,MP,data/source/MP/cleaned/cifs/MP-mp-1218930.cif,True,,data/final/MP/graphs/Bi2Ca0.92Cu2Sr2.08O8-MP-mp-1218930-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Ba2Ca1Cu2Tl1O7,1,0.0,1.0,True,Ba2Ca1Cu2Tl1O7,Ba2Ca1Cu2Tl1O7,80.8,Cuprate,True,Ba15.385Ca7.692Cu15.385Tl7.692O53.84615384615385,Ba-Ca-Cu-Tl-O,5,Supercon,Tl1Ba2Ca1Cu2O7,MP-mp-632802,Ba2Ca1Tl1Cu2O7,Ba-Ca-Cu-Tl-O,Ba15.385Ca7.692Cu15.385Tl7.692O53.84615384615385,P 4/m m m,tetragonal,3.840502,3.840502,13.048748,data/final/MP/cifs/Ba2Ca1Cu2Tl1O7-MP-mp-632802.cif,data/source/MP/raw/cifs/mp-632802.cif,mp-632802,0.0,,2013-06-21 12:28:47,6.541687864051921,10.17188/1279349,"@misc{osti_1279349,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2CaTlCu2O7 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1279349"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1742071'}},0.0444125982158123,2.89241018,520.0,-71.95529719,-5.535022860769231,{'tags': ['Thallium(III) calcium barium copper oxide (1/1/2/2/7)']},-71.95529719,-5.535022860769231,-1.978767086794871,"['xas', 'bandstructure']",True,[67128],True,2021-05-12 10:57:30.779000,NM,13,10,mp-632802,oxide,Ba2CaTlCu2O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ca_sv', 'Tl_d', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Ca': 1.0, 'Tl': 1.0, 'Cu': 2.0, 'O': 7.0}",GGA,mp-632802,"['mp-699409', 'mp-632802', 'mp-732256', 'mp-743134', 'mp-1182322', 'mp-1394572', 'mp-1742071', 'mp-1785618', 'mp-1654627', 'mp-749845']",0.0282595,"{'Ba': 2.0, 'Ca': 1.0, 'Tl': 1.0, 'Cu': 2.0, 'O': 7.0}",192.461929418226,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.000146831636186,0.0282595,0,0.0282595,MP,data/source/MP/cleaned/cifs/MP-mp-632802.cif,False,,data/final/MP/graphs/Ba2Ca1Cu2Tl1O7-MP-mp-632802.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ag1Mg1,1,0.0,1.0,True,Ag1Mg1,Ag1Mg1,0.0,Other,True,Ag50Mg50,Ag-Mg,2,Supercon,Ag1Mg1,MP-mp-2696,Mg1Ag1,Ag-Mg,Ag50Mg50,P m -3 m,cubic,3.335294,3.335294,3.335294,data/final/MP/cifs/Ag1Mg1-MP-mp-2696.cif,data/source/MP/raw/cifs/mp-2696.cif,mp-2696,0.0,,2011-05-12 18:31:08,5.91548197764998,10.17188/1201269,"@misc{osti_1201269,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MgAg (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201269"",
    place = ""United States"",
    year = ""2016"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688493'}},0.0,3.98400607,520.0,-4.93424514,-2.46712257,{'tags': ['Silver magnesium (1/1)']},-4.93424514,-2.46712257,-0.2507045433333332,"['xas', 'elasticity', 'bandstructure']",True,"[605551, 184205, 605549, 150831, 605541, 151379, 605539, 605538, 605540, 58322]",True,2021-05-12 10:56:18.721000,NM,2,15,mp-2696,,MgAg,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Ag'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Ag': 1.0}",GGA,mp-2696,"['mp-992196', 'mp-990529', 'mp-2696', 'mp-1057036', 'mp-1057005', 'mp-1057065', 'mp-1057916', 'mp-1057946', 'mp-1057906', 'mp-1440966', 'mp-1688493', 'mp-1793856', 'mp-993829', 'mp-1057056', 'mp-1057938']",0.0010003,"{'Mg': 1.0, 'Ag': 1.0}",37.1024310422676,[],NM,False,221,0,"[0, 0]",2.696049751727709e-05,0.0010003,0,0.0010003,MP,data/source/MP/cleaned/cifs/MP-mp-2696.cif,False,,data/final/MP/graphs/Ag1Mg1-MP-mp-2696.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ce0.14Cu1Nd1.86O4,2,0.0399999999999999,1.0,True,Ce0.14Cu1Nd1.86O4,Cu1Nd2O4,22.9,Cuprate,True,Ce2Cu14.286Nd26.571O57.142857142857146,Ce-Cu-Nd-O,4,Supercon,Nd1.86Ce0.14Cu1O4,MP-mp-4158,Nd2Cu1O4,Cu-Nd-O,Cu14.286Nd28.571O57.142857142857146,I 4/m m m,tetragonal,3.973854000245551,3.973854000245551,6.78296857,data/final/MP/cifs/Ce0.14Cu1Nd1.86O4-MP-mp-4158-synth_doped.cif,data/source/MP/raw/cifs/mp-4158.cif,mp-4158,0.0,,2011-05-13 10:19:33,7.086167303782593,10.17188/1207899,"@misc{osti_1207899,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nd2CuO4 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207899"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-670050'}},0.0009497997619085,3.16510927,520.0,-51.48091453,-7.354416361428571,"{'tags': ['Dineodymium copper tetraoxide', 'Dineodymium copper oxide', 'Dineodymium cuprate', 'High pressure experimental phase']}",-51.48091453,-7.354416361428571,-2.971653917142857,"['xas', 'elasticity', 'bandstructure']",True,"[261376, 203228, 160629, 261375, 69479, 186590, 4203, 75830, 75825, 202885, 203229, 71181, 82067, 75828, 69886, 75826, 75829, 75824, 75827, 69482, 86752]",True,2021-05-12 10:56:20.740000,NM,7,11,mp-4158,oxide,Nd2CuO4,"{'functional': 'PBE', 'labels': ['Nd_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Nd': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-4158,"['mp-670050', 'mp-660368', 'mp-4158', 'mp-1078016', 'mp-1173374', 'mp-1440751', 'mp-1668619', 'mp-1797319', 'mp-1588086', 'mp-1590518', 'mp-688505']",0.0084899,"{'Nd': 2.0, 'Cu': 1.0, 'O': 4.0}",97.4899480873212,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",8.708487558528232e-05,0.0084899,0,0.0084899,MP,data/source/MP/cleaned/cifs/MP-mp-4158.cif,True,,data/final/MP/graphs/Ce0.14Cu1Nd1.86O4-MP-mp-4158-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Cu1La1.914Sr0.086O4,2,0.0245714285714285,1.0,True,Cu1La1.914Sr0.086O4,Cu1La2O4,22.25,Cuprate,True,Cu14.286La27.343Sr1.229O57.142857142857146,Cu-La-Sr-O,4,Supercon,La1.914Sr0.086Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La1.914Sr0.086O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La1.914Sr0.086O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Cu1La2O4.005,2,0.0006118078923218,0.9989171868497712,True,Cu0.999La1.998O4,Cu1La2O4,32.0,Cuprate,True,Cu14.276La28.551O57.17344753747324,Cu-La-O,3,Supercon,La2Cu1O4.005,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La2O4.005-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La2O4.005-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Fe1Te0.82,3,0.0989010989010989,2.0,False,Fe2Te1.64,Fe2Te2,0.0,Ferrite,True,Fe54.945Te45.055,Fe-Te,2,Supercon,Fe1Te0.82,MP-mp-21273,Fe2Te2,Fe-Te,Fe50Te50,P 4/n m m,tetragonal,3.65601,3.65601,6.514508,data/final/MP/cifs/Fe1Te0.82-MP-mp-21273-synth_doped.cif,data/source/MP/raw/cifs/mp-21273.cif,mp-21273,0.0,,2015-11-26 15:42:53,6.996625048410066,10.17188/1196541,"@misc{osti_1196541,
    author = ""Persson, Kristin"",
    title = ""Materials Data on FeTe (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196541"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687548'}},0.0764545287500002,6.29104431,520.0,-23.46280856,-5.86570214,"{'tags': ['Iron telluride', 'Iron telluride - beta', 'Iron telluride (1/1)']}",-23.46280856,-5.86570214,-0.2700474499999998,"['xas', 'elasticity', 'bandstructure']",True,"[44753, 633877, 180602, 169974]",True,2021-05-12 10:56:16.728000,FM,4,9,mp-21273,,FeTe,"{'functional': 'PBE', 'labels': ['Fe_pv', 'Te'], 'pot_type': 'paw'}","{'Fe': 1.0, 'Te': 1.0}",GGA,mp-21273,"['mp-991220', 'mp-987578', 'mp-992375', 'mp-21273', 'mp-1439792', 'mp-1687548', 'mp-1800961', 'mp-993959', 'mp-1596778']",1.99364605,"{'Fe': 2.0, 'Te': 2.0}",87.07557914416442,[],FM,True,129,1,"[2.0, 2.0, 0.0, 0.0]",0.0457911637130606,1.99364605,2,3.9872921,MP,data/source/MP/cleaned/cifs/MP-mp-21273.cif,True,,data/final/MP/graphs/Fe1Te0.82-MP-mp-21273-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ba0.33Bi1K0.67O3,2,0.0013333333333333,3.0,False,Ba0.99Bi3K2.01O9,Ba1Bi3K2O9,0.77,Oxide,True,Ba6.6Bi20K13.4O60,Ba-Bi-K-O,4,Supercon,Ba0.33K0.67Bi1O3,MP-mp-1223672,K2Ba1Bi3O9,Ba-Bi-K-O,Ba6.667Bi20K13.333O60,P -3 m 1,trigonal,6.104433996276926,6.1044332,7.481113,data/final/MP/cifs/Ba0.33Bi1K0.67O3-MP-mp-1223672-synth_doped.cif,data/source/MP/raw/cifs/mp-1223672.cif,mp-1223672,0.0,,2019-01-13 00:02:05.715000,6.784857598202287,,,{'GGA': {'task_id': 'mp-1736675'}},0.0209399281666646,2.58339382,520.0,-80.80971432,-5.387314288,{'tags': []},-80.80971432,-5.387314288,-1.7767462414000008,[],False,[],True,2021-05-12 11:00:52.054000,NM,15,4,mp-1223672,oxide,K2Ba(BiO3)3,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Bi', 'O'], 'pot_type': 'paw'}","{'K': 2.0, 'Ba': 1.0, 'Bi': 3.0, 'O': 9.0}",GGA,mp-1223672,"['mp-1223672', 'mp-1408017', 'mp-1736675', 'mp-1774751']",0.001083,"{'K': 2.0, 'Ba': 1.0, 'Bi': 3.0, 'O': 9.0}",241.4279662625217,[],NM,False,164,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.485810060721703e-06,0.001083,0,0.001083,MP,data/source/MP/cleaned/cifs/MP-mp-1223672.cif,True,,data/final/MP/graphs/Ba0.33Bi1K0.67O3-MP-mp-1223672-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
C0.9N0.1Nb1,3,0.0999999999999999,1.0,True,C0.9N0.1Nb1,C1Nb1,16.97,Other,True,C45N5Nb50,C-N-Nb,3,Supercon,Nb1C0.9N0.1,MP-mp-910,Nb1C1,C-Nb,C50Nb50,F m -3 m,cubic,3.18634336,3.1863433599999995,3.1863433599999995,data/final/MP/cifs/C0.9N0.1Nb1-MP-mp-910-synth_doped.cif,data/source/MP/raw/cifs/mp-910.cif,mp-910,0.0,,2011-05-12 17:28:40,7.616098778357742,10.17188/1282001,"@misc{osti_1282001,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbC (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1282001"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686610'}},0.0408750508333302,7.39992982,520.0,-20.24633413,-10.123167065,"{'tags': ['Niobium carbide (1/1)', 'Niobium carbide (1/1) - RS-type']}",-20.24633413,-10.123167065,-0.4591241950000011,"['xas', 'elasticity', 'bandstructure']",True,"[618465, 77214, 187077, 618456, 181792, 618453, 94449, 618472, 183163, 237582, 618457, 159872, 618480, 618475, 618482, 618469, 155164, 618466, 44355, 618450, 618458, 618449, 44496, 618463, 618462, 618460, 618481, 618471, 618476, 181052, 601142, 618448, 189089, 618478, 26955, 618473, 618484, 618483]",True,2021-05-12 10:56:35.166000,NM,2,25,mp-910,,NbC,"{'functional': 'PBE', 'labels': ['Nb_pv', 'C'], 'pot_type': 'paw'}","{'Nb': 1.0, 'C': 1.0}",GGA,mp-910,"['mp-1000444', 'mp-1001333', 'mp-910', 'mp-1057158', 'mp-1057178', 'mp-1057130', 'mp-1057651', 'mp-1057669', 'mp-1057682', 'mp-1057771', 'mp-1057779', 'mp-1057802', 'mp-1060960', 'mp-1060978', 'mp-1061015', 'mp-1440938', 'mp-1686610', 'mp-1805660', 'mp-1007673', 'mp-1593845', 'mp-1596940', 'mp-1061007', 'mp-1057677', 'mp-1057792', 'mp-1057174']",3.33e-05,"{'Nb': 1.0, 'C': 1.0}",22.87508541625878,[],NM,False,225,0,"[0, 0]",1.4557322691495426e-06,3.33e-05,0,3.33e-05,MP,data/source/MP/cleaned/cifs/MP-mp-910.cif,True,,data/final/MP/graphs/C0.9N0.1Nb1-MP-mp-910-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
C2Ca0.2Y0.8,3,0.1333333333333333,1.0,True,C2Ca0.2Y0.8,C2Y1,2.82,Carbon,True,C66.667Ca6.667Y26.667,C-Ca-Y,3,Supercon,Y0.8Ca0.2C2,MP-mp-313,Y1C2,C-Y,C66.667Y33.333,I 4/m m m,tetragonal,3.6847620031018047,4.05388196,3.6847620031018047,data/final/MP/cifs/C2Ca0.2Y0.8-MP-mp-313-synth_doped.cif,data/source/MP/raw/cifs/mp-313.cif,mp-313,0.0,,2011-05-12 18:28:55,4.447058270599283,10.17188/1205571,"@misc{osti_1205571,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YC2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1205571"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686717'}},0.068494783958334,5.01076797,520.0,-25.48704506,-8.495681686666666,{'tags': ['Yttrium carbide (1/2)']},-25.48704506,-8.495681686666666,-0.1890041822222213,"['xas', 'elasticity', 'bandstructure']",True,"[619117, 33607, 619112, 619108, 619126, 74666, 619115, 95963]",True,2021-05-12 10:56:20.740000,NM,3,9,mp-313,,YC2,"{'functional': 'PBE', 'labels': ['Y_sv', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'C': 2.0}",GGA,mp-313,"['mp-1000986', 'mp-313', 'mp-1007425', 'mp-1442291', 'mp-1686717', 'mp-1791028', 'mp-1012183', 'mp-1591717', 'mp-1592070']",0.0001427,"{'Y': 1.0, 'C': 2.0}",42.16722581497335,[],NM,False,139,0,"[0, 0, 0]",3.384144848090244e-06,0.0001427,0,0.0001427,MP,data/source/MP/cleaned/cifs/MP-mp-313.cif,True,,data/final/MP/graphs/C2Ca0.2Y0.8-MP-mp-313-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Nb3Os2,1,0.0,6.0,False,Nb18Os12,Nb18Os12,1.81,Other,True,Nb60Os40,Nb-Os,2,Supercon,Nb3Os2,MP-mp-1220934,Nb18Os12,Nb-Os,Nb60Os40,C m m 2,orthorhombic,5.092609,9.94997279,9.94997279,data/final/MP/cifs/Nb3Os2-MP-mp-1220934.cif,data/source/MP/raw/cifs/mp-1220934.cif,mp-1220934,0.0,,2019-01-12 21:42:15.481000,13.026367343081224,,,,0.0,6.17665875,520.0,-323.73954953,-10.791318317666668,{'tags': []},-323.73954953,-10.791318317666668,-0.2395887916666652,[],False,[],True,2021-05-12 11:00:47.244000,NM,30,3,mp-1220934,,Nb3Os2,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Os_pv'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Os': 2.0}",GGA,mp-1220934,"['mp-1220934', 'mp-1354858', 'mp-1824836']",0.0012448166666666,"{'Nb': 18.0, 'Os': 12.0}",504.17404255339153,[],NM,False,35,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.4814130378814674e-05,0.0012448166666666,0,0.0074689,MP,data/source/MP/cleaned/cifs/MP-mp-1220934.cif,False,,data/final/MP/graphs/Nb3Os2-MP-mp-1220934.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
La2Rh3Si5,1,0.0,2.0,False,La4Rh6Si10,La4Rh6Si10,4.4,Other,True,La20Rh30Si50,La-Rh-Si,3,Supercon,La2Rh3Si5,MP-mp-8620,La4Si10Rh6,La-Rh-Si,La20Rh30Si50,I b a m,orthorhombic,5.923131997115675,8.3374328,8.337432801193998,data/final/MP/cifs/La2Rh3Si5-MP-mp-8620.cif,data/source/MP/raw/cifs/mp-8620.cif,mp-8620,0.0,,2011-06-08 14:35:54,6.812211983031146,10.17188/1309379,"@misc{osti_1309379,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La2Si5Rh3 (SG:72) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1309379"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1675859'}},0.0,8.78438803,520.0,-137.40235334,-6.870117667,{'tags': ['Lanthanum rhodium silicide (2/3/5)']},-137.40235334,-6.870117667,-0.9609668749999998,"['xas', 'bandstructure']",True,[40427],True,2021-05-12 10:57:53.781000,NM,20,10,mp-8620,,La2Si5Rh3,"{'functional': 'PBE', 'labels': ['La', 'Si', 'Rh_pv'], 'pot_type': 'paw'}","{'La': 2.0, 'Si': 5.0, 'Rh': 3.0}",GGA,mp-8620,"['mp-908010', 'mp-922501', 'mp-923284', 'mp-8620', 'mp-1125291', 'mp-1136215', 'mp-1418425', 'mp-1675859', 'mp-1844102', 'mp-1637634']",0.00063895,"{'La': 4.0, 'Si': 10.0, 'Rh': 6.0}",354.403850183985,[],NM,False,72,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.605773468139784e-06,0.00063895,0,0.0012779,MP,data/source/MP/cleaned/cifs/MP-mp-8620.cif,False,,data/final/MP/graphs/La2Rh3Si5-MP-mp-8620.json,0,True,mmm,0,0,0,7,0,0,0,0,0,1,0,1.0,False
N1Pr1,1,0.0,1.0,True,N1Pr1,N1Pr1,0.0,Heavy_fermion,True,N50Pr50,N-Pr,2,Supercon,N1Pr1,MP-mp-343,Pr1N1,N-Pr,N50Pr50,F m -3 m,cubic,3.69189219,3.69189219,3.69189219,data/final/MP/cifs/N1Pr1-MP-mp-343.cif,data/source/MP/raw/cifs/mp-343.cif,mp-343,0.4124999999999996,,2011-05-12 17:44:27,7.229507537404175,10.17188/1206763,"@misc{osti_1206763,
    author = ""Persson, Kristin"",
    title = ""Materials Data on PrN (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1206763"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686759'}},0.0,3.79085564,520.0,-15.6841585,-7.84207925,"{'tags': ['Praseodymium nitride - NaCl-type', 'Praseodymium nitride - NP', 'Praseodymium nitride', 'High pressure experimental phase', 'Praseodymium thorium nitride (1/1/2)']}",-15.6841585,-7.84207925,-1.463882215,"['xas', 'elasticity', 'bandstructure']",True,"[644630, 181482, 644633, 181481, 169199, 168641, 169214, 644631, 644626, 644628, 181480, 644624, 644627, 45161, 644632]",True,2021-05-12 10:56:20.740000,NM,2,9,mp-343,,PrN,"{'functional': 'PBE', 'labels': ['Pr_3', 'N'], 'pot_type': 'paw'}","{'Pr': 1.0, 'N': 1.0}",GGA,mp-343,"['mp-910811', 'mp-926467', 'mp-927043', 'mp-343', 'mp-1440742', 'mp-1686759', 'mp-1795038', 'mp-1594872', 'mp-1596863']",0.0001199,"{'Pr': 1.0, 'N': 1.0}",35.582137347672045,[],NM,False,225,0,"[0, 0]",3.3696682925047625e-06,0.0001199,0,0.0001199,MP,data/source/MP/cleaned/cifs/MP-mp-343.cif,False,,data/final/MP/graphs/N1Pr1-MP-mp-343.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
B6Dy0.01Y0.99,2,0.0028571428571428,1.0,True,B6Dy0.01Y0.99,B6Y1,0.0,Other,True,B85.714Dy0.143Y14.143,B-Dy-Y,3,Supercon,B6Dy0.01Y0.99,MP-mp-2203,Y1B6,B-Y,B85.714Y14.286,P m -3 m,cubic,4.1021,4.1021,4.1021,data/final/MP/cifs/B6Dy0.01Y0.99-MP-mp-2203-synth_doped.cif,data/source/MP/raw/cifs/mp-2203.cif,mp-2203,0.0,,2011-05-12 20:11:15,3.699194842606093,10.17188/1197299,"@misc{osti_1197299,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YB6 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197299"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686414'}},0.0285229421428576,6.62579631,520.0,-49.33978236,-7.048540337142858,"{'tags': ['Yttrium boride (1/6)', 'Yttrium octahedro-hexaboride', 'Yttrium hexaboride']}",-49.33978236,-7.048540337142858,-0.3995658030952376,"['xas', 'elasticity', 'bandstructure']",True,"[194635, 615723, 54730, 615726, 615714, 659505, 76126, 615728, 615710]",True,2021-05-12 10:56:16.728000,NM,7,9,mp-2203,,YB6,"{'functional': 'PBE', 'labels': ['Y_sv', 'B'], 'pot_type': 'paw'}","{'Y': 1.0, 'B': 6.0}",GGA,mp-2203,"['mp-1000404', 'mp-1006875', 'mp-2203', 'mp-1077859', 'mp-1440131', 'mp-1686414', 'mp-1801281', 'mp-1011609', 'mp-1592923']",3.48e-05,"{'Y': 1.0, 'B': 6.0}",69.026957252261,[],NM,False,221,0,"[0, 0, 0, 0, 0, 0, 0]",5.041508620005138e-07,3.48e-05,0,3.48e-05,MP,data/source/MP/cleaned/cifs/MP-mp-2203.cif,True,,data/final/MP/graphs/B6Dy0.01Y0.99-MP-mp-2203-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Pd2Si2Y1,1,0.0,1.0,True,Pd2Si2Y1,Pd2Si2Y1,0.785,Other,True,Pd40Si40Y20,Pd-Si-Y,3,Supercon,Y1Pd2Si2,MP-mp-4822,Y1Si2Pd2,Pd-Si-Y,Pd40Si40Y20,I 4/m m m,tetragonal,4.15526400168001,4.15526400168001,5.800921699999999,data/final/MP/cifs/Pd2Si2Y1-MP-mp-4822.cif,data/source/MP/raw/cifs/mp-4822.cif,mp-4822,0.0,,2011-05-12 23:10:12,6.881947002051371,10.17188/1208425,"@misc{osti_1208425,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Y(SiPd)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208425"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677697'}},0.0,6.57002253,520.0,-32.43802282,-6.487604564,"{'tags': ['Yttrium palladium silicide (1/2/2)', 'Palladium yttrium silicide (2/1/2)']}",-32.43802282,-6.487604564,-0.9522320093333334,"['xas', 'elasticity', 'bandstructure']",True,"[648889, 601236, 427113]",True,2021-05-12 10:56:20.740000,NM,5,13,mp-4822,,Y(SiPd)2,"{'functional': 'PBE', 'labels': ['Y_sv', 'Si', 'Pd'], 'pot_type': 'paw'}","{'Y': 1.0, 'Si': 2.0, 'Pd': 2.0}",GGA,mp-4822,"['mp-1001745', 'mp-1008171', 'mp-4822', 'mp-1070030', 'mp-1069988', 'mp-1070079', 'mp-1124916', 'mp-1441259', 'mp-1677697', 'mp-1782253', 'mp-1012495', 'mp-1588684', 'mp-1070065']",0.0023104,"{'Y': 1.0, 'Si': 2.0, 'Pd': 2.0}",86.36144856132324,[],NM,False,139,0,"[0, 0, 0, 0, 0]",2.675267771081259e-05,0.0023104,0,0.0023104,MP,data/source/MP/cleaned/cifs/MP-mp-4822.cif,False,,data/final/MP/graphs/Pd2Si2Y1-MP-mp-4822.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ta25Ti75,1,0.0,0.04,False,Ta1Ti3,Ta1Ti3,6.0,Other,True,Ta25Ti75,Ta-Ti,2,Supercon,Ta25Ti75,MP-mp-1187250,Ta1Ti3,Ta-Ti,Ta25Ti75,P m -3 m,cubic,4.133054,4.133054,4.133054,data/final/MP/cifs/Ta25Ti75-MP-mp-1187250.cif,data/source/MP/raw/cifs/mp-1187250.cif,mp-1187250,0.0,,2019-01-11 14:56:38.393000,7.633364020731523,,,{'GGA': {'task_id': 'mp-1766248'}},0.0949672124999985,5.75814314,520.0,-35.16438483,-8.7910962075,{'tags': []},-35.16438483,-8.7910962075,0.0949672124999985,['bandstructure'],True,[],True,2021-05-12 10:58:31.620000,NM,4,5,mp-1187250,,TaTi3,"{'functional': 'PBE', 'labels': ['Ta_pv', 'Ti_pv'], 'pot_type': 'paw'}","{'Ta': 1.0, 'Ti': 3.0}",GGA,mp-1187250,"['mp-1187250', 'mp-1427567', 'mp-1766248', 'mp-1799578', 'mp-1616175']",0.0612014,"{'Ta': 1.0, 'Ti': 3.0}",70.60138790677361,[],NM,False,221,0,"[0, 0, 0, 0]",0.0008668583127687,0.0612014,0,0.0612014,MP,data/source/MP/cleaned/cifs/MP-mp-1187250.cif,False,,data/final/MP/graphs/Ta25Ti75-MP-mp-1187250.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ge13Ru4Yb3,1,0.0,2.0,False,Ge26Ru8Yb6,Ge26Ru8Yb6,0.0,Heavy_fermion,True,Ge65Ru20Yb15,Ge-Ru-Yb,3,Supercon,Yb3Ru4Ge13,MP-mp-1202771,Yb6Ge26Ru8,Ge-Ru-Yb,Ge65Ru20Yb15,P m -3 n,cubic,9.023238,9.023238,9.023238,data/final/MP/cifs/Ge13Ru4Yb3-MP-mp-1202771.cif,data/source/MP/raw/cifs/mp-1202771.cif,mp-1202771,0.0,,2019-01-12 06:45:03.826000,8.443132885065207,,,,0.0438117140833327,4.24277894,520.0,-218.17989016,-5.4544972540000005,"{'tags': ['Yb3Rh4Sn13', 'Yb3Ru4Ge13', 'Ytterbium ruthenium germanide (3/4/13)']}",-218.17989016,-5.4544972540000005,-0.3637099752499999,[],False,[637775],True,2021-05-12 11:00:12.709000,NM,40,3,mp-1202771,,Yb3Ge13Ru4,"{'functional': 'PBE', 'labels': ['Yb_2', 'Ge_d', 'Ru_pv'], 'pot_type': 'paw'}","{'Yb': 3.0, 'Ge': 13.0, 'Ru': 4.0}",GGA,mp-1202771,"['mp-1202771', 'mp-1345650', 'mp-1935947']",0.0159945,"{'Yb': 6.0, 'Ge': 26.0, 'Ru': 8.0}",734.6614266740157,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.354250657315941e-05,0.0159945,0,0.031989,MP,data/source/MP/cleaned/cifs/MP-mp-1202771.cif,False,,data/final/MP/graphs/Ge13Ru4Yb3-MP-mp-1202771.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Cu2Sb1,1,0.0,2.0,False,Cu4Sb2,Cu4Sb2,0.085,Other,True,Cu66.667Sb33.333,Cu-Sb,2,Supercon,Cu2Sb1,MP-mp-1825,Cu4Sb2,Cu-Sb,Cu66.667Sb33.333,P 4/n m m,tetragonal,4.008931,4.008931,6.148596,data/final/MP/cifs/Cu2Sb1-MP-mp-1825.cif,data/source/MP/raw/cifs/mp-1825.cif,mp-1825,0.0,,2011-05-13 21:30:16,8.363481634210663,10.17188/1193008,"@misc{osti_1193008,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Cu2Sb (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1193008"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678486'}},0.0,8.19247941,520.0,-24.51508509,-4.085847515,"{'tags': ['Copper antimonide (2/1)', 'Copper(I) copper antimonide', 'Cuprostibite']}",-24.51508509,-4.085847515,-0.0407093216666668,"['xas', 'elasticity', 'bandstructure']",True,"[42323, 412295, 628984, 16843, 181258]",True,2021-05-12 10:56:14.760000,NM,6,8,mp-1825,,Cu2Sb,"{'functional': 'PBE', 'labels': ['Cu_pv', 'Sb'], 'pot_type': 'paw'}","{'Cu': 2.0, 'Sb': 1.0}",GGA,mp-1825,"['mp-909477', 'mp-924617', 'mp-925157', 'mp-1825', 'mp-1438010', 'mp-1678486', 'mp-1795926', 'mp-1591588']",0.0012284,"{'Cu': 4.0, 'Sb': 2.0}",98.81733131600122,[],NM,False,129,0,"[0, 0, 0, 0, 0, 0]",2.4862035508159665e-05,0.0012284,0,0.0024568,MP,data/source/MP/cleaned/cifs/MP-mp-1825.cif,False,,data/final/MP/graphs/Cu2Sb1-MP-mp-1825.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
La0.7Sr0.3Ti1O3,2,0.0133333333333333,3.0,False,La2.1Sr0.9Ti3O9,La2Sr1Ti3O9,0.0,Oxide,True,La14Sr6Ti20O60,La-Sr-Ti-O,4,Supercon,La0.7Sr0.3Ti1O3,MP-mp-1218904,Sr1La2Ti3O9,La-Sr-Ti-O,La13.333Sr6.667Ti20O60,P -3 m 1,trigonal,5.585068000772868,5.5850682,6.830672,data/final/MP/cifs/La0.7Sr0.3Ti1O3-MP-mp-1218904-synth_doped.cif,data/source/MP/raw/cifs/mp-1218904.cif,mp-1218904,0.0,,2019-01-12 19:59:48.166000,5.876637677567727,,,{'GGA': {'task_id': 'mp-1736640'}},0.023043555354187,8.53292476,520.0,-127.7619896,-8.517465973333334,{'tags': []},-127.7619896,-8.517465973333334,-3.611023789444446,[],False,[],True,2021-05-12 11:00:42.526000,NM,15,4,mp-1218904,oxide,SrLa2Ti3O9,"{'functional': 'PBE', 'labels': ['Sr_sv', 'La', 'Ti_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 1.0, 'La': 2.0, 'Ti': 3.0, 'O': 9.0}",GGA,mp-1218904,"['mp-1218904', 'mp-1406224', 'mp-1736640', 'mp-1828534']",0.0004049,"{'Sr': 1.0, 'La': 2.0, 'Ti': 3.0, 'O': 9.0}",184.52321560267407,[],NM,False,164,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.194303836932117e-06,0.0004049,0,0.0004049,MP,data/source/MP/cleaned/cifs/MP-mp-1218904.cif,True,,data/final/MP/graphs/La0.7Sr0.3Ti1O3-MP-mp-1218904-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
As2Ba1Fe0.875Ru1.125,2,0.05,1.0,True,As2Ba1Fe0.875Ru1.125,As2Ba1Fe1Ru1,21.3,Other,True,As40Ba20Fe17.5Ru22.5,As-Ba-Fe-Ru,4,Supercon,Ba1Fe0.875Ru1.125As2,MP-mp-1227957,Ba1Fe1As2Ru1,As-Ba-Fe-Ru,As40Ba20Fe20Ru20,I -4 m 2,tetragonal,4.094864001738776,4.094864001738776,6.95494631,data/final/MP/cifs/As2Ba1Fe0.875Ru1.125-MP-mp-1227957-synth_doped.cif,data/source/MP/raw/cifs/mp-1227957.cif,mp-1227957,0.0,,2019-01-13 03:43:43.313000,6.954649854678861,,,{'GGA': {'task_id': 'mp-1760595'}},0.0416149764999991,4.99960359,520.0,-31.92363508,-6.384727016,{'tags': []},-31.92363508,-6.384727016,-0.5884058670000002,['bandstructure'],True,[],True,2021-05-12 10:58:49.477000,FM,5,5,mp-1227957,,BaFeAs2Ru,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Fe_pv', 'As', 'Ru_pv'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Fe': 1.0, 'As': 2.0, 'Ru': 1.0}",GGA,mp-1227957,"['mp-1227957', 'mp-1384589', 'mp-1760595', 'mp-1795888', 'mp-1627878']",0.1424858,"{'Ba': 1.0, 'Fe': 1.0, 'As': 2.0, 'Ru': 1.0}",106.03277503651196,[],FM,True,119,1,"[0.0, 0.2, 0.0, 0.0, -0.0]",0.0013437901625316,0.1424858,1,0.1424858,MP,data/source/MP/cleaned/cifs/MP-mp-1227957.cif,True,,data/final/MP/graphs/As2Ba1Fe0.875Ru1.125-MP-mp-1227957-synth_doped.json,0,True,-42m,0,0,0,0,6,0,0,0,0,1,0,1.0,False
Al0.1Ca1Ga0.9Si1,3,0.0666666666666666,1.0,True,Al0.1Ca1Ga0.9Si1,Ca1Ga1Si1,3.34,Other,True,Al3.333Ca33.333Ga30Si33.333,Al-Ca-Ga-Si,4,Supercon,Ca1Al0.1Ga0.9Si1,MP-mp-1227042,Ca1Ga1Si1,Ca-Ga-Si,Ca33.333Ga33.333Si33.333,P -6 m 2,hexagonal,4.1465960017798045,4.14659559,4.415886,data/final/MP/cifs/Al0.1Ca1Ga0.9Si1-MP-mp-1227042-synth_doped.cif,data/source/MP/raw/cifs/mp-1227042.cif,mp-1227042,0.0,,2019-01-13 02:55:48.108000,3.4820817999200977,,,{'GGA': {'task_id': 'mp-1765640'}},0.0067707200000004,4.63147582,520.0,-11.79118587,-3.93039529,{'tags': []},-11.79118587,-3.93039529,-0.4203919825,['bandstructure'],True,[],True,2021-05-12 10:58:45.495000,NM,3,5,mp-1227042,,CaGaSi,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Ga_d', 'Si'], 'pot_type': 'paw'}","{'Ca': 1.0, 'Ga': 1.0, 'Si': 1.0}",GGA,mp-1227042,"['mp-1227042', 'mp-1409280', 'mp-1765640', 'mp-1792240', 'mp-1609418']",0.0016061,"{'Ca': 1.0, 'Ga': 1.0, 'Si': 1.0}",65.75546847061287,[],NM,False,187,0,"[0, 0, 0]",2.442534495389978e-05,0.0016061,0,0.0016061,MP,data/source/MP/cleaned/cifs/MP-mp-1227042.cif,True,,data/final/MP/graphs/Al0.1Ca1Ga0.9Si1-MP-mp-1227042-synth_doped.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Ir1V1,1,0.0,2.0,False,Ir2V2,Ir2V2,0.0,Other,True,Ir50V50,Ir-V,2,Supercon,Ir1V1,MP-mp-569250,V2Ir2,Ir-V,Ir50V50,C m m m,orthorhombic,2.822687,4.46341358,4.46341358,data/final/MP/cifs/Ir1V1-MP-mp-569250.cif,data/source/MP/raw/cifs/mp-569250.cif,mp-569250,0.0,,2014-02-16 08:52:23,14.527589697630964,10.17188/1275001,"@misc{osti_1275001,
    author = ""Persson, Kristin"",
    title = ""Materials Data on VIr (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1275001"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671702'}},0.0,8.10013282,520.0,-37.98342482,-9.495856205,"{'tags': ['Iridium vanadium (1/1) - alpha', 'Iridium vanadium (1/1)']}",-37.98342482,-9.495856205,-0.5346879600000012,"['xas', 'elasticity', 'bandstructure']",True,"[104590, 169384]",True,2021-05-12 10:56:22.739000,NM,4,8,mp-569250,,VIr,"{'functional': 'PBE', 'labels': ['V_pv', 'Ir'], 'pot_type': 'paw'}","{'V': 1.0, 'Ir': 1.0}",GGA,mp-569250,"['mp-941890', 'mp-935071', 'mp-941746', 'mp-569250', 'mp-1437797', 'mp-1671702', 'mp-1793942', 'mp-1593742']",3.8e-06,"{'V': 2.0, 'Ir': 2.0}",55.58722362481095,[],NM,False,65,0,"[0, 0, 0, 0]",1.3672206497119953e-07,3.8e-06,0,7.6e-06,MP,data/source/MP/cleaned/cifs/MP-mp-569250.cif,False,,data/final/MP/graphs/Ir1V1-MP-mp-569250.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ba2Cu3Eu0.4Pr0.6O7,2,0.0153846153846153,2.0,False,Ba4Cu6Eu0.8Pr1.2O14,Ba4Cu6Eu1Pr1O14,0.0,Cuprate,True,Ba15.385Cu23.077Eu3.077Pr4.615O53.84615384615385,Ba-Cu-Eu-Pr-O,5,Supercon,Eu0.4Pr0.6Ba2Cu3O7,MP-mp-1228601,Ba4Pr1Eu1Cu6O14,Ba-Cu-Eu-Pr-O,Ba15.385Cu23.077Eu3.846Pr3.846O53.84615384615385,C m m m,orthorhombic,3.879178,7.885327998393908,12.58992067,data/final/MP/cifs/Ba2Cu3Eu0.4Pr0.6O7-MP-mp-1228601-synth_doped.cif,data/source/MP/raw/cifs/mp-1228601.cif,mp-1228601,0.0,,2019-01-13 04:17:40.184000,6.571777011913311,,,,0.0156188576201969,3.16956422,520.0,-161.67470258,-6.218257791538462,{'tags': []},-161.67470258,-6.218257791538462,-2.1029685596153844,[],False,[],True,2021-05-12 11:00:59.151000,FM,26,3,mp-1228601,oxide,Ba4PrEu(Cu3O7)2,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Pr_3', 'Eu', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 4.0, 'Pr': 1.0, 'Eu': 1.0, 'Cu': 6.0, 'O': 14.0}",GGA,mp-1228601,"['mp-1228601', 'mp-1347083', 'mp-1836684']",6.3399007,"{'Ba': 4.0, 'Pr': 1.0, 'Eu': 1.0, 'Cu': 6.0, 'O': 14.0}",365.73710597766734,[],FM,True,65,1,"[0.0, 0.0, 0.0, 0.0, 0.0, 6.3, -0.0, -0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0173345843131025,6.3399007,1,6.3399007,MP,data/source/MP/cleaned/cifs/MP-mp-1228601.cif,True,,data/final/MP/graphs/Ba2Cu3Eu0.4Pr0.6O7-MP-mp-1228601-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ca0.12Cu1La1.88O4,2,0.0342857142857143,1.0,True,Ca0.12Cu1La1.88O4,Cu1La2O4,24.0,Cuprate,True,Ca1.714Cu14.286La26.857O57.142857142857146,Ca-Cu-La-O,4,Supercon,La1.88Ca0.12Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ca0.12Cu1La1.88O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ca0.12Cu1La1.88O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Be13Mg1,1,0.0,2.0,False,Be26Mg2,Be26Mg2,0.0,Other,True,Be92.857Mg7.143,Be-Mg,2,Supercon,Be13Mg1,MP-mp-855,Mg2Be26,Be-Mg,Be92.857Mg7.143,F m -3 c,cubic,7.13174464,7.131744639999999,7.131744639999999,data/final/MP/cifs/Be13Mg1-MP-mp-855.cif,data/source/MP/raw/cifs/mp-855.cif,mp-855,0.0,,2011-05-15 03:00:18,1.831684728171813,10.17188/1309151,"@misc{osti_1309151,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MgBe13 (SG:226) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1309151"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1673514'}},0.0,4.25137995,520.0,-100.47107295,-3.588252605357144,{'tags': ['Beryllium magnesium (13/1)']},-100.47107295,-3.588252605357144,-0.0016349414285719,"['xas', 'elasticity', 'bandstructure']",True,"[616327, 616325, 58713]",True,2021-05-12 10:56:31.128000,NM,28,7,mp-855,,MgBe13,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Be_sv'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Be': 13.0}",GGA,mp-855,"['mp-934565', 'mp-941388', 'mp-941079', 'mp-855', 'mp-1413516', 'mp-1673514', 'mp-1927660']",0.00021575,"{'Mg': 2.0, 'Be': 26.0}",256.4911331331468,[],NM,False,226,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.6823193641395962e-06,0.00021575,0,0.0004315,MP,data/source/MP/cleaned/cifs/MP-mp-855.cif,False,,data/final/MP/graphs/Be13Mg1-MP-mp-855.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Hf2Ni1,1,0.0,2.0,False,Hf4Ni2,Hf4Ni2,0.87,Other,True,Hf66.667Ni33.333,Hf-Ni,2,Supercon,Hf2Ni1,MP-mp-861,Hf4Ni2,Hf-Ni,Hf66.667Ni33.333,I 4/m c m,tetragonal,5.231509998855204,5.232571250634494,5.23257125,data/final/MP/cifs/Hf2Ni1-MP-mp-861.cif,data/source/MP/raw/cifs/mp-861.cif,mp-861,0.0,,2011-05-13 16:55:15,12.84854620559091,10.17188/1272572,"@misc{osti_1272572,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Hf2Ni (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1272572"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677523'}},0.0060807533333324,5.53224787,520.0,-53.42914946,-8.904858243333333,"{'tags': ['Hafnium nickel (2/1)', 'Nickel hafnium (1/2)', 'Hafnium nickel hydride (1/0.5/1.5)']}",-53.42914946,-8.904858243333333,-0.3400201166666659,"['xas', 'elasticity', 'bandstructure']",True,"[638174, 638705, 102808, 638691, 151466]",True,2021-05-12 10:56:31.128000,NM,6,17,mp-861,,Hf2Ni,"{'functional': 'PBE', 'labels': ['Hf_pv', 'Ni_pv'], 'pot_type': 'paw'}","{'Hf': 2.0, 'Ni': 1.0}",GGA,mp-861,"['mp-905535', 'mp-919638', 'mp-861', 'mp-918651', 'mp-1071586', 'mp-1071616', 'mp-1071577', 'mp-1072303', 'mp-1072365', 'mp-1072322', 'mp-1077499', 'mp-1438021', 'mp-1677523', 'mp-1921895', 'mp-1592982', 'mp-1072357', 'mp-1071610']",2.155e-05,"{'Hf': 4.0, 'Ni': 2.0}",107.4428045946703,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0]",4.01143661156235e-07,2.155e-05,0,4.31e-05,MP,data/source/MP/cleaned/cifs/MP-mp-861.cif,False,,data/final/MP/graphs/Hf2Ni1-MP-mp-861.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Bi2Ca1Cu2Sr2O8.051,2,0.0031625805594312,1.9873661532728848,False,Bi3.975Ca1.987Cu3.975Sr3.975O16,Bi4Ca2Cu4Sr4O16,0.0,Cuprate,True,Bi13.288Ca6.644Cu13.288Sr13.288O53.4914623613049,Bi-Ca-Cu-Sr-O,5,Supercon,Bi2Sr2Ca1Cu2O8.051,MP-mp-1218930,Sr4Ca2Cu4Bi4O16,Bi-Ca-Cu-Sr-O,Bi13.333Ca6.667Cu13.333Sr13.333O53.333333333333336,C c c 2,orthorhombic,5.417115,5.472898000129128,16.11398919,data/final/MP/cifs/Bi2Ca1Cu2Sr2O8.051-MP-mp-1218930-synth_doped.cif,data/source/MP/raw/cifs/mp-1218930.cif,mp-1218930,0.0,,2019-01-12 20:01:06.544000,6.266668983881059,,,,0.039252223722225,4.51768334,520.0,-173.15021002,-5.771673667333333,{'tags': []},-173.15021002,-5.771673667333333,-2.074956548222222,[],False,[],True,2021-05-12 11:00:42.526000,NM,30,3,mp-1218930,oxide,Sr2CaCu2(BiO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",GGA,mp-1218930,"['mp-1218930', 'mp-1359698', 'mp-1817714']",0.00011165,"{'Sr': 4.0, 'Ca': 2.0, 'Cu': 4.0, 'Bi': 4.0, 'O': 16.0}",470.7976286073367,[],NM,False,37,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.743014544498498e-07,0.00011165,0,0.0002233,MP,data/source/MP/cleaned/cifs/MP-mp-1218930.cif,True,,data/final/MP/graphs/Bi2Ca1Cu2Sr2O8.051-MP-mp-1218930-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Ba2Cu1Hg1O4.162,2,0.01984807645185,0.9610191013935608,True,Ba1.922Cu0.961Hg0.961O4,Ba2Cu1Hg1O4,97.4,Cuprate,True,Ba24.504Cu12.252Hg12.252O50.99240382259251,Ba-Cu-Hg-O,4,Supercon,Hg1Ba2Cu1O4.162,MP-mp-6562,Ba2Cu1Hg1O4,Ba-Cu-Hg-O,Ba25Cu12.5Hg12.5O50,P 4/m m m,tetragonal,3.933714,3.933714,9.827602,data/final/MP/cifs/Ba2Cu1Hg1O4.162-MP-mp-6562-synth_doped.cif,data/source/MP/raw/cifs/mp-6562.cif,mp-6562,0.0,,2011-05-13 18:18:06,6.582036471328142,10.17188/1281336,"@misc{osti_1281336,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2CuHgO4 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281336"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697135'}},0.0234340381250053,2.58068675,520.0,-40.91481298,-5.1143516225,"{'tags': ['Mercury dibarium copper oxide', 'High pressure experimental phase']}",-40.91481298,-5.1143516225,-1.953767533125,"['xas', 'bandstructure']",True,"[75722, 75720, 75724, 75721, 75723]",True,2021-05-12 10:57:32.679000,NM,8,8,mp-6562,oxide,Ba2CuHgO4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Cu_pv', 'Hg', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",GGA,mp-6562,"['mp-6562', 'mp-990899', 'mp-992892', 'mp-1435690', 'mp-1697135', 'mp-1878488', 'mp-994198', 'mp-1592659']",0.0003984,"{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",152.07335344042525,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0, 0, 0]",2.619788352047311e-06,0.0003984,0,0.0003984,MP,data/source/MP/cleaned/cifs/MP-mp-6562.cif,True,,data/final/MP/graphs/Ba2Cu1Hg1O4.162-MP-mp-6562-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
H4Si1,1,0.0,4.0,False,H16Si4,H16Si4,17.0,Other,True,H80Si20,H-Si,2,Supercon,H4Si1,MP-mp-23739,Si4H16,H-Si,H80Si20,P 1 21/c 1,monoclinic,5.059625,7.649027,7.69349057,data/final/MP/cifs/H4Si1-MP-mp-23739.cif,data/source/MP/raw/cifs/mp-23739.cif,mp-23739,6.5933,,2013-09-26 09:53:52,0.7373883725024172,10.17188/1199699,"@misc{osti_1199699,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SiH4 (SG:14) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199699"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1684315'}},0.0,-4.16865458,520.0,-75.73564266,-3.786782133,"{'tags': ['Silane - V', 'High pressure experimental phase']}",-75.73564266,-3.786782133,-0.1307384929999998,"['diel', 'xas', 'bandstructure']",True,[159307],True,2021-05-12 10:56:45.290000,NM,20,11,mp-23739,,SiH4,"{'functional': 'PBE', 'labels': ['Si', 'H'], 'pot_type': 'paw'}","{'Si': 1.0, 'H': 4.0}",GGA,mp-23739,"['mp-657561', 'mp-664609', 'mp-679531', 'mp-23739', 'mp-1125122', 'mp-1141088', 'mp-1146372', 'mp-1253815', 'mp-1342891', 'mp-1684315', 'mp-1925381']",2.005e-05,"{'Si': 4.0, 'H': 16.0}",289.3019034794975,[],NM,False,14,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.772190539896799e-07,2.005e-05,0,8.02e-05,MP,data/source/MP/cleaned/cifs/MP-mp-23739.cif,False,,data/final/MP/graphs/H4Si1-MP-mp-23739.json,0,True,2/m,0,0,3,0,0,0,0,1,0,0,0,1.0,False
Cu0.97La2Li0.03O4,2,0.0085714285714285,1.0,True,Cu0.97La2Li0.03O4,Cu1La2O4,0.0,Cuprate,True,Cu13.857La28.571Li0.429O57.142857142857146,Cu-La-Li-O,4,Supercon,La2Cu0.97Li0.03O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu0.97La2Li0.03O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu0.97La2Li0.03O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As3W2,1,0.0,2.0,False,As6W4,As6W4,0.0,Other,True,As60W40,As-W,2,Supercon,As3W2,MP-mp-11696,As6W4,As-W,As60W40,C 1 2/m 1,monoclinic,3.308197998630541,6.94875089,8.227601568116864,data/final/MP/cifs/As3W2-MP-mp-11696.cif,data/source/MP/raw/cifs/mp-11696.cif,mp-11696,0.0,,2011-05-29 20:49:27,11.060425882555302,10.17188/1188288,"@misc{osti_1188288,
    author = ""Persson, Kristin"",
    title = ""Materials Data on As3W2 (SG:12) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188288"",
    place = ""United States"",
    year = ""2015"",
    month = ""5"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704895'}},0.0,6.59116657,520.0,-80.59738993,-8.059738993,{'tags': ['Tungsten arsenide (2/3)']},-80.59738993,-8.059738993,-0.0810173620000014,"['xas', 'elasticity', 'bandstructure']",True,[43185],True,2021-05-12 10:56:12.755000,NM,10,8,mp-11696,,As3W2,"{'functional': 'PBE', 'labels': ['As', 'W_pv'], 'pot_type': 'paw'}","{'As': 3.0, 'W': 2.0}",GGA,mp-11696,"['mp-943243', 'mp-933014', 'mp-942227', 'mp-11696', 'mp-1437363', 'mp-1704895', 'mp-1832237', 'mp-1601626']",0.00035675,"{'As': 6.0, 'W': 4.0}",177.89147464125318,[],NM,False,12,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.010872367205274e-06,0.00035675,0,0.0007135,MP,data/source/MP/cleaned/cifs/MP-mp-11696.cif,False,,data/final/MP/graphs/As3W2-MP-mp-11696.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
Ni1.5V0.5Zr1,1,0.0,2.0,False,Ni3V1Zr2,Ni3V1Zr2,0.43,Other,True,Ni50V16.667Zr33.333,Ni-V-Zr,3,Supercon,Zr1Ni1.5V0.5,MP-mp-1215561,Zr2V1Ni3,Ni-V-Zr,Ni50V16.667Zr33.333,R -3 m,trigonal,4.93524362,4.93524362,4.93524365,data/final/MP/cifs/Ni1.5V0.5Zr1-MP-mp-1215561.cif,data/source/MP/raw/cifs/mp-1215561.cif,mp-1215561,0.0,,2019-01-12 17:13:36.164000,7.777543745550218,,,{'GGA': {'task_id': 'mp-1758117'}},0.076052419444446,6.36458486,520.0,-45.40209717,-7.567016195,{'tags': []},-45.40209717,-7.567016195,-0.3137299666666659,['bandstructure'],True,[],True,2021-05-12 10:58:39.488000,FM,6,5,mp-1215561,,Zr2VNi3,"{'functional': 'PBE', 'labels': ['Zr_sv', 'V_pv', 'Ni_pv'], 'pot_type': 'paw'}","{'Zr': 2.0, 'V': 1.0, 'Ni': 3.0}",GGA,mp-1215561,"['mp-1215561', 'mp-1400780', 'mp-1758117', 'mp-1781599', 'mp-1627580']",0.2889317,"{'Zr': 2.0, 'V': 1.0, 'Ni': 3.0}",87.42354343271906,[],FM,True,166,1,"[0.0, 0.0, 0.1, 0.0, 0.0, 0.0]",0.0033049644141038,0.2889317,1,0.2889317,MP,data/source/MP/cleaned/cifs/MP-mp-1215561.cif,False,,data/final/MP/graphs/Ni1.5V0.5Zr1-MP-mp-1215561.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Mo1,1,0.0,16.0,False,Mo16,Mo16,0.912666667,Other,True,Mo100,Mo,1,Supercon,Mo1,MP-mp-1181019,Mo16,Mo,Mo100,P 1 21 1,monoclinic,5.03927701,5.193482,10.06938086,data/final/MP/cifs/Mo1-MP-mp-1181019.cif,data/source/MP/raw/cifs/mp-1181019.cif,mp-1181019,0.0,,2019-01-11 10:07:08.701000,9.761774227467829,,,,0.331955426875,7.94673155,520.0,-168.21900165,-10.513687603125,{'tags': []},-168.21900165,-10.513687603125,0.331955426875,[],False,[],True,2021-05-12 10:59:47.973000,NM,16,2,mp-1181019,,Mo,"{'functional': 'PBE', 'labels': ['Mo_pv'], 'pot_type': 'paw'}",{'Mo': 1.0},GGA,mp-1181019,"['mp-1181019', 'mp-1933987']",2.758125e-05,{'Mo': 16.0},261.1199387936331,[],NM,False,4,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.690027969670925e-06,2.758125e-05,0,0.0004413,MP,data/source/MP/cleaned/cifs/MP-mp-1181019.cif,False,,data/final/MP/graphs/Mo1-MP-mp-1181019.json,0,True,2,0,0,1,0,0,0,0,1,0,0,0,1.0,False
Ga0.255V0.745,2,0.01,8.0,False,Ga2.04V5.96,Ga2V6,13.9,Other,True,Ga25.5V74.5,Ga-V,2,Supercon,Ga0.255V0.745,MP-mp-22568,V6Ga2,Ga-V,Ga25V75,P m -3 n,cubic,4.789645,4.789645,4.789645,data/final/MP/cifs/Ga0.255V0.745-MP-mp-22568-synth_doped.cif,data/source/MP/raw/cifs/mp-22568.cif,mp-22568,0.0,,2014-02-22 11:36:40,6.726541666276222,10.17188/1198793,"@misc{osti_1198793,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Ga (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198793"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686867'}},0.0,5.67452231,520.0,-61.95244347,-7.74405543375,{'tags': ['Gallium vanadium (1/3)']},-61.95244347,-7.74405543375,-0.1741018756249994,"['xas', 'elasticity', 'bandstructure']",True,"[635643, 635628, 635619, 635634, 104021, 635646, 635604, 635610, 635617, 635624, 635626, 635605, 635631, 635625, 635636, 635603, 104020, 635616, 635607]",True,2021-05-12 10:56:16.728000,FM,8,9,mp-22568,,V3Ga,"{'functional': 'PBE', 'labels': ['V_pv', 'Ga_d'], 'pot_type': 'paw'}","{'V': 3.0, 'Ga': 1.0}",GGA,mp-22568,"['mp-941343', 'mp-941663', 'mp-934924', 'mp-22568', 'mp-1440749', 'mp-1686867', 'mp-1804076', 'mp-1593784', 'mp-1595713']",0.09063635,"{'V': 6.0, 'Ga': 2.0}",109.87780534443452,[],FM,True,131,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.0, -0.0, -0.0]",0.0016497662965852,0.09063635,2,0.1812727,MP,data/source/MP/cleaned/cifs/MP-mp-22568.cif,True,,data/final/MP/graphs/Ga0.255V0.745-MP-mp-22568-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
C2I2Y2,1,0.0,1.0,True,C2I2Y2,C2I2Y2,9.9175,Other,True,C33.333I33.333Y33.333,C-I-Y,3,Supercon,Y2I2C2,MP-mp-23062,Y2C2I2,C-I-Y,C33.333I33.333Y33.333,C 1 2/m 1,monoclinic,3.914206004628932,4.15558825,10.78092902,data/final/MP/cifs/C2I2Y2-MP-mp-23062.cif,data/source/MP/raw/cifs/mp-23062.cif,mp-23062,0.0,,2014-02-21 06:41:11,4.900237993988967,10.17188/1199207,"@misc{osti_1199207,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YCI (SG:12) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199207"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698423'}},0.0,4.3403649,520.0,-39.59005325,-6.5983422083333325,"{'tags': ['Yttrium iodide carbide (2/2/2)', 'Yttrium carbide iodide (2/2/2)', 'High pressure experimental phase']}",-39.59005325,-6.5983422083333325,-0.9855873988888888,"['xas', 'elasticity', 'bandstructure']",True,"[400298, 153860, 153861, 153862]",True,2021-05-12 10:56:16.728000,NM,6,8,mp-23062,,YCI,"{'functional': 'PBE', 'labels': ['Y_sv', 'C', 'I'], 'pot_type': 'paw'}","{'Y': 1.0, 'C': 1.0, 'I': 1.0}",GGA,mp-23062,"['mp-918746', 'mp-919706', 'mp-905745', 'mp-23062', 'mp-1435572', 'mp-1698423', 'mp-1781217', 'mp-1592690']",0.0001098,"{'Y': 2.0, 'C': 2.0, 'I': 2.0}",154.40299200435598,[],NM,False,12,0,"[0, 0, 0, 0, 0, 0]",1.4222522319632556e-06,0.0001098,0,0.0002196,MP,data/source/MP/cleaned/cifs/MP-mp-23062.cif,False,,data/final/MP/graphs/C2I2Y2-MP-mp-23062.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
B2Ho0.1Lu0.9Ru1,2,0.0499999999999999,4.0,False,B8Ho0.4Lu3.6Ru4,B8Lu4Ru4,7.53,Other,True,B50Ho2.5Lu22.5Ru25,B-Ho-Lu-Ru,4,Supercon,Lu0.9Ho0.1Ru1B2,MP-mp-29239,Lu4B8Ru4,B-Lu-Ru,B50Lu25Ru25,P n m a,orthorhombic,5.262881,5.829858,6.288542,data/final/MP/cifs/B2Ho0.1Lu0.9Ru1-MP-mp-29239-synth_doped.cif,data/source/MP/raw/cifs/mp-29239.cif,mp-29239,0.0,,2014-02-24 06:45:28,10.246997128776938,10.17188/1203618,"@misc{osti_1203618,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LuB2Ru (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1203618"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677301'}},0.0,6.02142224,520.0,-119.30016105,-7.456260065625,"{'tags': ['Lutetium ruthenium(III) boride', 'Lutetium ruthenium boride (1/1/2)']}",-119.30016105,-7.456260065625,-0.6677291364583331,"['xas', 'bandstructure']",True,"[614715, 100774]",True,2021-05-12 10:57:03.017000,NM,16,8,mp-29239,,LuB2Ru,"{'functional': 'PBE', 'labels': ['Lu_3', 'B', 'Ru_pv'], 'pot_type': 'paw'}","{'Lu': 1.0, 'B': 2.0, 'Ru': 1.0}",GGA,mp-29239,"['mp-909473', 'mp-925177', 'mp-924466', 'mp-29239', 'mp-1381674', 'mp-1677301', 'mp-1784701', 'mp-1603819']",4.565e-05,"{'Lu': 4.0, 'B': 8.0, 'Ru': 4.0}",192.9440954509509,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",9.4638812124945e-07,4.565e-05,0,0.0001826,MP,data/source/MP/cleaned/cifs/MP-mp-29239.cif,True,,data/final/MP/graphs/B2Ho0.1Lu0.9Ru1-MP-mp-29239-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ho2Rh3Si5,1,0.0,2.0,False,Ho4Rh6Si10,Ho4Rh6Si10,0.0,Other,True,Ho20Rh30Si50,Ho-Rh-Si,3,Supercon,Ho2Rh3Si5,MP-mp-1212337,Ho4Si10Rh6,Ho-Rh-Si,Ho20Rh30Si50,I b a m,orthorhombic,5.745537996660919,8.15180959,8.151809590487003,data/final/MP/cifs/Ho2Rh3Si5-MP-mp-1212337.cif,data/source/MP/raw/cifs/mp-1212337.cif,mp-1212337,0.0,,2019-01-12 14:32:37.440000,7.8301266753850305,,,{'GGA': {'task_id': 'mp-1685056'}},0.0,7.2819166,520.0,-136.05864406,-6.802932203,"{'tags': ['U2Co3Si5', 'Ho2Rh3Si5']}",-136.05864406,-6.802932203,-0.9645010580000004,[],False,[],True,2021-05-12 11:00:28.874000,NM,20,4,mp-1212337,,Ho2Si5Rh3,"{'functional': 'PBE', 'labels': ['Ho_3', 'Si', 'Rh_pv'], 'pot_type': 'paw'}","{'Ho': 2.0, 'Si': 5.0, 'Rh': 3.0}",GGA,mp-1212337,"['mp-1212337', 'mp-1344369', 'mp-1685056', 'mp-1809442']",4.925e-05,"{'Ho': 4.0, 'Si': 10.0, 'Rh': 6.0}",330.4078443198521,[],NM,False,72,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.981164088363678e-07,4.925e-05,0,9.85e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1212337.cif,False,,data/final/MP/graphs/Ho2Rh3Si5-MP-mp-1212337.json,0,True,mmm,0,0,0,7,0,0,0,0,0,1,0,1.0,False
B4Er0.76Gd0.24Rh4,3,0.0533333333333333,2.0,False,B8Er1.52Gd0.48Rh8,B8Er2Rh8,4.18,Other,True,B44.444Er8.444Gd2.667Rh44.444,B-Er-Gd-Rh,4,Supercon,Er0.76Gd0.24Rh4B4,MP-mp-8408,Er2B8Rh8,B-Er-Rh,B44.444Er11.111Rh44.444,P 42/n m c,tetragonal,5.336304,5.336304,7.44528,data/final/MP/cifs/B4Er0.76Gd0.24Rh4-MP-mp-8408-synth_doped.cif,data/source/MP/raw/cifs/mp-8408.cif,mp-8408,0.0,,2011-06-07 02:27:50,9.745285939793032,10.17188/1308086,"@misc{osti_1308086,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Er(BRh)4 (SG:137) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1308086"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1673724'}},0.0133402750000009,6.84272912,520.0,-131.92031901,-7.328906611666666,{'tags': ['Erbium rhodium boride (1/4/4)']},-131.92031901,-7.328906611666666,-0.5797380146296286,"['xas', 'bandstructure']",True,"[613809, 601530, 49631]",True,2021-05-12 10:57:51.871000,NM,18,8,mp-8408,,Er(BRh)4,"{'functional': 'PBE', 'labels': ['Er_3', 'B', 'Rh_pv'], 'pot_type': 'paw'}","{'Er': 1.0, 'B': 4.0, 'Rh': 4.0}",GGA,mp-8408,"['mp-932384', 'mp-931412', 'mp-8408', 'mp-915879', 'mp-1434188', 'mp-1673724', 'mp-1785064', 'mp-1597242']",7.985e-05,"{'Er': 2.0, 'B': 8.0, 'Rh': 8.0}",212.01283845150363,[],NM,False,137,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",7.532562705467018e-07,7.985e-05,0,0.0001597,MP,data/source/MP/cleaned/cifs/MP-mp-8408.cif,True,,data/final/MP/graphs/B4Er0.76Gd0.24Rh4-MP-mp-8408-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B4Ho1Ru4,1,0.0,4.0,False,B16Ho4Ru16,B16Ho4Ru16,0.0,Other,True,B44.444Ho11.111Ru44.444,B-Ho-Ru,3,Supercon,Ho1Ru4B4,MP-mp-1204787,Ho4B16Ru16,B-Ho-Ru,B44.444Ho11.111Ru44.444,I 41/a c d,tetragonal,7.481251998814142,7.481251998814142,9.19521491,data/final/MP/cifs/B4Ho1Ru4-MP-mp-1204787.cif,data/source/MP/raw/cifs/mp-1204787.cif,mp-1204787,0.0,,2019-01-12 08:24:23.878000,9.663869803929725,,,{'GGA': {'task_id': 'mp-1742374'}},0.0,6.91856826,520.0,-291.57621872,-8.099339408888888,{'tags': ['Holmium ruthenium boride (1/4/4)']},-291.57621872,-8.099339408888888,-0.499613345185185,[],False,[614511],True,2021-05-12 11:00:14.977000,NM,36,4,mp-1204787,,Ho(BRu)4,"{'functional': 'PBE', 'labels': ['Ho_3', 'B', 'Ru_pv'], 'pot_type': 'paw'}","{'Ho': 1.0, 'B': 4.0, 'Ru': 4.0}",GGA,mp-1204787,"['mp-1204787', 'mp-1444845', 'mp-1742374', 'mp-1819267']",0.001743175,"{'Ho': 4.0, 'B': 16.0, 'Ru': 16.0}",420.9511698737424,[],NM,False,142,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.6564153989859085e-05,0.001743175,0,0.0069727,MP,data/source/MP/cleaned/cifs/MP-mp-1204787.cif,False,,data/final/MP/graphs/B4Ho1Ru4-MP-mp-1204787.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As1Co0.05Fe0.95Na1,2,0.0333333333333333,2.0,False,As2Co0.1Fe1.9Na2,As2Fe2Na2,16.3,Ferrite,True,As33.333Co1.667Fe31.667Na33.333,As-Co-Fe-Na,4,Supercon,Na1Fe0.95Co0.05As1,MP-mp-22152,Na2Fe2As2,As-Fe-Na,As33.333Fe33.333Na33.333,P 4/n m m,tetragonal,3.923688,3.923688,6.918844,data/final/MP/cifs/As1Co0.05Fe0.95Na1-MP-mp-22152-synth_doped.cif,data/source/MP/raw/cifs/mp-22152.cif,mp-22152,0.0,,2014-02-21 10:51:39,4.793908463406792,10.17188/1197381,"@misc{osti_1197381,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NaFeAs (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197381"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704688'}},0.0,4.10723066,520.0,-30.57538864,-5.095898106666667,{'tags': ['Sodium iron arsenide']},-30.57538864,-5.095898106666667,-0.2786807238505749,"['xas', 'elasticity', 'bandstructure']",True,"[163144, 163143]",True,2021-05-12 10:56:16.728000,FM,6,8,mp-22152,,NaFeAs,"{'functional': 'PBE', 'labels': ['Na_pv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Na': 1.0, 'Fe': 1.0, 'As': 1.0}",GGA,mp-22152,"['mp-906352', 'mp-920130', 'mp-919102', 'mp-22152', 'mp-1413190', 'mp-1704688', 'mp-1797758', 'mp-1594769']",0.0693226,"{'Na': 2.0, 'Fe': 2.0, 'As': 2.0}",106.5178694490858,[],FM,True,129,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.0]",0.0013016144682303,0.0693226,2,0.1386452,MP,data/source/MP/cleaned/cifs/MP-mp-22152.cif,True,,data/final/MP/graphs/As1Co0.05Fe0.95Na1-MP-mp-22152-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B2C1Ni1.82Pd0.18Y1,3,0.0599999999999999,1.0,True,B2C1Ni1.82Pd0.18Y1,B2C1Ni2Y1,11.8,Other,True,B33.333C16.667Ni30.333Pd3Y16.667,B-C-Ni-Pd-Y,5,Supercon,Y1Ni1.82Pd0.18B2C1,MP-mp-6576,Y1Ni2B2C1,B-C-Ni-Y,B33.333C16.667Ni33.333Y16.667,I 4/m m m,tetragonal,3.548790000501972,3.548790000501972,5.76144136,data/final/MP/cifs/B2C1Ni1.82Pd0.18Y1-MP-mp-6576-synth_doped.cif,data/source/MP/raw/cifs/mp-6576.cif,mp-6576,0.0,,2011-05-13 05:21:43,6.099730998852292,10.17188/1281366,"@misc{osti_1281366,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281366"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688230'}},0.0,6.81083016,520.0,-43.677878,-7.279646333333333,{'tags': []},-43.677878,-7.279646333333333,-0.5109282141666659,"['xas', 'bandstructure']",True,"[75816, 89142, 83231, 79574, 41549]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6576,,YNi2B2C,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6576,"['mp-6576', 'mp-1007054', 'mp-1000583', 'mp-1439516', 'mp-1688230', 'mp-1794280', 'mp-1011792', 'mp-1597064']",0.0006603,"{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.3152437079014,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",1.010943177297096e-05,0.0006603,0,0.0006603,MP,data/source/MP/cleaned/cifs/MP-mp-6576.cif,True,,data/final/MP/graphs/B2C1Ni1.82Pd0.18Y1-MP-mp-6576-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
La1.8Ni1Sr0.2O4,3,0.0571428571428571,4.0,False,La7.2Ni4Sr0.8O16,La8Ni4O16,0.0,Oxide,True,La25.714Ni14.286Sr2.857O57.142857142857146,La-Ni-Sr-O,4,Supercon,La1.8Sr0.2Ni1O4,MP-mp-21874,La8Ni4O16,La-Ni-O,La28.571Ni14.286O57.142857142857146,P 42/n c m,tetragonal,5.607892,5.607892,12.423229,data/final/MP/cifs/La1.8Ni1Sr0.2O4-MP-mp-21874-synth_doped.cif,data/source/MP/raw/cifs/mp-21874.cif,mp-21874,0.0346000000000001,,2013-06-09 07:15:40,6.808946783295827,,,{'GGA+U': {'task_id': 'mp-1767279'}},0.0468913437499995,7.93744356,520.0,-206.53456634,-7.376234512142857,"{'tags': ['Dilanthanum niccolate', 'Dilanthanum niccolate - LT']}",-206.53456634,-7.376234512142857,-3.0683780964285714,"['xas', 'bandstructure']",True,"[63396, 65920, 69753, 56319]",True,2021-05-12 10:57:01.079000,AFM,28,17,mp-21874,oxide,La2NiO4,"{'functional': 'PBE', 'labels': ['La', 'Ni_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Ni': 1.0, 'O': 4.0}",GGA+U,mp-21874,"['mp-795798', 'mp-819481', 'mp-616538', 'mp-25711', 'mp-21874', 'mp-1272397', 'mp-1287242', 'mp-1273910', 'mp-1289543', 'mp-1295462', 'mp-1287775', 'mp-1281171', 'mp-1283506', 'mp-1422956', 'mp-1767279', 'mp-820353', 'mp-1629609']",2.9e-06,"{'La': 8.0, 'Ni': 4.0, 'O': 16.0}",390.6913293848223,[],AFM,True,14,1,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -1.7, -1.7, 1.7, 1.7, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",2.9690958379509523e-08,2.9e-06,4,1.16e-05,MP,data/source/MP/cleaned/cifs/MP-mp-21874.cif,True,,data/final/MP/graphs/La1.8Ni1Sr0.2O4-MP-mp-21874-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
La0.88Mo6Se8,2,0.0150537634408603,1.0,True,La0.88Mo6Se8,La1Mo6Se8,10.25,Chevrel,True,La5.914Mo40.323Se53.763,La-Mo-Se,3,Supercon,La0.88Mo6Se8,MP-mp-37784,La1Mo6Se8,La-Mo-Se,La6.667Mo40Se53.333,R -3,trigonal,6.84882661,6.84882661,6.84882641,data/final/MP/cifs/La0.88Mo6Se8-MP-mp-37784-synth_doped.cif,data/source/MP/raw/cifs/mp-37784.cif,mp-37784,0.0,,2013-11-13 11:12:22,6.964358050864285,,,{'GGA': {'task_id': 'mp-1669492'}},0.0265230636249986,5.68236385,520.0,-109.21685909,-7.281123939333333,"{'tags': ['Lanthanum molybdenum(II/III) selenide (1/6/8)', 'Lanthanum molybdenum selenide (1/6/8)', 'Lanthanum molybdenum(II/III) selenide  (1/6/8)']}",-109.21685909,-7.281123939333333,-1.001046798916666,"['xas', 'bandstructure']",True,"[641459, 641461, 600706, 600656]",True,2021-05-12 10:57:34.594000,FM,15,11,mp-37784,,La(Mo3Se4)2,"{'functional': 'PBE', 'labels': ['La', 'Mo_pv', 'Se'], 'pot_type': 'paw'}","{'La': 1.0, 'Mo': 6.0, 'Se': 8.0}",GGA,mp-37784,"['mp-948248', 'mp-676259', 'mp-949023', 'mp-937946', 'mp-1104045', 'mp-1104421', 'mp-37784', 'mp-1413507', 'mp-1669492', 'mp-1810114', 'mp-1598006']",0.6990221,"{'La': 1.0, 'Mo': 6.0, 'Se': 8.0}",320.98579209458114,[],FM,True,148,1,"[0.0, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0021777353303975,0.6990221,6,0.6990221,MP,data/source/MP/cleaned/cifs/MP-mp-37784.cif,True,,data/final/MP/graphs/La0.88Mo6Se8-MP-mp-37784-synth_doped.json,0,True,-3,0,0,0,0,0,0,2,1,0,0,0,1.0,False
As1Co0.225Fe0.775Sm1O1,3,0.1124999999999999,2.0,False,As2Co0.45Fe1.55Sm2O2,As2Fe2Sm2O2,0.0,Ferrite,True,As25Co5.625Fe19.375Sm25O25,As-Co-Fe-Sm-O,5,Supercon,Sm1Fe0.775Co0.225As1O1,MP-mp-20349,Sm2Fe2As2O2,As-Fe-Sm-O,As25Fe25Sm25O25,P 4/n m m,tetragonal,4.026492,4.026492,9.046755,data/final/MP/cifs/As1Co0.225Fe0.775Sm1O1-MP-mp-20349-synth_doped.cif,data/source/MP/raw/cifs/mp-20349.cif,mp-20349,0.0,,2014-02-19 11:24:42,6.727802583283198,,,{'GGA+U': {'task_id': 'mp-1695938'}},0.3015723809374986,3.77685593,520.0,-52.73407138,-6.5917589225,{'tags': ['Samarium iron arsenic oxide (1/1/1/1)']},-52.73407138,-6.5917589225,-1.6285904237499995,"['xas', 'elasticity', 'bandstructure']",True,"[236652, 236653, 422002, 163457, 163458]",True,2021-05-12 10:56:16.728000,FM,8,10,mp-20349,oxide,SmFeAsO,"{'functional': 'PBE', 'labels': ['Sm_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Sm': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-20349,"['mp-24944', 'mp-1078897', 'mp-1079866', 'mp-1173321', 'mp-20349', 'mp-1425472', 'mp-1695938', 'mp-1772503', 'mp-1789694', 'mp-1588381']",3.75729895,"{'Sm': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",146.67176231613362,[],FM,True,129,1,"[0.0, 0.0, 3.5, 3.5, -0.0, -0.0, -0.0, -0.0]",0.0512341147425717,3.75729895,2,7.5145979,MP,data/source/MP/cleaned/cifs/MP-mp-20349.cif,True,,data/final/MP/graphs/As1Co0.225Fe0.775Sm1O1-MP-mp-20349-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Fe1S0.1Se0.9,3,0.0999999999999999,2.0,False,Fe2S0.2Se1.8,Fe2Se2,10.27,Ferrite,True,Fe50S5Se45,Fe-S-Se,3,Supercon,Fe1Se0.9S0.1,MP-mp-20311,Fe2Se2,Fe-Se,Fe50Se50,P 4/n m m,tetragonal,3.688905,3.688905,5.854194,data/final/MP/cifs/Fe1S0.1Se0.9-MP-mp-20311-synth_doped.cif,data/source/MP/raw/cifs/mp-20311.cif,mp-20311,0.0,,2013-10-20 07:09:24,5.619828229873189,10.17188/1195438,"@misc{osti_1195438,
    author = ""Persson, Kristin"",
    title = ""Materials Data on FeSe (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195438"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668877'}},0.0,3.48880228,520.0,-25.01949237,-6.2548730925,"{'tags': ['Iron selenide - NN AFM', 'Iron selenide - orthorhombic, LT', 'Iron selenide', 'Iron sulfide', 'Iron selenide (1/1) - nonmagnetic', 'Iron selenide - tetragonal', 'Iron selenide - alpha LT', 'Iron selenide - LT', 'High pressure experimental phase', 'Iron selenide - alpha']}",-25.01949237,-6.2548730925,-0.5079131286718743,"['xas', 'elasticity', 'bandstructure']",True,"[196301, 196298, 196299, 196297, 290701, 165958, 185464, 163561, 169257, 163560, 977900, 169311, 169303, 26889, 166440, 162901, 169283, 165957, 169271, 977903, 169259, 977901, 185465, 165959, 169306, 169267, 163557, 169287, 169297, 169289, 163556, 169299, 163562, 166441, 182544, 163559, 169269, 169263, 169265, 169315, 169255, 166439, 169293, 169313, 163555, 169291, 169301, 165960, 169253, 169295, 169970, 163558, 169285, 169261, 169309]",True,2021-05-12 10:56:14.760000,NM,4,55,mp-20311,,FeSe,"{'functional': 'PBE', 'labels': ['Fe_pv', 'Se'], 'pot_type': 'paw'}","{'Fe': 1.0, 'Se': 1.0}",GGA,mp-20311,"['mp-684656', 'mp-20311', 'mp-1063646', 'mp-1063662', 'mp-1063681', 'mp-1063669', 'mp-1063680', 'mp-1063695', 'mp-1063686', 'mp-1063699', 'mp-1063715', 'mp-1063717', 'mp-1063876', 'mp-1063734', 'mp-1063891', 'mp-1063735', 'mp-1063910', 'mp-1063918', 'mp-1063922', 'mp-1063931', 'mp-1063774', 'mp-1063781', 'mp-1064091', 'mp-1064111', 'mp-1063801', 'mp-1064112', 'mp-1064180', 'mp-1064138', 'mp-1064153', 'mp-1065102', 'mp-1065123', 'mp-1065075', 'mp-1065161', 'mp-1065131', 'mp-1065030', 'mp-1065055', 'mp-1065085', 'mp-1065094', 'mp-1440814', 'mp-1668877', 'mp-1799618', 'mp-1593782', 'mp-1592730', 'mp-1065081', 'mp-1065148', 'mp-1063928', 'mp-1063726', 'mp-1063683', 'mp-1063709', 'mp-1063911', 'mp-1063795', 'mp-1065121', 'mp-1063725', 'mp-1064139', 'mp-1064165']",3.455e-05,"{'Fe': 2.0, 'Se': 2.0}",79.66398961559156,[],NM,False,129,0,"[0, 0, 0, 0]",8.673931638803586e-07,3.455e-05,0,6.91e-05,MP,data/source/MP/cleaned/cifs/MP-mp-20311.cif,True,,data/final/MP/graphs/Fe1S0.1Se0.9-MP-mp-20311-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ba2Cu3Er0.5Pr0.5O7,1,0.0,2.0,False,Ba4Cu6Er1Pr1O14,Ba4Cu6Er1Pr1O14,28.6,Cuprate,True,Ba15.385Cu23.077Er3.846Pr3.846O53.84615384615385,Ba-Cu-Er-Pr-O,5,Supercon,Er0.5Pr0.5Ba2Cu3O7,MP-mp-1228227,Ba4Pr1Er1Cu6O14,Ba-Cu-Er-Pr-O,Ba15.385Cu23.077Er3.846Pr3.846O53.84615384615385,P m m m,orthorhombic,3.874962,3.948902,23.915469,data/final/MP/cifs/Ba2Cu3Er0.5Pr0.5O7-MP-mp-1228227.cif,data/source/MP/raw/cifs/mp-1228227.cif,mp-1228227,0.0,,2019-01-13 03:57:53.906000,6.637342019150472,,,,0.0349924649919799,3.12836665,520.0,-157.60416115,-6.061698505769231,{'tags': []},-157.60416115,-6.061698505769231,-2.1665756071153845,[],False,[],True,2021-05-12 11:00:59.151000,NM,26,3,mp-1228227,oxide,Ba4PrEr(Cu3O7)2,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Pr_3', 'Er_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 4.0, 'Pr': 1.0, 'Er': 1.0, 'Cu': 6.0, 'O': 14.0}",GGA,mp-1228227,"['mp-1228227', 'mp-1340453', 'mp-1836278']",0.0001937,"{'Ba': 4.0, 'Pr': 1.0, 'Er': 1.0, 'Cu': 6.0, 'O': 14.0}",365.9508043254744,[],NM,False,47,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.293061190479701e-07,0.0001937,0,0.0001937,MP,data/source/MP/cleaned/cifs/MP-mp-1228227.cif,False,,data/final/MP/graphs/Ba2Cu3Er0.5Pr0.5O7-MP-mp-1228227.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ca1Hg3,1,0.0,2.0,False,Ca2Hg6,Ca2Hg6,1.6,Other,True,Ca25Hg75,Ca-Hg,2,Supercon,Ca1Hg3,MP-mp-863648,Ca2Hg6,Ca-Hg,Ca25Hg75,P 63/m m c,hexagonal,5.210899,6.756760003530719,6.75676017,data/final/MP/cifs/Ca1Hg3-MP-mp-863648.cif,data/source/MP/raw/cifs/mp-863648.cif,mp-863648,0.0,,2014-08-25 10:44:31,10.346441289806643,10.17188/1309853,"@misc{osti_1309853,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CaHg3 (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1309853"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1730926'}},0.0,3.08623759,520.0,-9.01359242,-1.1266990525,{'tags': ['Calcium mercury (1/3)']},-9.01359242,-1.1266990525,-0.39753880875,['bandstructure'],True,[619356],True,2021-05-12 10:59:07.834000,NM,8,8,mp-863648,,CaHg3,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Hg'], 'pot_type': 'paw'}","{'Ca': 1.0, 'Hg': 3.0}",GGA,mp-863648,"['mp-863648', 'mp-1050979', 'mp-1050970', 'mp-1395902', 'mp-1730926', 'mp-1835686', 'mp-1622710', 'mp-1050990']",0.00530885,"{'Ca': 2.0, 'Hg': 6.0}",206.025173093887,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",5.153593534495635e-05,0.00530885,0,0.0106177,MP,data/source/MP/cleaned/cifs/MP-mp-863648.cif,False,,data/final/MP/graphs/Ca1Hg3-MP-mp-863648.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Nd1Pt1Si1,1,0.0,2.0,False,Nd2Pt2Si2,Nd2Pt2Si2,0.0,Other,True,Nd33.333Pt33.333Si33.333,Nd-Pt-Si,3,Supercon,Nd1Pt1Si1,MP-mp-1077762,Nd2Si2Pt2,Nd-Pt-Si,Nd33.333Pt33.333Si33.333,I 41 m d,tetragonal,4.221861998712802,4.221861998712802,7.83807203,data/final/MP/cifs/Nd1Pt1Si1-MP-mp-1077762.cif,data/source/MP/raw/cifs/mp-1077762.cif,mp-1077762,0.0,,2018-04-09 15:23:48,9.445995024738684,,,{'GGA': {'task_id': 'mp-1703016'}},0.0,5.67564874,520.0,-39.29314737,-6.548857895,"{'tags': ['NdPtSi', 'Neodymium platinum silicide (1/1/1)', 'LaPtSi']}",-39.29314737,-6.548857895,-1.1037362483333328,['bandstructure'],True,[645745],True,2021-05-12 10:58:14.654000,NM,6,6,mp-1077762,,NdSiPt,"{'functional': 'PBE', 'labels': ['Nd_3', 'Si', 'Pt'], 'pot_type': 'paw'}","{'Nd': 1.0, 'Si': 1.0, 'Pt': 1.0}",GGA,mp-1077762,"['mp-1077762', 'mp-1262647', 'mp-1416358', 'mp-1703016', 'mp-1789147', 'mp-1594299']",3.85e-06,"{'Nd': 2.0, 'Si': 2.0, 'Pt': 2.0}",129.17668232309572,[],NM,False,109,0,"[0, 0, 0, 0, 0, 0]",5.960828116595239e-08,3.85e-06,0,7.7e-06,MP,data/source/MP/cleaned/cifs/MP-mp-1077762.cif,False,,data/final/MP/graphs/Nd1Pt1Si1-MP-mp-1077762.json,0,True,4mm,0,0,0,0,5,0,0,0,0,1,0,1.0,False
Fe1P1Zr1,1,0.0,4.0,False,Fe4P4Zr4,Fe4P4Zr4,0.0,Ferrite,True,Fe33.333P33.333Zr33.333,Fe-P-Zr,3,Supercon,Zr1Fe1P1,MP-mp-20892,Zr4Fe4P4,Fe-P-Zr,Fe33.333P33.333Zr33.333,P n m a,orthorhombic,3.761831,6.331533,7.088344,data/final/MP/cifs/Fe1P1Zr1-MP-mp-20892.cif,data/source/MP/raw/cifs/mp-20892.cif,mp-20892,0.0,,2014-02-22 14:41:33,7.004553715516284,10.17188/1196087,"@misc{osti_1196087,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrFeP (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196087"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1676774'}},0.0,7.44709673,520.0,-102.35103126,-8.529252605,{'tags': ['Zirconium iron phosphide (1/1/1)']},-102.35103126,-8.529252605,-1.0522487427777776,"['xas', 'elasticity', 'bandstructure']",True,[43204],True,2021-05-12 10:56:14.760000,NM,12,8,mp-20892,,ZrFeP,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Fe_pv', 'P'], 'pot_type': 'paw'}","{'Zr': 1.0, 'Fe': 1.0, 'P': 1.0}",GGA,mp-20892,"['mp-909961', 'mp-925508', 'mp-925933', 'mp-20892', 'mp-1442635', 'mp-1676774', 'mp-1829259', 'mp-1608637']",0.00088605,"{'Zr': 4.0, 'Fe': 4.0, 'P': 4.0}",168.83129109079846,[],NM,False,62,0,"[0.0, 0.0, 0.0, 0.0, -0.0, -0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0]",2.0992554028944244e-05,0.00088605,0,0.0035442,MP,data/source/MP/cleaned/cifs/MP-mp-20892.cif,False,,data/final/MP/graphs/Fe1P1Zr1-MP-mp-20892.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Co0.85Ga0.15Zr2,3,0.1,2.0,False,Co1.7Ga0.3Zr4,Co2Zr4,5.56,Other,True,Co28.333Ga5Zr66.667,Co-Ga-Zr,3,Supercon,Zr2Co0.85Ga0.15,MP-mp-628,Zr4Co2,Co-Zr,Co33.333Zr66.667,I 4/m c m,tetragonal,5.27792884001752,5.27792884,5.277928840000001,data/final/MP/cifs/Co0.85Ga0.15Zr2-MP-mp-628-synth_doped.cif,data/source/MP/raw/cifs/mp-628.cif,mp-628,0.0,,2011-05-13 12:16:44,7.17077101131263,10.17188/1278899,"@misc{osti_1278899,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Zr2Co (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278899"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677545'}},0.0,4.51380976,520.0,-49.95120762,-8.325201269999999,"{'tags': ['Cobalt zirconium (1/2)', 'Zirconium cobalt (2/1)']}",-49.95120762,-8.325201269999999,-0.2572949183333328,"['xas', 'elasticity', 'bandstructure']",True,"[625671, 191386, 625688, 102740, 625665]",True,2021-05-12 10:56:27.046000,NM,6,20,mp-628,,Zr2Co,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Co'], 'pot_type': 'paw'}","{'Zr': 2.0, 'Co': 1.0}",GGA,mp-628,"['mp-928347', 'mp-912327', 'mp-928866', 'mp-628', 'mp-1071352', 'mp-1071381', 'mp-1071431', 'mp-1071762', 'mp-1071803', 'mp-1071859', 'mp-1071883', 'mp-1071742', 'mp-1071925', 'mp-1441633', 'mp-1677545', 'mp-1802810', 'mp-1591799', 'mp-1071792', 'mp-1071416', 'mp-1071915']",0.0001226,"{'Zr': 4.0, 'Co': 2.0}",111.79353060019714,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0]",2.1933290654975308e-06,0.0001226,0,0.0002452,MP,data/source/MP/cleaned/cifs/MP-mp-628.cif,True,,data/final/MP/graphs/Co0.85Ga0.15Zr2-MP-mp-628-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Cu1La1O2.54,3,0.0810572687224669,2.0,False,Cu2La2O5.08,Cu2La2O6,0.0,Cuprate,True,Cu22.026La22.026O55.94713656387665,Cu-La-O,3,Supercon,La1Cu1O2.54,MP-mp-3474,La2Cu2O6,Cu-La-O,Cu20La20O60,R -3 c,trigonal,5.4477705,5.4477705,5.44777013,data/final/MP/cifs/Cu1La1O2.54-MP-mp-3474-synth_doped.cif,data/source/MP/raw/cifs/mp-3474.cif,mp-3474,0.0,,2011-05-14 08:56:28,7.050085630553842,10.17188/1206881,"@misc{osti_1206881,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaCuO3 (SG:167) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1206881"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702794'}},0.0,7.03721726,520.0,-67.87475158,-6.787475158,"{'tags': ['Lanthanum cuprate(III)', 'Lanthanum copper(III) oxide']}",-67.87475158,-6.787475158,-2.4238558,"['xas', 'bandstructure']",True,"[73554, 9428]",True,2021-05-12 10:57:06.958000,NM,10,8,mp-3474,oxide,LaCuO3,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 1.0, 'Cu': 1.0, 'O': 3.0}",GGA,mp-3474,"['mp-922220', 'mp-907610', 'mp-921966', 'mp-3474', 'mp-1414769', 'mp-1702794', 'mp-1804977', 'mp-1591206']",9.3e-06,"{'La': 2.0, 'Cu': 2.0, 'O': 6.0}",117.97912338815296,[],NM,False,167,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.5765501103789136e-07,9.3e-06,0,1.86e-05,MP,data/source/MP/cleaned/cifs/MP-mp-3474.cif,True,,data/final/MP/graphs/Cu1La1O2.54-MP-mp-3474-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ba1Ni2P2,1,0.0,1.0,True,Ba1Ni2P2,Ba1Ni2P2,2.686666667,Ferrite,True,Ba20Ni40P40,Ba-Ni-P,3,Supercon,Ba1Ni2P2,MP-mp-9473,Ba1Ni2P2,Ba-Ni-P,Ba20Ni40P40,I 4/m m m,tetragonal,3.947297997669611,3.947297997669612,6.57328595,data/final/MP/cifs/Ba1Ni2P2-MP-mp-9473.cif,data/source/MP/raw/cifs/mp-9473.cif,mp-9473,0.0,,2011-05-28 05:58:48,5.670682010106403,10.17188/1313267,"@misc{osti_1313267,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba(NiP)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1313267"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703178'}},0.0,6.04045586,520.0,-28.17358026,-5.634716052,{'tags': ['Barium nickel phosphide (1/2/2)']},-28.17358026,-5.634716052,-0.7735462113333341,"['xas', 'elasticity', 'bandstructure']",True,[85408],True,2021-05-12 10:56:35.166000,NM,5,8,mp-9473,,Ba(NiP)2,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ni_pv', 'P'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Ni': 2.0, 'P': 2.0}",GGA,mp-9473,"['mp-924273', 'mp-925037', 'mp-909295', 'mp-9473', 'mp-1429988', 'mp-1703178', 'mp-1797689', 'mp-1595208']",0.0002192,"{'Ba': 1.0, 'Ni': 2.0, 'P': 2.0}",92.72755877443632,[],NM,False,139,0,"[0, 0, 0, 0, 0]",2.363914276371852e-06,0.0002192,0,0.0002192,MP,data/source/MP/cleaned/cifs/MP-mp-9473.cif,False,,data/final/MP/graphs/Ba1Ni2P2-MP-mp-9473.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ag3In1,1,0.0,1.0,True,Ag3In1,Ag3In1,0.0,Other,True,Ag75In25,Ag-In,2,Supercon,Ag3In1,MP-mp-30343,In1Ag3,Ag-In,Ag75In25,P m -3 m,cubic,4.24711,4.24711,4.24711,data/final/MP/cifs/Ag3In1-MP-mp-30343.cif,data/source/MP/raw/cifs/mp-30343.cif,mp-30343,0.0,,2014-02-19 17:29:33,9.50301692337814,10.17188/1204760,"@misc{osti_1204760,
    author = ""Persson, Kristin"",
    title = ""Materials Data on InAg3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1204760"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703883'}},0.0,5.0771726,520.0,-11.38286783,-2.8457169575,{'tags': ['Silver indium (3/1)']},-11.38286783,-2.8457169575,-0.0333790225000001,"['xas', 'elasticity', 'bandstructure']",True,[58283],True,2021-05-12 10:56:18.721000,NM,4,8,mp-30343,,InAg3,"{'functional': 'PBE', 'labels': ['In_d', 'Ag'], 'pot_type': 'paw'}","{'In': 1.0, 'Ag': 3.0}",GGA,mp-30343,"['mp-928641', 'mp-911999', 'mp-928119', 'mp-30343', 'mp-1476153', 'mp-1703883', 'mp-1781863', 'mp-1592671']",0.0001596,"{'In': 1.0, 'Ag': 3.0}",76.60912959013744,[],NM,False,221,0,"[0, 0, 0, 0]",2.08330261489548e-06,0.0001596,0,0.0001596,MP,data/source/MP/cleaned/cifs/MP-mp-30343.cif,False,,data/final/MP/graphs/Ag3In1-MP-mp-30343.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Br0.25C2I1.75Y2,3,0.0833333333333333,1.0,True,Br0.25C2I1.75Y2,C2I2Y2,10.35,Other,True,Br4.167C33.333I29.167Y33.333,Br-C-I-Y,4,Supercon,Y2I1.75Br0.25C2,MP-mp-23062,Y2C2I2,C-I-Y,C33.333I33.333Y33.333,C 1 2/m 1,monoclinic,3.914206004628932,4.15558825,10.78092902,data/final/MP/cifs/Br0.25C2I1.75Y2-MP-mp-23062-synth_doped.cif,data/source/MP/raw/cifs/mp-23062.cif,mp-23062,0.0,,2014-02-21 06:41:11,4.900237993988967,10.17188/1199207,"@misc{osti_1199207,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YCI (SG:12) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199207"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698423'}},0.0,4.3403649,520.0,-39.59005325,-6.5983422083333325,"{'tags': ['Yttrium iodide carbide (2/2/2)', 'Yttrium carbide iodide (2/2/2)', 'High pressure experimental phase']}",-39.59005325,-6.5983422083333325,-0.9855873988888888,"['xas', 'elasticity', 'bandstructure']",True,"[400298, 153860, 153861, 153862]",True,2021-05-12 10:56:16.728000,NM,6,8,mp-23062,,YCI,"{'functional': 'PBE', 'labels': ['Y_sv', 'C', 'I'], 'pot_type': 'paw'}","{'Y': 1.0, 'C': 1.0, 'I': 1.0}",GGA,mp-23062,"['mp-918746', 'mp-919706', 'mp-905745', 'mp-23062', 'mp-1435572', 'mp-1698423', 'mp-1781217', 'mp-1592690']",0.0001098,"{'Y': 2.0, 'C': 2.0, 'I': 2.0}",154.40299200435598,[],NM,False,12,0,"[0, 0, 0, 0, 0, 0]",1.4222522319632556e-06,0.0001098,0,0.0002196,MP,data/source/MP/cleaned/cifs/MP-mp-23062.cif,True,,data/final/MP/graphs/Br0.25C2I1.75Y2-MP-mp-23062-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
Cu4Te3,3,0.1428571428571428,0.5,False,Cu2Te1.5,Cu2Te2,0.0,Other,True,Cu57.143Te42.857,Cu-Te,2,Supercon,Cu4Te3,MP-mp-20826,Cu2Te2,Cu-Te,Cu50Te50,P m m n,orthorhombic,3.195561,4.040864,7.128868,data/final/MP/cifs/Cu4Te3-MP-mp-20826-synth_doped.cif,data/source/MP/raw/cifs/mp-20826.cif,mp-20826,0.0,,2014-02-21 08:23:56,6.896081538150364,10.17188/1196028,"@misc{osti_1196028,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CuTe (SG:59) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196028"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687864'}},0.0,6.02620216,520.0,-14.74894129,-3.6872353225,"{'tags': ['Vulcanite', 'Copper telluride']}",-14.74894129,-3.6872353225,-0.2769815224999998,"['xas', 'elasticity', 'bandstructure']",True,"[44993, 43273, 42591, 93966, 660104]",True,2021-05-12 10:56:14.760000,NM,4,12,mp-20826,,CuTe,"{'functional': 'PBE', 'labels': ['Cu_pv', 'Te'], 'pot_type': 'paw'}","{'Cu': 1.0, 'Te': 1.0}",GGA,mp-20826,"['mp-988114', 'mp-987817', 'mp-20826', 'mp-1066020', 'mp-1065991', 'mp-1066113', 'mp-1439215', 'mp-1687864', 'mp-1797532', 'mp-988722', 'mp-1587594', 'mp-1066056']",7.25e-06,"{'Cu': 2.0, 'Te': 2.0}",92.0538420749174,[],NM,False,59,0,"[0, 0, 0, 0]",1.5751651069815506e-07,7.25e-06,0,1.45e-05,MP,data/source/MP/cleaned/cifs/MP-mp-20826.cif,True,,data/final/MP/graphs/Cu4Te3-MP-mp-20826-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Co1Si1,1,0.0,4.0,False,Co4Si4,Co4Si4,0.0,Other,True,Co50Si50,Co-Si,2,Supercon,Co1Si1,MP-mp-7577,Co4Si4,Co-Si,Co50Si50,P 21 3,cubic,4.433198,4.433198,4.433198,data/final/MP/cifs/Co1Si1-MP-mp-7577.cif,data/source/MP/raw/cifs/mp-7577.cif,mp-7577,0.0,,2011-05-28 05:43:03,6.633920594525826,10.17188/1290870,"@misc{osti_1290870,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CoSi (SG:198) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1290870"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702127'}},0.0,9.64796906,520.0,-55.0616888,-6.8827111,"{'tags': ['Cobalt silicide (1/1)', 'Cobalt silicide(-II) - epsilon *']}",-55.0616888,-6.8827111,-0.5803951925000002,"['bandstructure', 'elasticity']",True,"[260982, 16839, 625027, 625029, 189221, 625024]",True,2021-05-12 10:56:29.056000,NM,8,11,mp-7577,,CoSi,"{'functional': 'PBE', 'labels': ['Co', 'Si'], 'pot_type': 'paw'}","{'Co': 1.0, 'Si': 1.0}",GGA,mp-7577,"['mp-924632', 'mp-7577', 'mp-909476', 'mp-1080601', 'mp-1125008', 'mp-1138232', 'mp-1438650', 'mp-1702127', 'mp-1801308', 'mp-925189', 'mp-1588076']",0.001624175,"{'Co': 4.0, 'Si': 4.0}",87.12672424284776,[],NM,False,198,0,"[0, 0, 0, 0, 0, 0, 0, 0]",7.456609962623856e-05,0.001624175,0,0.0064967,MP,data/source/MP/cleaned/cifs/MP-mp-7577.cif,False,,data/final/MP/graphs/Co1Si1-MP-mp-7577.json,0,True,23,1,0,0,0,0,0,0,1,0,0,0,1.0,False
B2Mg0.95Zr0.05,2,0.0333333333333333,1.0,True,B2Mg0.95Zr0.05,B2Mg1,37.7,Other,True,B66.667Mg31.667Zr1.667,B-Mg-Zr,3,Supercon,Mg0.95Zr0.05B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B2Mg0.95Zr0.05-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B2Mg0.95Zr0.05-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ag0.9S0.2Se1.8Sn1.1,3,0.15,1.0,True,Ag0.9S0.2Se1.8Sn1.1,Ag1Se2Sn1,6.79,Other,True,Ag22.5S5Se45Sn27.5,Ag-S-Se-Sn,4,Supercon,Ag0.9Sn1.1Se1.8S0.2,MP-mp-1229011,Ag1Sn1Se2,Ag-Se-Sn,Ag25Se50Sn25,R -3 m,trigonal,4.0598026973764,4.0598026973764,7.0325229,data/final/MP/cifs/Ag0.9S0.2Se1.8Sn1.1-MP-mp-1229011-synth_doped.cif,data/source/MP/raw/cifs/mp-1229011.cif,mp-1229011,0.0,,2019-01-13 04:39:21.201000,6.746249424080593,,,{'GGA': {'task_id': 'mp-1766738'}},0.0,4.6965768,520.0,-14.98910359,-3.7472758975,{'tags': []},-14.98910359,-3.7472758975,-0.5247881940885413,['bandstructure'],True,[],True,2021-05-12 10:58:49.477000,NM,4,5,mp-1229011,,AgSnSe2,"{'functional': 'PBE', 'labels': ['Ag', 'Sn_d', 'Se'], 'pot_type': 'paw'}","{'Ag': 1.0, 'Sn': 1.0, 'Se': 2.0}",GGA,mp-1229011,"['mp-1229011', 'mp-1422543', 'mp-1766738', 'mp-1796245', 'mp-1612963']",0.0080447,"{'Ag': 1.0, 'Sn': 1.0, 'Se': 2.0}",94.64136915222257,[],NM,False,166,0,"[0, 0, 0, 0]",8.50019401881305e-05,0.0080447,0,0.0080447,MP,data/source/MP/cleaned/cifs/MP-mp-1229011.cif,True,,data/final/MP/graphs/Ag0.9S0.2Se1.8Sn1.1-MP-mp-1229011-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
C1Ti0.8W0.2,1,0.0,5.0,False,C5Ti4W1,C5Ti4W1,0.0,Other,True,C50Ti40W10,C-Ti-W,3,Supercon,C1Ti0.8W0.2,MP-mp-1217128,Ti4W1C5,C-Ti-W,C50Ti40W10,R -3 m,trigonal,3.0662162763993632,3.0662162763993632,12.70632795,data/final/MP/cifs/C1Ti0.8W0.2-MP-mp-1217128.cif,data/source/MP/raw/cifs/mp-1217128.cif,mp-1217128,0.0,,2019-01-12 18:31:03.205000,7.056662243826723,,,{'GGA': {'task_id': 'mp-1750902'}},0.018644720000001,7.98682196,520.0,-97.21286611,-9.721286611,{'tags': []},-97.21286611,-9.721286611,-0.6538868073333333,[],False,[],True,2021-05-12 11:00:40.103000,NM,10,4,mp-1217128,,Ti4WC5,"{'functional': 'PBE', 'labels': ['Ti_pv', 'W_pv', 'C'], 'pot_type': 'paw'}","{'Ti': 4.0, 'W': 1.0, 'C': 5.0}",GGA,mp-1217128,"['mp-1217128', 'mp-1443418', 'mp-1750902', 'mp-1798223']",0.0030314,"{'Ti': 4.0, 'W': 1.0, 'C': 5.0}",102.44712781542157,[],NM,False,166,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.9589897390404707e-05,0.0030314,0,0.0030314,MP,data/source/MP/cleaned/cifs/MP-mp-1217128.cif,False,,data/final/MP/graphs/C1Ti0.8W0.2-MP-mp-1217128.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ba2Cu4Eu0.3Pr0.7O8,3,0.04,1.0,True,Ba2Cu4Eu0.3Pr0.7O8,Ba2Cu4Pr1O8,0.0,Cuprate,True,Ba13.333Cu26.667Eu2Pr4.667O53.333333333333336,Ba-Cu-Eu-Pr-O,5,Supercon,Eu0.3Pr0.7Ba2Cu4O8,MP-mp-6779,Ba2Pr1Cu4O8,Ba-Cu-Pr-O,Ba13.333Cu26.667Pr6.667O53.333333333333336,C m m m,orthorhombic,3.929110001624248,3.949708,13.95458511,data/final/MP/cifs/Ba2Cu4Eu0.3Pr0.7O8-MP-mp-6779-synth_doped.cif,data/source/MP/raw/cifs/mp-6779.cif,mp-6779,0.0,,2011-05-16 04:48:00,6.178482380811956,10.17188/1283406,"@misc{osti_1283406,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Pr(CuO2)4 (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1283406"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1676400'}},0.0,3.2175718,520.0,-89.48122933,-5.965415288666667,"{'tags': ['Praseodymium barium copper oxide (1/2/4/8)', 'Praseodymium dibarium tricopper copper(III) oxide', 'Praseodymium dibarium tetracopper octaoxide']}",-89.48122933,-5.965415288666667,-2.025191587000001,"['xas', 'bandstructure']",True,"[75850, 75815, 90748, 87940, 90757]",True,2021-05-12 10:57:34.594000,NM,15,8,mp-6779,oxide,Ba2Pr(CuO2)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Pr_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Pr': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-6779,"['mp-1000699', 'mp-6779', 'mp-1007159', 'mp-1381422', 'mp-1676400', 'mp-1835392', 'mp-1011903', 'mp-1598918']",0.0021731,"{'Ba': 2.0, 'Pr': 1.0, 'Cu': 4.0, 'O': 8.0}",214.40214033168536,[],NM,False,65,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",1.0135626429093296e-05,0.0021731,0,0.0021731,MP,data/source/MP/cleaned/cifs/MP-mp-6779.cif,True,,data/final/MP/graphs/Ba2Cu4Eu0.3Pr0.7O8-MP-mp-6779-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ga1.1Si0.9Sr1,3,0.0666666666666667,1.0,True,Ga1.1Si0.9Sr1,Ga1Si1Sr1,5.04,Other,True,Ga36.667Si30Sr33.333,Ga-Si-Sr,3,Supercon,Sr1Ga1.1Si0.9,MP-mp-1218262,Sr1Ga1Si1,Ga-Si-Sr,Ga33.333Si33.333Sr33.333,P -6 m 2,hexagonal,4.2209479997069455,4.220947830000001,4.723355,data/final/MP/cifs/Ga1.1Si0.9Sr1-MP-mp-1218262-synth_doped.cif,data/source/MP/raw/cifs/mp-1218262.cif,mp-1218262,0.0,,2019-01-12 19:27:35.341000,4.224977327446255,,,{'GGA': {'task_id': 'mp-1767455'}},0.0,4.14906217,520.0,-11.52735393,-3.84245131,{'tags': []},-11.52735393,-3.84245131,-0.4378168113888889,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,3,5,mp-1218262,,SrGaSi,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ga_d', 'Si'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Ga': 1.0, 'Si': 1.0}",GGA,mp-1218262,"['mp-1218262', 'mp-1432931', 'mp-1767455', 'mp-1801429', 'mp-1611910']",0.0052074,"{'Sr': 1.0, 'Ga': 1.0, 'Si': 1.0}",72.87879778923026,[],NM,False,187,0,"[0, 0, 0]",7.14528800963499e-05,0.0052074,0,0.0052074,MP,data/source/MP/cleaned/cifs/MP-mp-1218262.cif,True,,data/final/MP/graphs/Ga1.1Si0.9Sr1-MP-mp-1218262-synth_doped.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Rh0.8Ru0.2Se2,3,0.1333333333333333,4.0,False,Rh3.2Ru0.8Se8,Rh4Se8,1.33,Other,True,Rh26.667Ru6.667Se66.667,Rh-Ru-Se,3,Supercon,Rh0.8Ru0.2Se2,MP-mp-983,Rh4Se8,Rh-Se,Rh33.333Se66.667,P a -3,cubic,6.099805,6.099805,6.099805,data/final/MP/cifs/Rh0.8Ru0.2Se2-MP-mp-983-synth_doped.cif,data/source/MP/raw/cifs/mp-983.cif,mp-983,0.0,,2011-05-14 19:13:30,7.6332815701689585,10.17188/1316470,"@misc{osti_1316470,
    author = ""Persson, Kristin"",
    title = ""Materials Data on RhSe2 (SG:205) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1316470"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700335'}},0.033700524583339,6.11932593,520.0,-62.153365,-5.179447083333334,"{'tags': ['Rhenium selenide (1/2)', 'Rhodium selenide (1/2)', 'Rhodium perselenide (1/1)']}",-62.153365,-5.179447083333334,-0.7087368082291666,['bandstructure'],True,"[650276, 44868, 650283]",True,2021-05-12 10:59:09.988000,NM,12,8,mp-983,,RhSe2,"{'functional': 'PBE', 'labels': ['Rh_pv', 'Se'], 'pot_type': 'paw'}","{'Rh': 1.0, 'Se': 2.0}",GGA,mp-983,"['mp-942577', 'mp-921168', 'mp-983', 'mp-942969', 'mp-1417796', 'mp-1700335', 'mp-1871355', 'mp-1600224']",8.3475e-05,"{'Rh': 4.0, 'Se': 8.0}",226.95923284585007,[],NM,False,205,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.4711893224752998e-06,8.3475e-05,0,0.0003339,MP,data/source/MP/cleaned/cifs/MP-mp-983.cif,True,,data/final/MP/graphs/Rh0.8Ru0.2Se2-MP-mp-983-synth_doped.json,0,True,m-3,2,0,0,0,0,0,0,1,0,0,0,1.0,False
Lu0.275Rh0.725,2,0.05,4.0,False,Lu1.1Rh2.9,Lu1Rh3,1.27,Other,True,Lu27.5Rh72.5,Lu-Rh,2,Supercon,Lu0.275Rh0.725,MP-mp-865802,Lu1Rh3,Lu-Rh,Lu25Rh75,P m -3 m,cubic,4.011469,4.011469,4.011469,data/final/MP/cifs/Lu0.275Rh0.725-MP-mp-865802-synth_doped.cif,data/source/MP/raw/cifs/mp-865802.cif,mp-865802,0.0,,2014-09-01 02:36:10,12.442282243401042,10.17188/1311002,"@misc{osti_1311002,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LuRh3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1311002"",
    place = ""United States"",
    year = ""2016"",
    month = ""8"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1764486'}},0.0,5.33667658,520.0,-28.96576272,-7.24144068,{'tags': []},-28.96576272,-7.24144068,-0.5879721475000004,['bandstructure'],True,[],True,2021-05-12 10:59:07.834000,NM,4,11,mp-865802,,LuRh3,"{'functional': 'PBE', 'labels': ['Lu_3', 'Rh_pv'], 'pot_type': 'paw'}","{'Lu': 1.0, 'Rh': 3.0}",GGA,mp-865802,"['mp-1004969', 'mp-865802', 'mp-1003460', 'mp-1053519', 'mp-1053509', 'mp-1424241', 'mp-1764486', 'mp-1791729', 'mp-1010610', 'mp-1615510', 'mp-1053520']",0.0088978,"{'Lu': 1.0, 'Rh': 3.0}",64.55209196414087,[],NM,False,221,0,"[0, 0, 0, 0]",0.0001378390649979,0.0088978,0,0.0088978,MP,data/source/MP/cleaned/cifs/MP-mp-865802.cif,True,,data/final/MP/graphs/Lu0.275Rh0.725-MP-mp-865802-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Al2Mg3,2,0.0275862068965516,5.6665833333333335,False,Al11.333Mg17,Al12Mg17,0.0,Other,True,Al40Mg60,Al-Mg,2,Supercon,Al2Mg3,MP-mp-2151,Mg17Al12,Al-Mg,Al41.379Mg58.621,I -4 3 m,cubic,9.121485312022092,9.12148531,9.121485310000002,data/final/MP/cifs/Al2Mg3-MP-mp-2151-synth_doped.cif,data/source/MP/raw/cifs/mp-2151.cif,mp-2151,0.0,,2011-05-17 07:31:32,2.094692395338542,10.17188/1196962,"@misc{osti_1196962,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Mg17Al12 (SG:217) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196962"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-929205'}},0.0,5.02840363,520.0,-72.9355201,-2.515017934482759,"{'tags': ['Magnesium aluminium (17/12) - gamma', 'Magnesium aluminium (17/12)', 'Magnesium aluminide (0.59/0.41)', 'Aluminium magnesium (12/17)']}",-72.9355201,-2.515017934482759,-0.0270292858620691,"['xas', 'elasticity', 'bandstructure']",True,"[163478, 191276, 608398, 23607, 158247]",True,2021-05-12 10:56:16.728000,NM,29,8,mp-2151,,Mg17Al12,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Al'], 'pot_type': 'paw'}","{'Mg': 17.0, 'Al': 12.0}",GGA,mp-2151,"['mp-929581', 'mp-929205', 'mp-912924', 'mp-2151', 'mp-1192420', 'mp-1116058', 'mp-1408918', 'mp-1886800']",0.0006166,"{'Mg': 17.0, 'Al': 12.0}",584.2178183411263,[],NM,False,217,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.0554282677492142e-06,0.0006166,0,0.0006166,MP,data/source/MP/cleaned/cifs/MP-mp-2151.cif,True,,data/final/MP/graphs/Al2Mg3-MP-mp-2151-synth_doped.json,0,True,-43m,5,0,0,0,0,0,0,0,0,1,0,1.0,False
Ga0.75Si0.25V3,3,0.125,2.0,False,Ga1.5Si0.5V6,Ga2V6,8.1,Other,True,Ga18.75Si6.25V75,Ga-Si-V,3,Supercon,V3Si0.25Ga0.75,MP-mp-22568,V6Ga2,Ga-V,Ga25V75,P m -3 n,cubic,4.789645,4.789645,4.789645,data/final/MP/cifs/Ga0.75Si0.25V3-MP-mp-22568-synth_doped.cif,data/source/MP/raw/cifs/mp-22568.cif,mp-22568,0.0,,2014-02-22 11:36:40,6.726541666276222,10.17188/1198793,"@misc{osti_1198793,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Ga (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198793"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686867'}},0.0,5.67452231,520.0,-61.95244347,-7.74405543375,{'tags': ['Gallium vanadium (1/3)']},-61.95244347,-7.74405543375,-0.1741018756249994,"['xas', 'elasticity', 'bandstructure']",True,"[635643, 635628, 635619, 635634, 104021, 635646, 635604, 635610, 635617, 635624, 635626, 635605, 635631, 635625, 635636, 635603, 104020, 635616, 635607]",True,2021-05-12 10:56:16.728000,FM,8,9,mp-22568,,V3Ga,"{'functional': 'PBE', 'labels': ['V_pv', 'Ga_d'], 'pot_type': 'paw'}","{'V': 3.0, 'Ga': 1.0}",GGA,mp-22568,"['mp-941343', 'mp-941663', 'mp-934924', 'mp-22568', 'mp-1440749', 'mp-1686867', 'mp-1804076', 'mp-1593784', 'mp-1595713']",0.09063635,"{'V': 6.0, 'Ga': 2.0}",109.87780534443452,[],FM,True,131,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.0, -0.0, -0.0]",0.0016497662965852,0.09063635,2,0.1812727,MP,data/source/MP/cleaned/cifs/MP-mp-22568.cif,True,,data/final/MP/graphs/Ga0.75Si0.25V3-MP-mp-22568-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Hg3Pt1,3,0.1,1.0,True,Hg3Pt1,Hg4Pt1,0.0,Other,True,Hg75Pt25,Hg-Pt,2,Supercon,Hg3Pt1,MP-mp-936,Hg4Pt1,Hg-Pt,Hg80Pt20,I m -3 m,cubic,5.530796761226092,5.53079676,5.53079676,data/final/MP/cifs/Hg3Pt1-MP-mp-936-synth_doped.cif,data/source/MP/raw/cifs/mp-936.cif,mp-936,0.0,,2011-05-13 07:18:03,12.717343750372809,,,{'GGA': {'task_id': 'mp-1687409'}},0.0,2.38621962,520.0,-7.7566809,-1.55133618,"{'tags': ['Mercury platinum (4/1) - beta', 'Mercury platinum (4/1)', 'Platinum mercury (1/4)']}",-7.7566809,-1.55133618,-0.094210346,"['xas', 'elasticity', 'bandstructure']",True,"[639148, 108762, 659824, 655081, 639150, 150772]",True,2021-05-12 10:56:35.166000,NM,5,17,mp-936,,Hg4Pt,"{'functional': 'PBE', 'labels': ['Hg', 'Pt'], 'pot_type': 'paw'}","{'Hg': 4.0, 'Pt': 1.0}",GGA,mp-936,"['mp-905399', 'mp-919589', 'mp-918590', 'mp-936', 'mp-2312', 'mp-1070373', 'mp-1070439', 'mp-1070404', 'mp-1070645', 'mp-1070688', 'mp-1070664', 'mp-1437641', 'mp-1687409', 'mp-1780994', 'mp-1588391', 'mp-1070703', 'mp-1070450']",0.0002601,"{'Hg': 4.0, 'Pt': 1.0}",130.23904686835377,[],NM,False,229,0,"[0, 0, 0, 0, 0]",1.997096924879297e-06,0.0002601,0,0.0002601,MP,data/source/MP/cleaned/cifs/MP-mp-936.cif,True,,data/final/MP/graphs/Hg3Pt1-MP-mp-936-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,1,0,1.0,False
B2C1Ce1Pd2,1,0.0,1.0,True,B2C1Ce1Pd2,B2C1Ce1Pd2,0.0,Heavy_fermion,True,B33.333C16.667Ce16.667Pd33.333,B-C-Ce-Pd,4,Supercon,Ce1Pd2B2C1,MP-mp-1206294,Ce1B2Pd2C1,B-C-Ce-Pd,B33.333C16.667Ce16.667Pd33.333,I 4/m m m,tetragonal,3.839158000879665,3.8391580008796646,5.98893521,data/final/MP/cifs/B2C1Ce1Pd2-MP-mp-1206294.cif,data/source/MP/raw/cifs/mp-1206294.cif,mp-1206294,0.0,,2019-01-12 09:38:04.124000,8.158696593173493,,,{'GGA': {'task_id': 'mp-1760170'}},0.0771931527777809,7.18754573,520.0,-41.83721374,-6.972868956666667,"{'tags': ['LuNi2B2C', 'CePd2B2C']}",-41.83721374,-6.972868956666667,-0.4931327872222226,['bandstructure'],True,[],True,2021-05-12 10:58:37.524000,FM,6,5,mp-1206294,,CeB2Pd2C,"{'functional': 'PBE', 'labels': ['Ce', 'B', 'Pd', 'C'], 'pot_type': 'paw'}","{'Ce': 1.0, 'B': 2.0, 'Pd': 2.0, 'C': 1.0}",GGA,mp-1206294,"['mp-1206294', 'mp-1394268', 'mp-1760170', 'mp-1801489', 'mp-1624112']",0.8095618,"{'Ce': 1.0, 'B': 2.0, 'Pd': 2.0, 'C': 1.0}",78.68237674057313,[],FM,True,139,1,"[0.6, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0102889850756445,0.8095618,1,0.8095618,MP,data/source/MP/cleaned/cifs/MP-mp-1206294.cif,False,,data/final/MP/graphs/B2C1Ce1Pd2-MP-mp-1206294.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ca1Si3,1,0.0,4.0,False,Ca4Si12,Ca4Si12,4.25,Other,True,Ca25Si75,Ca-Si,2,Supercon,Ca1Si3,MP-mp-1205346,Ca4Si12,Ca-Si,Ca25Si75,I 4/m m m,tetragonal,7.259770000361542,7.64928384,7.259770000361542,data/final/MP/cifs/Ca1Si3-MP-mp-1205346.cif,data/source/MP/raw/cifs/mp-1205346.cif,mp-1205346,0.0,,2019-01-12 08:52:16.966000,2.763127724915327,,,{'GGA': {'task_id': 'mp-1670689'}},0.1254007474999996,6.75091686,520.0,-75.99549666,-4.74971854125,{'tags': ['Calcium trisilicide']},-75.99549666,-4.74971854125,-0.1260830562500006,['bandstructure'],True,[263004],True,2021-05-12 10:58:37.524000,NM,16,5,mp-1205346,,CaSi3,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Si'], 'pot_type': 'paw'}","{'Ca': 1.0, 'Si': 3.0}",GGA,mp-1205346,"['mp-1205346', 'mp-1434340', 'mp-1670689', 'mp-1808482', 'mp-1597995']",0.00085675,"{'Ca': 4.0, 'Si': 12.0}",298.8820136173828,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.1466063007682735e-05,0.00085675,0,0.003427,MP,data/source/MP/cleaned/cifs/MP-mp-1205346.cif,False,,data/final/MP/graphs/Ca1Si3-MP-mp-1205346.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Gd0.02In1La2.98,2,0.01,1.0,True,Gd0.02In1La2.98,In1La3,7.9,Other,True,Gd0.5In25La74.5,Gd-In-La,3,Supercon,Gd0.02In1La2.98,MP-mp-20909,La3In1,In-La,In25La75,P m -3 m,cubic,5.076766,5.076766,5.076766,data/final/MP/cifs/Gd0.02In1La2.98-MP-mp-20909-synth_doped.cif,data/source/MP/raw/cifs/mp-20909.cif,mp-20909,0.0,,2014-02-21 06:52:52,6.7455760598452565,10.17188/1196104,"@misc{osti_1196104,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La3In (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196104"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671685'}},0.0,8.16935076,520.0,-18.73796121,-4.6844903025,"{'tags': ['Indium lanthanum (1/3)', 'Lanthanum indium (3/1)']}",-18.73796121,-4.6844903025,-0.2945640412500001,"['xas', 'bandstructure']",True,"[639844, 51950, 639851, 639840, 603208, 107019]",True,2021-05-12 10:56:57.051000,NM,4,8,mp-20909,,La3In,"{'functional': 'PBE', 'labels': ['La', 'In_d'], 'pot_type': 'paw'}","{'La': 3.0, 'In': 1.0}",GGA,mp-20909,"['mp-906743', 'mp-921394', 'mp-920373', 'mp-20909', 'mp-1476042', 'mp-1671685', 'mp-1778647', 'mp-1590323']",0.0489742,"{'La': 3.0, 'In': 1.0}",130.84629766481785,[],NM,False,221,0,"[0, 0, 0, 0]",0.0003742880071811,0.0489742,0,0.0489742,MP,data/source/MP/cleaned/cifs/MP-mp-20909.cif,True,,data/final/MP/graphs/Gd0.02In1La2.98-MP-mp-20909-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Pb3Th1,1,0.0,1.0,True,Pb3Th1,Pb3Th1,5.55,Other,True,Pb75Th25,Pb-Th,2,Supercon,Pb3Th1,MP-mp-21381,Th1Pb3,Pb-Th,Pb75Th25,P m -3 m,cubic,4.925651,4.925651,4.925651,data/final/MP/cifs/Pb3Th1-MP-mp-21381.cif,data/source/MP/raw/cifs/mp-21381.cif,mp-21381,0.0,,2014-02-21 11:06:56,11.861290862017611,10.17188/1196831,"@misc{osti_1196831,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ThPb3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196831"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1674288'}},0.0,7.93715681,520.0,-19.49913875,-4.8747846875,{'tags': ['Lead thorium (3/1)']},-19.49913875,-4.8747846875,-0.2368348224999996,"['xas', 'elasticity', 'bandstructure']",True,"[648629, 105632, 648626, 105633]",True,2021-05-12 10:56:16.728000,NM,4,8,mp-21381,,ThPb3,"{'functional': 'PBE', 'labels': ['Th', 'Pb_d'], 'pot_type': 'paw'}","{'Th': 1.0, 'Pb': 3.0}",GGA,mp-21381,"['mp-913782', 'mp-930593', 'mp-930049', 'mp-21381', 'mp-1438972', 'mp-1674288', 'mp-1804936', 'mp-1591065']",0.0054905,"{'Th': 1.0, 'Pb': 3.0}",119.50633062256068,[],NM,False,221,0,"[0, 0, 0, 0]",4.59431728126668e-05,0.0054905,0,0.0054905,MP,data/source/MP/cleaned/cifs/MP-mp-21381.cif,False,,data/final/MP/graphs/Pb3Th1-MP-mp-21381.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Mo0.81Pt0.19,3,0.12,8.0,False,Mo6.48Pt1.52,Mo6Pt2,4.53,Other,True,Mo81Pt19,Mo-Pt,2,Supercon,Mo0.81Pt0.19,MP-mp-1232,Mo6Pt2,Mo-Pt,Mo75Pt25,P m -3 n,cubic,5.021457,5.021457,5.021457,data/final/MP/cifs/Mo0.81Pt0.19-MP-mp-1232-synth_doped.cif,data/source/MP/raw/cifs/mp-1232.cif,mp-1232,0.0,,2011-05-14 07:33:46,12.666325713651156,10.17188/1188699,"@misc{osti_1188699,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Mo3Pt (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188699"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703333'}},0.0468418224999993,8.12451675,520.0,-78.11615432,-9.76451929,{'tags': ['Molybdenum platinum (3/1)']},-78.11615432,-9.76451929,-0.1125600900000005,"['xas', 'elasticity', 'bandstructure']",True,"[105071, 161106]",True,2021-05-12 10:56:12.755000,NM,8,8,mp-1232,,Mo3Pt,"{'functional': 'PBE', 'labels': ['Mo_pv', 'Pt'], 'pot_type': 'paw'}","{'Mo': 3.0, 'Pt': 1.0}",GGA,mp-1232,"['mp-906180', 'mp-919006', 'mp-920031', 'mp-1232', 'mp-1435577', 'mp-1703333', 'mp-1787044', 'mp-1597150']",0.00115405,"{'Mo': 6.0, 'Pt': 2.0}",126.61619092159891,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.822910627148136e-05,0.00115405,0,0.0023081,MP,data/source/MP/cleaned/cifs/MP-mp-1232.cif,True,,data/final/MP/graphs/Mo0.81Pt0.19-MP-mp-1232-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Pd2Sn1Yb1,1,0.0,1.0,True,Pd2Sn1Yb1,Pd2Sn1Yb1,2.225,Heavy_fermion,True,Pd50Sn25Yb25,Pd-Sn-Yb,3,Supercon,Yb1Pd2Sn1,MP-mp-4053,Yb1Sn1Pd2,Pd-Sn-Yb,Pd50Sn25Yb25,F m -3 m,cubic,4.759941620000001,4.75994162,4.75994162,data/final/MP/cifs/Pd2Sn1Yb1-MP-mp-4053.cif,data/source/MP/raw/cifs/mp-4053.cif,mp-4053,0.0,,2011-05-12 23:41:25,10.98747386739332,10.17188/1207803,"@misc{osti_1207803,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YbSnPd2 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207803"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687829'}},0.0,6.01177944,520.0,-19.18646952,-4.79661738,{'tags': ['Palladium tin ytterbium (2/1/1)']},-19.18646952,-4.79661738,-0.8193814412499996,"['xas', 'bandstructure']",True,"[648956, 105703, 105704]",True,2021-05-12 10:57:08.928000,NM,4,8,mp-4053,,YbSnPd2,"{'functional': 'PBE', 'labels': ['Yb_2', 'Sn_d', 'Pd'], 'pot_type': 'paw'}","{'Yb': 1.0, 'Sn': 1.0, 'Pd': 2.0}",GGA,mp-4053,"['mp-929472', 'mp-912755', 'mp-929106', 'mp-4053', 'mp-1437932', 'mp-1687829', 'mp-1800428', 'mp-1591839']",0.0010356,"{'Yb': 1.0, 'Sn': 1.0, 'Pd': 2.0}",76.25878502448501,[],NM,False,225,0,"[0, 0, 0, 0]",1.3580074737192469e-05,0.0010356,0,0.0010356,MP,data/source/MP/cleaned/cifs/MP-mp-4053.cif,False,,data/final/MP/graphs/Pd2Sn1Yb1-MP-mp-4053.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Fe1.66K0.86Se2,3,0.0849557522123894,1.0,True,Fe1.66K0.86Se2,Fe2K1Se2,32.0,Ferrite,True,Fe36.726K19.027Se44.248,Fe-K-Se,3,Supercon,K0.86Fe1.66Se2,MP-mp-1070735,K1Fe2Se2,Fe-K-Se,Fe40K20Se40,I 4/m m m,tetragonal,3.783558000712664,3.783558000712664,7.91886339,data/final/MP/cifs/Fe1.66K0.86Se2-MP-mp-1070735-synth_doped.cif,data/source/MP/raw/cifs/mp-1070735.cif,mp-1070735,0.0,,2018-03-22 03:52:22,4.804538531009527,,,{'GGA': {'task_id': 'mp-1761650'}},0.0327827750000011,3.42423866,520.0,-27.50456218,-5.500912436,{'tags': ['Potassium iron selenide (1/2/2)']},-27.50456218,-5.500912436,-0.6812646755374999,['bandstructure'],True,[186573],True,2021-05-12 10:58:14.654000,FM,5,8,mp-1070735,,K(FeSe)2,"{'functional': 'PBE', 'labels': ['K_sv', 'Fe_pv', 'Se'], 'pot_type': 'paw'}","{'K': 1.0, 'Fe': 2.0, 'Se': 2.0}",GGA,mp-1070735,"['mp-1070735', 'mp-1070765', 'mp-1070841', 'mp-1416829', 'mp-1761650', 'mp-1797161', 'mp-1585994', 'mp-1070830']",6.0503851,"{'K': 1.0, 'Fe': 2.0, 'Se': 2.0}",106.69540665041993,[],FM,True,139,1,"[0.0, 2.8, 2.8, 0.0, 0.0]",0.0567070813069176,6.0503851,2,6.0503851,MP,data/source/MP/cleaned/cifs/MP-mp-1070735.cif,True,,data/final/MP/graphs/Fe1.66K0.86Se2-MP-mp-1070735-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ge2Lu1,1,0.0,2.0,False,Ge4Lu2,Ge4Lu2,2.6,Other,True,Ge66.667Lu33.333,Ge-Lu,2,Supercon,Ge2Lu1,MP-mp-973906,Lu2Ge4,Ge-Lu,Ge66.667Lu33.333,C m c m,orthorhombic,3.885367,4.042952000740487,8.01138973,data/final/MP/cifs/Ge2Lu1-MP-mp-973906.cif,data/source/MP/raw/cifs/mp-973906.cif,mp-973906,0.0,,2015-09-16 11:18:52,8.733950918906396,10.17188/1314315,"@misc{osti_1314315,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LuGe2 (SG:63) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1314315"",
    place = ""United States"",
    year = ""2016"",
    month = ""8"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697662'}},0.0,3.72631924,520.0,-30.99803847,-5.166339745,{'tags': ['Lutetium germanide (1/2)']},-30.99803847,-5.166339745,-0.5773376683333336,"['xas', 'bandstructure']",True,"[601099, 636917]",True,2021-05-12 10:57:55.580000,NM,6,10,mp-973906,,LuGe2,"{'functional': 'PBE', 'labels': ['Lu_3', 'Ge_d'], 'pot_type': 'paw'}","{'Lu': 1.0, 'Ge': 2.0}",GGA,mp-973906,"['mp-974097', 'mp-1005266', 'mp-1005284', 'mp-973906', 'mp-1077794', 'mp-1504050', 'mp-1697662', 'mp-1804537', 'mp-1010834', 'mp-1589340']",0.00132595,"{'Lu': 2.0, 'Ge': 4.0}",121.7736759455104,[],NM,False,63,0,"[0, 0, 0, 0, 0, 0]",2.177728461762652e-05,0.00132595,0,0.0026519,MP,data/source/MP/cleaned/cifs/MP-mp-973906.cif,False,,data/final/MP/graphs/Ge2Lu1-MP-mp-973906.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
As2Ba0.5Fe2Na0.5,1,0.0,2.0,False,As4Ba1Fe4Na1,As4Ba1Fe4Na1,32.8,Ferrite,True,As40Ba10Fe40Na10,As-Ba-Fe-Na,4,Supercon,Ba0.5Na0.5Fe2As2,MP-mp-1227868,Ba1Na1Fe4As4,As-Ba-Fe-Na,As40Ba10Fe40Na10,C m m m,orthorhombic,5.458732000131759,5.462821,6.96934908,data/final/MP/cifs/As2Ba0.5Fe2Na0.5-MP-mp-1227868.cif,data/source/MP/raw/cifs/mp-1227868.cif,mp-1227868,0.0,,2019-01-13 03:39:01.428000,5.934244973483095,,,{'GGA': {'task_id': 'mp-1731957'}},0.0195872770000011,4.30353274,520.0,-59.62394279,-5.962394279,{'tags': []},-59.62394279,-5.962394279,-0.3865939246551718,[],False,[],True,2021-05-12 11:00:59.151000,FM,10,4,mp-1227868,,BaNa(FeAs)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Na_pv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Na': 1.0, 'Fe': 4.0, 'As': 4.0}",GGA,mp-1227868,"['mp-1227868', 'mp-1396889', 'mp-1731957', 'mp-1827521']",0.9949323,"{'Ba': 1.0, 'Na': 1.0, 'Fe': 4.0, 'As': 4.0}",191.22642477974767,[],FM,True,65,1,"[0.0, 0.0, 0.3, 0.3, 0.3, 0.3, 0.0, 0.0, 0.0, 0.0]",0.0052029017493055,0.9949323,4,0.9949323,MP,data/source/MP/cleaned/cifs/MP-mp-1227868.cif,False,,data/final/MP/graphs/As2Ba0.5Fe2Na0.5-MP-mp-1227868.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Al3Pd2U0.99Y0.01,2,0.0033333333333333,1.0,True,Al3Pd2U0.99Y0.01,Al3Pd2U1,1.11,Heavy_fermion,True,Al50Pd33.333U16.5Y0.167,Al-Pd-U-Y,4,Supercon,U0.99Y0.01Pd2Al3,MP-mp-4561,U1Al3Pd2,Al-Pd-U,Al50Pd33.333U16.667,P 6/m m m,hexagonal,4.239652,5.384229999094356,5.3842309,data/final/MP/cifs/Al3Pd2U0.99Y0.01-MP-mp-4561-synth_doped.cif,data/source/MP/raw/cifs/mp-4561.cif,mp-4561,0.0,,2011-05-12 23:59:10,8.296603403902926,10.17188/1208253,"@misc{osti_1208253,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UAl3Pd2 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208253"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700804'}},0.0796314472916668,8.0468212,520.0,-36.36476907,-6.060794845,"{'tags': ['Aluminium palladium uranium (3/2/1)', 'Aluminum palladium uranium (3/2/1)']}",-36.36476907,-6.060794845,-0.5794779916666665,"['xas', 'elasticity', 'bandstructure']",True,"[657574, 106242, 659234]",True,2021-05-12 10:56:20.740000,FM,6,9,mp-4561,,UAl3Pd2,"{'functional': 'PBE', 'labels': ['U', 'Al', 'Pd'], 'pot_type': 'paw'}","{'U': 1.0, 'Al': 3.0, 'Pd': 2.0}",GGA,mp-4561,"['mp-4561', 'mp-991619', 'mp-993538', 'mp-1251974', 'mp-1441898', 'mp-1700804', 'mp-1933710', 'mp-994863', 'mp-1593816']",2.2050571,"{'U': 1.0, 'Al': 3.0, 'Pd': 2.0}",106.4408038742404,[],FM,True,191,1,"[2.2, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0207162762750765,2.2050571,1,2.2050571,MP,data/source/MP/cleaned/cifs/MP-mp-4561.cif,True,,data/final/MP/graphs/Al3Pd2U0.99Y0.01-MP-mp-4561-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Be22Mo0.3Re0.7,3,0.0260869565217391,2.0,False,Be44Mo0.6Re1.4,Be44Re2,8.6,Other,True,Be95.652Mo1.304Re3.043,Be-Mo-Re,3,Supercon,Be22Mo0.3Re0.7,MP-mp-569364,Be44Re2,Be-Re,Be95.652Re4.348,F d -3 m,cubic,8.13033498,8.13033498,8.13033498,data/final/MP/cifs/Be22Mo0.3Re0.7-MP-mp-569364-synth_doped.cif,data/source/MP/raw/cifs/mp-569364.cif,mp-569364,0.0,,2014-02-18 16:00:38,3.359981469520108,10.17188/1275060,"@misc{osti_1275060,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Be22Re (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1275060"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1729467'}},0.0,5.02493221,520.0,-192.40958206,-4.182817001304348,"{'tags': ['Rhenium beryllium (1/22)', 'Beryllium rhenium (22/1)']}",-192.40958206,-4.182817001304348,-0.0649209050000001,"['xas', 'elasticity', 'bandstructure']",True,"[150540, 616399]",True,2021-05-12 10:56:22.739000,NM,46,7,mp-569364,,Be22Re,"{'functional': 'PBE', 'labels': ['Be_sv', 'Re_pv'], 'pot_type': 'paw'}","{'Be': 22.0, 'Re': 1.0}",GGA,mp-569364,"['mp-914535', 'mp-1001401', 'mp-569364', 'mp-1384180', 'mp-1729467', 'mp-1836331', 'mp-1007840']",9.15e-05,"{'Be': 44.0, 'Re': 2.0}",380.0233840958512,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.815493142228399e-07,9.15e-05,0,0.000183,MP,data/source/MP/cleaned/cifs/MP-mp-569364.cif,True,,data/final/MP/graphs/Be22Mo0.3Re0.7-MP-mp-569364-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Al2Y1,1,0.0,2.0,False,Al4Y2,Al4Y2,0.0,Other,True,Al66.667Y33.333,Al-Y,2,Supercon,Al2Y1,MP-mp-2322,Y2Al4,Al-Y,Al66.667Y33.333,F d -3 m,cubic,5.571813349999999,5.571813349999999,5.571813349999999,data/final/MP/cifs/Al2Y1-MP-mp-2322.cif,data/source/MP/raw/cifs/mp-2322.cif,mp-2322,0.0,,2011-05-12 21:01:55,3.879200230807744,10.17188/1199338,"@misc{osti_1199338,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YAl2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199338"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668831'}},0.0,5.84499563,520.0,-31.10323876,-5.183873126666667,"{'tags': ['Aluminum yttrium (2/1)', 'Aluminium yttrium (2/1)']}",-31.10323876,-5.183873126666667,-0.531332202222222,"['xas', 'elasticity', 'bandstructure']",True,"[609661, 609649, 609638, 609665, 609645, 609660, 609654, 609628, 609662, 58213, 609664, 609647, 58214, 186476, 609629, 609655, 609653, 609656]",True,2021-05-12 10:56:16.728000,NM,6,11,mp-2322,,YAl2,"{'functional': 'PBE', 'labels': ['Y_sv', 'Al'], 'pot_type': 'paw'}","{'Y': 1.0, 'Al': 2.0}",GGA,mp-2322,"['mp-913585', 'mp-930449', 'mp-929922', 'mp-2322', 'mp-1077550', 'mp-1252865', 'mp-1440585', 'mp-1668831', 'mp-1803835', 'mp-1590398', 'mp-1592369']",0.01159115,"{'Y': 2.0, 'Al': 4.0}",122.31358058536324,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",0.0001895316929571,0.01159115,0,0.0231823,MP,data/source/MP/cleaned/cifs/MP-mp-2322.cif,False,,data/final/MP/graphs/Al2Y1-MP-mp-2322.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ge3Mo5,1,0.0,2.0,False,Ge6Mo10,Ge6Mo10,1.65,Other,True,Ge37.5Mo62.5,Ge-Mo,2,Supercon,Ge3Mo5,MP-mp-17094,Ge6Mo10,Ge-Mo,Ge37.5Mo62.5,I 4/m c m,tetragonal,5.006915996958563,7.4405922788024785,7.44059228,data/final/MP/cifs/Ge3Mo5-MP-mp-17094.cif,data/source/MP/raw/cifs/mp-17094.cif,mp-17094,0.0,,2014-02-16 02:30:52,9.425175792162042,10.17188/1192328,"@misc{osti_1192328,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ge3Mo5 (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1192328"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671752'}},0.0409530968750004,7.95867674,520.0,-138.01523407,-8.625952129375,{'tags': ['Molybdenum germanide (5/3)']},-138.01523407,-8.625952129375,-0.1137897900000002,"['xas', 'bandstructure']",True,"[637142, 77281]",True,2021-05-12 10:56:55.092000,NM,16,7,mp-17094,,Ge3Mo5,"{'functional': 'PBE', 'labels': ['Ge_d', 'Mo_pv'], 'pot_type': 'paw'}","{'Ge': 3.0, 'Mo': 5.0}",GGA,mp-17094,"['mp-17094', 'mp-996590', 'mp-1105865', 'mp-1431705', 'mp-1671752', 'mp-1777897', 'mp-1604492']",0.00018285,"{'Ge': 6.0, 'Mo': 10.0}",245.8150997257444,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.4877035642155874e-06,0.00018285,0,0.0003657,MP,data/source/MP/cleaned/cifs/MP-mp-17094.cif,False,,data/final/MP/graphs/Ge3Mo5-MP-mp-17094.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Bi1In2,1,0.0,2.0,False,Bi2In4,Bi2In4,5.584,Other,True,Bi33.333In66.667,Bi-In,2,Supercon,Bi1In2,MP-mp-23188,In4Bi2,Bi-In,Bi33.333In66.667,P 63/m m c,hexagonal,5.580768003066436,5.58076899,6.682238,data/final/MP/cifs/Bi1In2-MP-mp-23188.cif,data/source/MP/raw/cifs/mp-23188.cif,mp-23188,0.0,,2014-02-21 09:44:07,8.08208377762098,10.17188/1199309,"@misc{osti_1199309,
    author = ""Persson, Kristin"",
    title = ""Materials Data on In2Bi (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199309"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702188'}},0.0289779983333313,6.35759427,520.0,-18.61759444,-3.102932406666667,"{'tags': ['Indium bismuthide (2/1)', 'Bismuth indium (1/2)']}",-18.61759444,-3.102932406666667,0.0282015166666666,"['xas', 'elasticity', 'bandstructure']",True,"[1247, 616699, 1250, 616700, 1249, 1248]",True,2021-05-12 10:56:16.728000,NM,6,12,mp-23188,,In2Bi,"{'functional': 'PBE', 'labels': ['In_d', 'Bi'], 'pot_type': 'paw'}","{'In': 2.0, 'Bi': 1.0}",GGA,mp-23188,"['mp-927113', 'mp-926592', 'mp-910993', 'mp-23188', 'mp-1072678', 'mp-1072728', 'mp-1072693', 'mp-1441100', 'mp-1702188', 'mp-1830667', 'mp-1591115', 'mp-1072734']",0.0016852,"{'In': 4.0, 'Bi': 2.0}",180.23561435188296,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0]",1.8699966774711903e-05,0.0016852,0,0.0033704,MP,data/source/MP/cleaned/cifs/MP-mp-23188.cif,False,,data/final/MP/graphs/Bi1In2-MP-mp-23188.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
As2Ba1Fe1.24Ru0.76,3,0.096,1.0,True,As2Ba1Fe1.24Ru0.76,As2Ba1Fe1Ru1,7.1,Ferrite,True,As40Ba20Fe24.8Ru15.2,As-Ba-Fe-Ru,4,Supercon,Ba1Fe1.24Ru0.76As2,MP-mp-1227957,Ba1Fe1As2Ru1,As-Ba-Fe-Ru,As40Ba20Fe20Ru20,I -4 m 2,tetragonal,4.094864001738776,4.094864001738776,6.95494631,data/final/MP/cifs/As2Ba1Fe1.24Ru0.76-MP-mp-1227957-synth_doped.cif,data/source/MP/raw/cifs/mp-1227957.cif,mp-1227957,0.0,,2019-01-13 03:43:43.313000,6.954649854678861,,,{'GGA': {'task_id': 'mp-1760595'}},0.0416149764999991,4.99960359,520.0,-31.92363508,-6.384727016,{'tags': []},-31.92363508,-6.384727016,-0.5884058670000002,['bandstructure'],True,[],True,2021-05-12 10:58:49.477000,FM,5,5,mp-1227957,,BaFeAs2Ru,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Fe_pv', 'As', 'Ru_pv'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Fe': 1.0, 'As': 2.0, 'Ru': 1.0}",GGA,mp-1227957,"['mp-1227957', 'mp-1384589', 'mp-1760595', 'mp-1795888', 'mp-1627878']",0.1424858,"{'Ba': 1.0, 'Fe': 1.0, 'As': 2.0, 'Ru': 1.0}",106.03277503651196,[],FM,True,119,1,"[0.0, 0.2, 0.0, 0.0, -0.0]",0.0013437901625316,0.1424858,1,0.1424858,MP,data/source/MP/cleaned/cifs/MP-mp-1227957.cif,True,,data/final/MP/graphs/As2Ba1Fe1.24Ru0.76-MP-mp-1227957-synth_doped.json,0,True,-42m,0,0,0,0,6,0,0,0,0,1,0,1.0,False
Ba2Cu2.1Nd2Ti1.9O11,2,0.0105263157894736,1.0,True,Ba2Cu2.1Nd2Ti1.9O11,Ba2Cu2Nd2Ti2O11,0.0,Cuprate,True,Ba10.526Cu11.053Nd10.526Ti10O57.89473684210527,Ba-Cu-Nd-Ti-O,5,Supercon,Nd2Ba2Ti1.9Cu2.1O11,MP-mp-557043,Ba2Nd2Ti2Cu2O11,Ba-Cu-Nd-Ti-O,Ba10.526Cu10.526Nd10.526Ti10.526O57.89473684210527,P 4/m m m,tetragonal,3.937893,3.937893,16.03637,data/final/MP/cifs/Ba2Cu2.1Nd2Ti1.9O11-MP-mp-557043-synth_doped.cif,data/source/MP/raw/cifs/mp-557043.cif,mp-557043,0.0,,2014-03-21 17:50:18,6.423489915304013,10.17188/1269671,"@misc{osti_1269671,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Nd2Ti2Cu2O11 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1269671"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1705848'}},0.0219658294736904,4.03119509,520.0,-141.65509819,-7.45553148368421,{'tags': ['Dineodymium dibarium dicopper dititanium oxide']},-141.65509819,-7.45553148368421,-3.0221527200877176,"['xas', 'bandstructure']",True,[75342],True,2021-05-12 10:57:19.246000,NM,19,8,mp-557043,oxide,Ba2Nd2Ti2Cu2O11,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Nd_3', 'Ti_pv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Nd': 2.0, 'Ti': 2.0, 'Cu': 2.0, 'O': 11.0}",GGA,mp-557043,"['mp-908761', 'mp-924365', 'mp-923779', 'mp-557043', 'mp-1425576', 'mp-1705848', 'mp-1775561', 'mp-1604704']",7.81e-05,"{'Ba': 2.0, 'Nd': 2.0, 'Ti': 2.0, 'Cu': 2.0, 'O': 11.0}",248.6760101077176,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.140632663607956e-07,7.81e-05,0,7.81e-05,MP,data/source/MP/cleaned/cifs/MP-mp-557043.cif,True,,data/final/MP/graphs/Ba2Cu2.1Nd2Ti1.9O11-MP-mp-557043-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
As1F0.225Fe1Pr1O0.775,3,0.1124999999999999,2.0,False,As2F0.45Fe2Pr2O1.55,As2Fe2Pr2O2,50.0,Ferrite,True,As25F5.625Fe25Pr25O19.375,As-F-Fe-Pr-O,5,Supercon,Pr1Fe1As1F0.225O0.775,MP-mp-22491,Pr2Fe2As2O2,As-Fe-Pr-O,As25Fe25Pr25O25,P 4/n m m,tetragonal,4.094889,4.094889,9.258722,data/final/MP/cifs/As1F0.225Fe1Pr1O0.775-MP-mp-22491-synth_doped.cif,data/source/MP/raw/cifs/mp-22491.cif,mp-22491,0.0,,2014-02-25 19:17:30,6.153806906111091,,,{'GGA+U': {'task_id': 'mp-1695715'}},0.3808778432291664,4.12348168,520.0,-51.7633941,-6.4704242625,{'tags': ['Praseodymium iron arsenic oxide (1/1/1/1)']},-51.7633941,-6.4704242625,-1.491677511249999,"['xas', 'bandstructure']",True,"[162830, 162833, 246832, 90316, 422000, 236649, 236648, 602491]",True,2021-05-12 10:57:10.838000,FM,8,8,mp-22491,oxide,PrFeAsO,"{'functional': 'PBE', 'labels': ['Pr_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Pr': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-22491,"['mp-510622', 'mp-1079608', 'mp-1079857', 'mp-22491', 'mp-1476145', 'mp-1695715', 'mp-1778524', 'mp-1596397']",3.7947681,"{'Pr': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",155.25132378854377,[],FM,True,129,1,"[0.0, 0.0, 3.5, 3.5, 0.0, 0.0, 0.0, 0.0]",0.0488854846116297,3.7947681,2,7.5895362,MP,data/source/MP/cleaned/cifs/MP-mp-22491.cif,True,,data/final/MP/graphs/As1F0.225Fe1Pr1O0.775-MP-mp-22491-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B4Ru4Th1,1,0.0,4.0,False,B16Ru16Th4,B16Ru16Th4,0.0,Other,True,B44.444Ru44.444Th11.111,B-Ru-Th,3,Supercon,Th1Ru4B4,MP-mp-1203781,Th4B16Ru16,B-Ru-Th,B44.444Ru44.444Th11.111,I 41/a c d,tetragonal,7.576110004218978,7.576110004218978,9.3152573,data/final/MP/cifs/B4Ru4Th1-MP-mp-1203781.cif,data/source/MP/raw/cifs/mp-1203781.cif,mp-1203781,0.0,,2019-01-12 07:34:19.702000,10.319293134876135,,,{'GGA': {'task_id': 'mp-1742143'}},0.0,8.10391182,520.0,-304.80921564,-8.466922656666666,{'tags': ['Thorium ruthenium boride (1/4/4)']},-304.80921564,-8.466922656666666,-0.5525911062962953,[],False,[615378],True,2021-05-12 11:00:14.977000,NM,36,4,mp-1203781,,Th(BRu)4,"{'functional': 'PBE', 'labels': ['Th', 'B', 'Ru_pv'], 'pot_type': 'paw'}","{'Th': 1.0, 'B': 4.0, 'Ru': 4.0}",GGA,mp-1203781,"['mp-1203781', 'mp-1385802', 'mp-1742143', 'mp-1815705']",4.55e-05,"{'Th': 4.0, 'B': 16.0, 'Ru': 16.0}",437.4095527901554,[],NM,False,142,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.160860201590371e-07,4.55e-05,0,0.000182,MP,data/source/MP/cleaned/cifs/MP-mp-1203781.cif,False,,data/final/MP/graphs/B4Ru4Th1-MP-mp-1203781.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
S1.8Se0.2Ta1,3,0.1333333333333333,2.0,False,S3.6Se0.4Ta2,S4Ta2,2.75,Chevrel,True,S60Se6.667Ta33.333,S-Se-Ta,3,Supercon,Ta1S1.8Se0.2,MP-mp-1984,Ta2S4,S-Ta,S66.667Ta33.333,P 63/m m c,hexagonal,3.342118002453848,3.34211879,13.760229,data/final/MP/cifs/S1.8Se0.2Ta1-MP-mp-1984-synth_doped.cif,data/source/MP/raw/cifs/mp-1984.cif,mp-1984,0.0,,2011-05-13 02:12:28,6.114813551853877,10.17188/1195033,"@misc{osti_1195033,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TaS2 (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195033"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677531'}},0.0,3.34024684,520.0,-46.55212986,-7.75868831,"{'tags': ['Tantalum sulfide (1/2)', 'Tantalum(IV) sulfide']}",-46.55212986,-7.75868831,-1.3837958554166672,"['xas', 'elasticity', 'bandstructure']",True,"[68488, 651092, 651103, 651101, 169771, 651082]",True,2021-05-12 10:56:14.760000,NM,6,14,mp-1984,,TaS2,"{'functional': 'PBE', 'labels': ['Ta_pv', 'S'], 'pot_type': 'paw'}","{'Ta': 1.0, 'S': 2.0}",GGA,mp-1984,"['mp-923440', 'mp-922654', 'mp-908250', 'mp-1984', 'mp-1072221', 'mp-1072202', 'mp-1072270', 'mp-1077051', 'mp-1077493', 'mp-1437951', 'mp-1677531', 'mp-1780443', 'mp-1588583', 'mp-1072284']",0.0126151,"{'Ta': 2.0, 'S': 4.0}",133.10672210966268,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0]",0.000189548653893,0.0126151,0,0.0252302,MP,data/source/MP/cleaned/cifs/MP-mp-1984.cif,True,,data/final/MP/graphs/S1.8Se0.2Ta1-MP-mp-1984-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
In0.91Te1,2,0.0471204188481675,1.0,True,In0.91Te1,In1Te1,2.04,Other,True,In47.644Te52.356,In-Te,2,Supercon,In0.91Te1,MP-mp-2597,In1Te1,In-Te,In50Te50,F m -3 m,cubic,4.44363296,4.44363296,4.44363296,data/final/MP/cifs/In0.91Te1-MP-mp-2597-synth_doped.cif,data/source/MP/raw/cifs/mp-2597.cif,mp-2597,0.0,,2011-05-12 18:35:42,6.488053472608879,10.17188/1201088,"@misc{osti_1201088,
    author = ""Persson, Kristin"",
    title = ""Materials Data on InTe (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201088"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668520'}},0.0,6.3140604,520.0,-6.47268679,-3.236343395,"{'tags': ['Indium telluride (1/1)', 'Indium tellurium (1/1) - HP, HT', 'High pressure experimental phase', 'Indium telluride  - II']}",-6.47268679,-3.236343395,-0.4998510649999996,"['xas', 'elasticity', 'bandstructure']",True,"[169425, 44653, 169422, 59547, 169428, 640620, 640614, 169431, 169419, 640622]",True,2021-05-12 10:56:18.721000,NM,2,9,mp-2597,,InTe,"{'functional': 'PBE', 'labels': ['In_d', 'Te'], 'pot_type': 'paw'}","{'In': 1.0, 'Te': 1.0}",GGA,mp-2597,"['mp-1000805', 'mp-1007252', 'mp-2597', 'mp-1440879', 'mp-1668520', 'mp-1793575', 'mp-1011993', 'mp-1588148', 'mp-1589064']",0.0001824,"{'In': 1.0, 'Te': 1.0}",62.04396451824765,[],NM,False,225,0,"[0, 0]",2.939850820563773e-06,0.0001824,0,0.0001824,MP,data/source/MP/cleaned/cifs/MP-mp-2597.cif,True,,data/final/MP/graphs/In0.91Te1-MP-mp-2597-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Co1Sc0.125Zr1.875,3,0.0833333333333333,2.0,False,Co2Sc0.25Zr3.75,Co2Zr4,2.89,Other,True,Co33.333Sc4.167Zr62.5,Co-Sc-Zr,3,Supercon,Co1Sc0.125Zr1.875,MP-mp-628,Zr4Co2,Co-Zr,Co33.333Zr66.667,I 4/m c m,tetragonal,5.27792884001752,5.27792884,5.277928840000001,data/final/MP/cifs/Co1Sc0.125Zr1.875-MP-mp-628-synth_doped.cif,data/source/MP/raw/cifs/mp-628.cif,mp-628,0.0,,2011-05-13 12:16:44,7.17077101131263,10.17188/1278899,"@misc{osti_1278899,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Zr2Co (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278899"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677545'}},0.0,4.51380976,520.0,-49.95120762,-8.325201269999999,"{'tags': ['Cobalt zirconium (1/2)', 'Zirconium cobalt (2/1)']}",-49.95120762,-8.325201269999999,-0.2572949183333328,"['xas', 'elasticity', 'bandstructure']",True,"[625671, 191386, 625688, 102740, 625665]",True,2021-05-12 10:56:27.046000,NM,6,20,mp-628,,Zr2Co,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Co'], 'pot_type': 'paw'}","{'Zr': 2.0, 'Co': 1.0}",GGA,mp-628,"['mp-928347', 'mp-912327', 'mp-928866', 'mp-628', 'mp-1071352', 'mp-1071381', 'mp-1071431', 'mp-1071762', 'mp-1071803', 'mp-1071859', 'mp-1071883', 'mp-1071742', 'mp-1071925', 'mp-1441633', 'mp-1677545', 'mp-1802810', 'mp-1591799', 'mp-1071792', 'mp-1071416', 'mp-1071915']",0.0001226,"{'Zr': 4.0, 'Co': 2.0}",111.79353060019714,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0]",2.1933290654975308e-06,0.0001226,0,0.0002452,MP,data/source/MP/cleaned/cifs/MP-mp-628.cif,True,,data/final/MP/graphs/Co1Sc0.125Zr1.875-MP-mp-628-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ba2Cu1Hg1O4.117,2,0.0144141924356289,0.971770312120476,True,Ba1.943Cu0.972Hg0.972O4,Ba2Cu1Hg1O4,82.0,Cuprate,True,Ba24.64Cu12.32Hg12.32O50.72070962178144,Ba-Cu-Hg-O,4,Supercon,Hg1Ba2Cu1O4.117,MP-mp-6562,Ba2Cu1Hg1O4,Ba-Cu-Hg-O,Ba25Cu12.5Hg12.5O50,P 4/m m m,tetragonal,3.933714,3.933714,9.827602,data/final/MP/cifs/Ba2Cu1Hg1O4.117-MP-mp-6562-synth_doped.cif,data/source/MP/raw/cifs/mp-6562.cif,mp-6562,0.0,,2011-05-13 18:18:06,6.582036471328142,10.17188/1281336,"@misc{osti_1281336,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2CuHgO4 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281336"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697135'}},0.0234340381250053,2.58068675,520.0,-40.91481298,-5.1143516225,"{'tags': ['Mercury dibarium copper oxide', 'High pressure experimental phase']}",-40.91481298,-5.1143516225,-1.953767533125,"['xas', 'bandstructure']",True,"[75722, 75720, 75724, 75721, 75723]",True,2021-05-12 10:57:32.679000,NM,8,8,mp-6562,oxide,Ba2CuHgO4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Cu_pv', 'Hg', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",GGA,mp-6562,"['mp-6562', 'mp-990899', 'mp-992892', 'mp-1435690', 'mp-1697135', 'mp-1878488', 'mp-994198', 'mp-1592659']",0.0003984,"{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",152.07335344042525,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0, 0, 0]",2.619788352047311e-06,0.0003984,0,0.0003984,MP,data/source/MP/cleaned/cifs/MP-mp-6562.cif,True,,data/final/MP/graphs/Ba2Cu1Hg1O4.117-MP-mp-6562-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
La0.05Os4Pr0.95Sb12,2,0.0058823529411764,1.0,True,La0.05Os4Pr0.95Sb12,Os4Pr1Sb12,1.815,Heavy_fermion,True,La0.294Os23.529Pr5.588Sb70.588,La-Os-Pr-Sb,4,Supercon,Pr0.95La0.05Os4Sb12,MP-mp-4251,Pr1Sb12Os4,Os-Pr-Sb,Os23.529Pr5.882Sb70.588,I m -3,cubic,8.16020751180899,8.16020751,8.16020751,data/final/MP/cifs/La0.05Os4Pr0.95Sb12-MP-mp-4251-synth_doped.cif,data/source/MP/raw/cifs/mp-4251.cif,mp-4251,0.0,,2011-05-15 09:44:04,9.380402650313032,10.17188/1208003,"@misc{osti_1208003,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Pr(Sb3Os)4 (SG:204) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208003"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700242'}},0.0086126564705901,7.28147826,520.0,-102.089288,-6.005252235294117,{'tags': ['Praseodymium osmium antimonide (1/4/12)']},-102.089288,-6.005252235294117,-0.1677005267647063,"['xas', 'elasticity', 'bandstructure']",True,"[155178, 155187, 165911, 155182, 155185, 155181, 647731, 155183, 155188, 155180, 155179, 165910, 155184, 155186, 183087]",True,2021-05-12 10:56:20.740000,NM,17,9,mp-4251,,Pr(Sb3Os)4,"{'functional': 'PBE', 'labels': ['Pr_3', 'Sb', 'Os_pv'], 'pot_type': 'paw'}","{'Pr': 1.0, 'Sb': 12.0, 'Os': 4.0}",GGA,mp-4251,"['mp-1000443', 'mp-1006919', 'mp-4251', 'mp-1188290', 'mp-1430112', 'mp-1700242', 'mp-1817791', 'mp-1011635', 'mp-1609307']",0.0526026,"{'Pr': 1.0, 'Sb': 12.0, 'Os': 4.0}",418.2940787754696,[],NM,False,204,0,"[-0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.000125755067234,0.0526026,0,0.0526026,MP,data/source/MP/cleaned/cifs/MP-mp-4251.cif,True,,data/final/MP/graphs/La0.05Os4Pr0.95Sb12-MP-mp-4251-synth_doped.json,0,True,m-3,2,0,0,0,0,0,0,0,0,1,0,1.0,False
Al1Mg4Si3,1,0.0,4.0,False,Al4Mg16Si12,Al4Mg16Si12,5.2,Other,True,Al12.5Mg50Si37.5,Al-Mg-Si,3,Supercon,Mg4Al1Si3,MP-mp-1198317,Mg16Al4Si12,Al-Mg-Si,Al12.5Mg50Si37.5,P 4/n c c,tetragonal,6.559292,6.559292,13.820557,data/final/MP/cifs/Al1Mg4Si3-MP-mp-1198317.cif,data/source/MP/raw/cifs/mp-1198317.cif,mp-1198317,0.0,,2019-01-12 03:07:28.185000,2.3285644339230727,,,,0.0871631271875026,5.9478128,520.0,-106.84277413,-3.3388366915625,{'tags': ['Magnesium silicide aluminide (4/3/1)']},-106.84277413,-3.3388366915625,-0.0093819303124997,[],False,[251038],True,2021-05-12 11:00:03.538000,NM,32,2,mp-1198317,,Mg4AlSi3,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Al', 'Si'], 'pot_type': 'paw'}","{'Mg': 4.0, 'Al': 1.0, 'Si': 3.0}",GGA,mp-1198317,"['mp-1198317', 'mp-1403099']",0.001434525,"{'Mg': 16.0, 'Al': 4.0, 'Si': 12.0}",594.6199500417971,[],NM,False,130,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",9.650029400454286e-06,0.001434525,0,0.0057381,MP,data/source/MP/cleaned/cifs/MP-mp-1198317.cif,False,,data/final/MP/graphs/Al1Mg4Si3-MP-mp-1198317.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ca0.36Cu3Pb2Sr2Y0.64O8,2,0.0175,2.0,False,Ca0.72Cu6Pb4Sr4Y1.28O16,Ca1Cu6Pb4Sr4Y1O16,65.0,Cuprate,True,Ca2.25Cu18.75Pb12.5Sr12.5Y4O50,Ca-Cu-Pb-Sr-Y-O,6,Supercon,Pb2Sr2Y0.64Ca0.36Cu3O8,MP-mp-1218734,Sr4Ca1Y1Cu6Pb4O16,Ca-Cu-Pb-Sr-Y-O,Ca3.125Cu18.75Pb12.5Sr12.5Y3.125O50,P -1,triclinic,5.409182,5.43484807,15.91871111,data/final/MP/cifs/Ca0.36Cu3Pb2Sr2Y0.64O8-MP-mp-1218734-synth_doped.cif,data/source/MP/raw/cifs/mp-1218734.cif,mp-1218734,0.0,,2019-01-12 19:51:15.257000,6.904106081290769,,,,0.0219881772737666,4.29183133,520.0,-186.6260121,-5.832062878125,{'tags': []},-186.6260121,-5.832062878125,-1.9929613410416671,[],False,[],True,2021-05-12 11:00:42.526000,NM,32,3,mp-1218734,oxide,Sr4CaYCu6(PbO4)4,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Y_sv', 'Cu_pv', 'Pb_d', 'O'], 'pot_type': 'paw'}","{'Sr': 4.0, 'Ca': 1.0, 'Y': 1.0, 'Cu': 6.0, 'Pb': 4.0, 'O': 16.0}",GGA,mp-1218734,"['mp-1218734', 'mp-1380819', 'mp-1821682']",0.002747,"{'Sr': 4.0, 'Ca': 1.0, 'Y': 1.0, 'Cu': 6.0, 'Pb': 4.0, 'O': 16.0}",467.9286423671341,[],NM,False,2,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.870553223892458e-06,0.002747,0,0.002747,MP,data/source/MP/cleaned/cifs/MP-mp-1218734.cif,True,,data/final/MP/graphs/Ca0.36Cu3Pb2Sr2Y0.64O8-MP-mp-1218734-synth_doped.json,0,True,-1,0,0,0,0,0,2,0,1,0,0,0,1.0,False
Co4Sn13Yb3,1,0.0,2.0,False,Co8Sn26Yb6,Co8Sn26Yb6,2.5,Heavy_fermion,True,Co20Sn65Yb15,Co-Sn-Yb,3,Supercon,Yb3Co4Sn13,MP-mp-1198658,Yb6Co8Sn26,Co-Sn-Yb,Co20Sn65Yb15,P m -3 n,cubic,9.568913,9.568913,9.568913,data/final/MP/cifs/Co4Sn13Yb3-MP-mp-1198658.cif,data/source/MP/raw/cifs/mp-1198658.cif,mp-1198658,0.0,,2019-01-12 03:24:01.650000,8.710777959346808,,,{'GGA': {'task_id': 'mp-1683131'}},0.001885828333334,7.65479434,520.0,-183.03092818,-4.5757732045,"{'tags': ['Ytterbium cobalt stannide (3/4/13)', 'Yb3Co4Sn13', 'Yb3Rh4Sn13']}",-183.03092818,-4.5757732045,-0.3169466977499994,[],False,[625310],True,2021-05-12 11:00:03.538000,NM,40,4,mp-1198658,,Yb3Co4Sn13,"{'functional': 'PBE', 'labels': ['Yb_2', 'Co', 'Sn_d'], 'pot_type': 'paw'}","{'Yb': 3.0, 'Co': 4.0, 'Sn': 13.0}",GGA,mp-1198658,"['mp-1198658', 'mp-1325015', 'mp-1683131', 'mp-1895822']",0.13087405,"{'Yb': 6.0, 'Co': 8.0, 'Sn': 26.0}",876.1688685626616,[],NM,False,223,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0002987416117961,0.13087405,0,0.2617481,MP,data/source/MP/cleaned/cifs/MP-mp-1198658.cif,False,,data/final/MP/graphs/Co4Sn13Yb3-MP-mp-1198658.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Bi1Co0.1Sc0.9,3,0.0999999999999999,1.0,True,Bi1Co0.1Sc0.9,Bi1Sc1,0.0,Other,True,Bi50Co5Sc45,Bi-Co-Sc,3,Supercon,Bi1Co0.1Sc0.9,MP-mp-570632,Sc1Bi1,Bi-Sc,Bi50Sc50,F m -3 m,cubic,4.26879515,4.26879515,4.26879515,data/final/MP/cifs/Bi1Co0.1Sc0.9-MP-mp-570632-synth_doped.cif,data/source/MP/raw/cifs/mp-570632.cif,mp-570632,0.0,,2014-02-16 10:30:00,7.666073148858634,10.17188/1275825,"@misc{osti_1275825,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ScBi (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1275825"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-928206'}},0.0,5.35898923,520.0,-11.53734507,-5.768672535,{'tags': ['Bismuth scandium (1/1)']},-11.53734507,-5.768672535,-0.6574208275000002,"['xas', 'elasticity', 'bandstructure']",True,[58856],True,2021-05-12 10:56:27.046000,NM,2,7,mp-570632,,ScBi,"{'functional': 'PBE', 'labels': ['Sc_sv', 'Bi'], 'pot_type': 'paw'}","{'Sc': 1.0, 'Bi': 1.0}",GGA,mp-570632,"['mp-912166', 'mp-928206', 'mp-928766', 'mp-570632', 'mp-1439745', 'mp-1791136', 'mp-1592799']",0.0012531,"{'Sc': 1.0, 'Bi': 1.0}",55.00484515558099,[],NM,False,225,0,"[0, 0]",2.278162944474457e-05,0.0012531,0,0.0012531,MP,data/source/MP/cleaned/cifs/MP-mp-570632.cif,True,,data/final/MP/graphs/Bi1Co0.1Sc0.9-MP-mp-570632-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ru2Zr1,1,0.0,4.0,False,Ru8Zr4,Ru8Zr4,2.053333333,Other,True,Ru66.667Zr33.333,Ru-Zr,2,Supercon,Ru2Zr1,MP-mp-569979,Zr4Ru8,Ru-Zr,Ru66.667Zr33.333,P 63/m m c,hexagonal,5.199970002962749,5.199969900000001,8.585561,data/final/MP/cifs/Ru2Zr1-MP-mp-569979.cif,data/source/MP/raw/cifs/mp-569979.cif,mp-569979,0.0,,2015-02-15 05:14:40,9.692034084217662,10.17188/1275399,"@misc{osti_1275399,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrRu2 (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1275399"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696982'}},0.0668370908333315,6.5373156,520.0,-112.84354849,-9.403629040833334,{'tags': ['Ruthenium zirconium (2/1)']},-112.84354849,-9.403629040833334,-0.371469060833333,"['xas', 'bandstructure']",True,"[650790, 650784, 650786]",True,2021-05-12 10:57:24.969000,NM,12,9,mp-569979,,ZrRu2,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Ru_pv'], 'pot_type': 'paw'}","{'Zr': 1.0, 'Ru': 2.0}",GGA,mp-569979,"['mp-944576', 'mp-933806', 'mp-943944', 'mp-569979', 'mp-1102037', 'mp-1423955', 'mp-1696982', 'mp-1831031', 'mp-1598903']",0.00149575,"{'Zr': 4.0, 'Ru': 8.0}",201.04856359401228,[],NM,False,63,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, 0.0, 0.0, -0.0, 0.0]",2.975897908965805e-05,0.00149575,0,0.005983,MP,data/source/MP/cleaned/cifs/MP-mp-569979.cif,False,,data/final/MP/graphs/Ru2Zr1-MP-mp-569979.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ge0.35Nb3Sn0.65,3,0.075,2.0,False,Ge0.7Nb6Sn1.3,Ge1Nb6Sn1,16.1,Other,True,Ge8.75Nb75Sn16.25,Ge-Nb-Sn,3,Supercon,Nb3Sn0.65Ge0.35,MP-mp-1220377,Nb6Sn1Ge1,Ge-Nb-Sn,Ge12.5Nb75Sn12.5,P m -3,cubic,5.257683,5.257683,5.257683,data/final/MP/cifs/Ge0.35Nb3Sn0.65-MP-mp-1220377-synth_doped.cif,data/source/MP/raw/cifs/mp-1220377.cif,mp-1220377,0.0,,2019-01-12 21:14:01.957000,8.555097085551632,,,{'GGA': {'task_id': 'mp-1753393'}},0.041374483958334,6.24154069,520.0,-70.84482418,-8.8556030225,{'tags': []},-70.84482418,-8.8556030225,-0.2005492787499996,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,8,5,mp-1220377,,Nb6SnGe,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Sn_d', 'Ge_d'], 'pot_type': 'paw'}","{'Nb': 6.0, 'Sn': 1.0, 'Ge': 1.0}",GGA,mp-1220377,"['mp-1220377', 'mp-1392635', 'mp-1753393', 'mp-1926728', 'mp-1621241']",0.9917683,"{'Nb': 6.0, 'Sn': 1.0, 'Ge': 1.0}",145.33934321471764,[],NM,False,200,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0068238116263867,0.9917683,0,0.9917683,MP,data/source/MP/cleaned/cifs/MP-mp-1220377.cif,True,,data/final/MP/graphs/Ge0.35Nb3Sn0.65-MP-mp-1220377-synth_doped.json,0,True,m-3,2,0,0,0,0,0,0,1,0,0,0,1.0,False
B2Er0.1Lu0.9Ru1,2,0.0499999999999999,4.0,False,B8Er0.4Lu3.6Ru4,B8Lu4Ru4,8.77,Other,True,B50Er2.5Lu22.5Ru25,B-Er-Lu-Ru,4,Supercon,Lu0.9Er0.1Ru1B2,MP-mp-29239,Lu4B8Ru4,B-Lu-Ru,B50Lu25Ru25,P n m a,orthorhombic,5.262881,5.829858,6.288542,data/final/MP/cifs/B2Er0.1Lu0.9Ru1-MP-mp-29239-synth_doped.cif,data/source/MP/raw/cifs/mp-29239.cif,mp-29239,0.0,,2014-02-24 06:45:28,10.246997128776938,10.17188/1203618,"@misc{osti_1203618,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LuB2Ru (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1203618"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677301'}},0.0,6.02142224,520.0,-119.30016105,-7.456260065625,"{'tags': ['Lutetium ruthenium(III) boride', 'Lutetium ruthenium boride (1/1/2)']}",-119.30016105,-7.456260065625,-0.6677291364583331,"['xas', 'bandstructure']",True,"[614715, 100774]",True,2021-05-12 10:57:03.017000,NM,16,8,mp-29239,,LuB2Ru,"{'functional': 'PBE', 'labels': ['Lu_3', 'B', 'Ru_pv'], 'pot_type': 'paw'}","{'Lu': 1.0, 'B': 2.0, 'Ru': 1.0}",GGA,mp-29239,"['mp-909473', 'mp-925177', 'mp-924466', 'mp-29239', 'mp-1381674', 'mp-1677301', 'mp-1784701', 'mp-1603819']",4.565e-05,"{'Lu': 4.0, 'B': 8.0, 'Ru': 4.0}",192.9440954509509,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",9.4638812124945e-07,4.565e-05,0,0.0001826,MP,data/source/MP/cleaned/cifs/MP-mp-29239.cif,True,,data/final/MP/graphs/B2Er0.1Lu0.9Ru1-MP-mp-29239-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
B2Os1Tm1,1,0.0,4.0,False,B8Os4Tm4,B8Os4Tm4,0.0,Other,True,B50Os25Tm25,B-Os-Tm,3,Supercon,Tm1Os1B2,MP-mp-1188249,Tm4B8Os4,B-Os-Tm,B50Os25Tm25,P n m a,orthorhombic,5.279895,5.841864,6.327581,data/final/MP/cifs/B2Os1Tm1-MP-mp-1188249.cif,data/source/MP/raw/cifs/mp-1188249.cif,mp-1188249,0.0,,2019-01-11 19:18:02.184000,12.959130387485333,,,,0.0,6.3290064,520.0,-126.20007954,-7.88750497125,"{'tags': ['Thulium osmium boride (1/1/2)', 'TmOsB2', 'LuRuB2']}",-126.20007954,-7.88750497125,-0.6220086662500002,[],False,[615136],True,2021-05-12 10:59:52.436000,NM,16,3,mp-1188249,,TmB2Os,"{'functional': 'PBE', 'labels': ['Tm_3', 'B', 'Os_pv'], 'pot_type': 'paw'}","{'Tm': 1.0, 'B': 2.0, 'Os': 1.0}",GGA,mp-1188249,"['mp-1188249', 'mp-1834259', 'mp-1987288']",0.000890725,"{'Tm': 4.0, 'B': 8.0, 'Os': 4.0}",195.1706198860922,[],NM,False,62,0,"[-0.0, -0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",1.8255309134537884e-05,0.000890725,0,0.0035629,MP,data/source/MP/cleaned/cifs/MP-mp-1188249.cif,False,,data/final/MP/graphs/B2Os1Tm1-MP-mp-1188249.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Br1.8C2I0.2Y2,3,0.0666666666666666,1.0,True,Br1.8C2I0.2Y2,Br2C2Y2,0.0,Other,True,Br30C33.333I3.333Y33.333,Br-C-I-Y,4,Supercon,Y2I0.2Br1.8C2,MP-mp-643367,Y2C2Br2,Br-C-Y,Br33.333C33.333Y33.333,C 1 2/m 1,monoclinic,3.846773999724948,4.02928774,10.04420137,data/final/MP/cifs/Br1.8C2I0.2Y2-MP-mp-643367-synth_doped.cif,data/source/MP/raw/cifs/mp-643367.cif,mp-643367,0.0,,2013-06-28 23:28:36,4.453038714645779,10.17188/1280298,"@misc{osti_1280298,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YCBr (SG:12) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1280298"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698781'}},0.0,3.4577348,520.0,-41.14365364,-6.857275606666666,{'tags': ['Yttrium bromide carbide (2/2/2)']},-41.14365364,-6.857275606666666,-1.2585473713888884,"['xas', 'elasticity', 'bandstructure']",True,[78871],True,2021-05-12 10:56:27.046000,NM,6,11,mp-643367,,YCBr,"{'functional': 'PBE', 'labels': ['Y_sv', 'C', 'Br'], 'pot_type': 'paw'}","{'Y': 1.0, 'C': 1.0, 'Br': 1.0}",GGA,mp-643367,"['mp-643367', 'mp-1002327', 'mp-1003939', 'mp-1048935', 'mp-1048950', 'mp-1423619', 'mp-1698781', 'mp-1779867', 'mp-1009265', 'mp-1593059', 'mp-1048942']",0.0169429,"{'Y': 2.0, 'C': 2.0, 'Br': 2.0}",134.8560417099284,[],NM,False,12,0,"[0, 0, 0, 0, 0, 0]",0.000251273873757,0.0169429,0,0.0338858,MP,data/source/MP/cleaned/cifs/MP-mp-643367.cif,True,,data/final/MP/graphs/Br1.8C2I0.2Y2-MP-mp-643367-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
Ba2Cu1Tl2O6.12,2,0.0098103335513407,1.9609460784313728,False,Ba3.922Cu1.961Tl3.922O12,Ba4Cu2Tl4O12,87.8,Cuprate,True,Ba17.986Cu8.993Tl17.986O55.035971223021576,Ba-Cu-Tl-O,4,Supercon,Tl2Ba2Cu1O6.12,MP-mp-6027,Ba4Tl4Cu2O12,Ba-Cu-Tl-O,Ba18.182Cu9.091Tl18.182O54.54545454545455,C m c a,orthorhombic,5.504110002693673,5.585743,12.28312762,data/final/MP/cifs/Ba2Cu1Tl2O6.12-MP-mp-6027-synth_doped.cif,data/source/MP/raw/cifs/mp-6027.cif,mp-6027,0.0,,2011-05-19 00:05:23,7.606665315628389,10.17188/1277350,"@misc{osti_1277350,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Tl2CuO6 (SG:64) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277350"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1673478'}},0.0059215576010052,4.10961464,520.0,-115.75418737,-5.261553971363636,"{'tags': ['Dithallium dibarium cuprate', 'Dithallium(III) dibarium copper oxide']}",-115.75418737,-5.261553971363636,-1.7862630028787878,"['xas', 'bandstructure']",True,"[202723, 202724, 202722]",True,2021-05-12 10:57:28.836000,NM,22,8,mp-6027,oxide,Ba2Tl2CuO6,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Tl_d', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Tl': 2.0, 'Cu': 1.0, 'O': 6.0}",GGA,mp-6027,"['mp-925246', 'mp-909581', 'mp-924678', 'mp-6027', 'mp-1504634', 'mp-1673478', 'mp-1837163', 'mp-1605186']",2.9e-05,"{'Ba': 4.0, 'Tl': 4.0, 'Cu': 2.0, 'O': 12.0}",368.0385386017736,[],NM,False,64,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.5759219189476614e-07,2.9e-05,0,5.8e-05,MP,data/source/MP/cleaned/cifs/MP-mp-6027.cif,True,,data/final/MP/graphs/Ba2Cu1Tl2O6.12-MP-mp-6027-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
B4Co4Gd1,1,0.0,2.0,False,B8Co8Gd2,B8Co8Gd2,0.0,Other,True,B44.444Co44.444Gd11.111,B-Co-Gd,3,Supercon,Gd1Co4B4,MP-mp-1181496,Gd2Co8B8,B-Co-Gd,B44.444Co44.444Gd11.111,P 42/n m c,tetragonal,5.016232,5.016232,6.998587,data/final/MP/cifs/B4Co4Gd1-MP-mp-1181496.cif,data/source/MP/raw/cifs/mp-1181496.cif,mp-1181496,0.0,,2019-01-11 10:29:26.045000,8.226703065238032,,,{'GGA': {'task_id': 'mp-1673751'}},0.0009759805555571,6.13905968,520.0,-147.08473247,-8.171374026111112,{'tags': ['Gadolinium cobalt boride (1/4/4)']},-147.08473247,-8.171374026111112,-0.4794895257407414,['bandstructure'],True,[613081],True,2021-05-12 10:58:25.879000,FM,18,6,mp-1181496,,Gd(CoB)4,"{'functional': 'PBE', 'labels': ['Gd', 'Co', 'B'], 'pot_type': 'paw'}","{'Gd': 1.0, 'Co': 4.0, 'B': 4.0}",GGA,mp-1181496,"['mp-1181496', 'mp-1415745', 'mp-1673751', 'mp-1771354', 'mp-1828638', 'mp-1604621']",7.3625879,"{'Gd': 2.0, 'Co': 8.0, 'B': 8.0}",176.1025296143138,[],FM,True,137,2,"[6.9, 6.9, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0836170600856782,7.3625879,10,14.7251758,MP,data/source/MP/cleaned/cifs/MP-mp-1181496.cif,False,,data/final/MP/graphs/B4Co4Gd1-MP-mp-1181496.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Rh1,1,0.0,4.0,False,Rh4,Rh4,0.08138375,Other,True,Rh100,Rh,1,Supercon,Rh1,MP-mp-1186916,Rh4,Rh,Rh100,P 63/m m c,hexagonal,2.7240140049250257,2.72401459,8.870532,data/final/MP/cifs/Rh1-MP-mp-1186916.cif,data/source/MP/raw/cifs/mp-1186916.cif,mp-1186916,0.0,,2019-01-11 14:41:22.216000,11.990811681777446,,,{'GGA': {'task_id': 'mp-1767098'}},0.0399171250000005,6.86028185,520.0,-29.29756298,-7.324390745,{'tags': []},-29.29756298,-7.324390745,0.0399171250000005,['bandstructure'],True,[],True,2021-05-12 10:58:29.672000,NM,4,5,mp-1186916,,Rh,"{'functional': 'PBE', 'labels': ['Rh_pv'], 'pot_type': 'paw'}",{'Rh': 1.0},GGA,mp-1186916,"['mp-1186916', 'mp-1403418', 'mp-1767098', 'mp-1794507', 'mp-1616206']",0.073335325,{'Rh': 4.0},57.00318125342329,[],NM,False,194,0,"[0, 0, 0, 0]",0.0051460513878316,0.073335325,0,0.2933413,MP,data/source/MP/cleaned/cifs/MP-mp-1186916.cif,False,,data/final/MP/graphs/Rh1-MP-mp-1186916.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
B2Co3Sc1,1,0.0,1.0,True,B2Co3Sc1,B2Co3Sc1,0.0,Other,True,B33.333Co50Sc16.667,B-Co-Sc,3,Supercon,Sc1Co3B2,MP-mp-4938,Sc1Co3B2,B-Co-Sc,B33.333Co50Sc16.667,P 6/m m m,hexagonal,2.981184,4.886841997605899,4.88684259,data/final/MP/cifs/B2Co3Sc1-MP-mp-4938.cif,data/source/MP/raw/cifs/mp-4938.cif,mp-4938,0.0,,2011-05-13 00:42:40,6.554709346740869,10.17188/1208500,"@misc{osti_1208500,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ScCo3B2 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208500"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704629'}},0.0,6.00325059,520.0,-44.29413206,-7.382355343333334,"{'tags': ['Sacandium cobalt boride (1/3/2)', 'Cobalt scandium boride (3/1/2)']}",-44.29413206,-7.382355343333334,-0.5463210047222221,"['xas', 'elasticity', 'bandstructure']",True,"[613280, 44179]",True,2021-05-12 10:56:20.740000,NM,6,8,mp-4938,,ScCo3B2,"{'functional': 'PBE', 'labels': ['Sc_sv', 'Co', 'B'], 'pot_type': 'paw'}","{'Sc': 1.0, 'Co': 3.0, 'B': 2.0}",GGA,mp-4938,"['mp-910100', 'mp-926032', 'mp-925593', 'mp-4938', 'mp-1438228', 'mp-1704629', 'mp-1793121', 'mp-1596465']",0.0115183,"{'Sc': 1.0, 'Co': 3.0, 'B': 2.0}",61.65610408046081,[],NM,False,191,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001868152419259,0.0115183,0,0.0115183,MP,data/source/MP/cleaned/cifs/MP-mp-4938.cif,False,,data/final/MP/graphs/B2Co3Sc1-MP-mp-4938.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Hf1Si2,1,0.0,2.0,False,Hf2Si4,Hf2Si4,0.0,Other,True,Hf33.333Si66.667,Hf-Si,2,Supercon,Hf1Si2,MP-mp-1069,Hf2Si4,Hf-Si,Hf33.333Si66.667,C m c m,orthorhombic,3.659544,3.69848599902553,7.49830741,data/final/MP/cifs/Hf1Si2-MP-mp-1069.cif,data/source/MP/raw/cifs/mp-1069.cif,mp-1069,0.0,,2011-05-12 21:49:16,7.923770467997716,10.17188/1187293,"@misc{osti_1187293,
    author = ""Persson, Kristin"",
    title = ""Materials Data on HfSi2 (SG:63) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187293"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703398'}},0.0064866966666654,8.39818314,520.0,-44.99084218,-7.498473696666667,"{'tags': ['Hafnium silicide (1/2)', 'Hafnium silicon (1/2)']}",-44.99084218,-7.498473696666667,-0.515201400000001,"['xas', 'elasticity', 'bandstructure']",True,"[638923, 638917, 16697, 638908]",True,2021-05-12 10:56:10.715000,NM,6,12,mp-1069,,HfSi2,"{'functional': 'PBE', 'labels': ['Hf_pv', 'Si'], 'pot_type': 'paw'}","{'Hf': 1.0, 'Si': 2.0}",GGA,mp-1069,"['mp-1069', 'mp-1077153', 'mp-1077458', 'mp-909393', 'mp-924383', 'mp-925095', 'mp-1124875', 'mp-1138292', 'mp-1413041', 'mp-1703398', 'mp-1797616', 'mp-1596248']",3.98e-05,"{'Hf': 2.0, 'Si': 4.0}",98.35311597709315,[],NM,False,63,0,"[0, 0, 0, 0, 0, 0]",8.093287051377119e-07,3.98e-05,0,7.96e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1069.cif,False,,data/final/MP/graphs/Hf1Si2-MP-mp-1069.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ir4Si10Tm5,1,0.0,2.0,False,Ir8Si20Tm10,Ir8Si20Tm10,0.95,Other,True,Ir21.053Si52.632Tm26.316,Ir-Si-Tm,3,Supercon,Tm5Ir4Si10,MP-mp-1202399,Tm10Si20Ir8,Ir-Si-Tm,Ir21.053Si52.632Tm26.316,P 4/m b m,tetragonal,4.231212,12.579405,12.579405,data/final/MP/cifs/Ir4Si10Tm5-MP-mp-1202399.cif,data/source/MP/raw/cifs/mp-1202399.cif,mp-1202399,0.0,,2019-01-12 06:26:44.012000,9.396463456222818,,,,0.0,7.07570077,520.0,-257.90856043,-6.787067379736842,"{'tags': ['Sc5Co4Si10', 'Thulium iridium silicide (5/4/10)', 'Tm5Ir4Si10 lt1']}",-257.90856043,-6.787067379736842,-0.8556969062280697,[],False,[641018],True,2021-05-12 11:00:12.709000,NM,38,2,mp-1202399,,Tm5(Si5Ir2)2,"{'functional': 'PBE', 'labels': ['Tm_3', 'Si', 'Ir'], 'pot_type': 'paw'}","{'Tm': 5.0, 'Si': 10.0, 'Ir': 4.0}",GGA,mp-1202399,"['mp-1202399', 'mp-1341648']",0.00123735,"{'Tm': 10.0, 'Si': 20.0, 'Ir': 8.0}",669.5530381648724,[],NM,False,65,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",3.6960477496789775e-06,0.00123735,0,0.0024747,MP,data/source/MP/cleaned/cifs/MP-mp-1202399.cif,False,,data/final/MP/graphs/Ir4Si10Tm5-MP-mp-1202399.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Cl1N1Zr1,1,0.0,2.0,False,Cl2N2Zr2,Cl2N2Zr2,13.0,Other,True,Cl33.333N33.333Zr33.333,Cl-N-Zr,3,Supercon,Zr1N1Cl1,MP-mp-568592,Zr2N2Cl2,Cl-N-Zr,Cl33.333N33.333Zr33.333,R -3 m,trigonal,3.645830270497761,3.6458302704977608,9.89271338,data/final/MP/cifs/Cl1N1Zr1-MP-mp-568592.cif,data/source/MP/raw/cifs/mp-568592.cif,mp-568592,1.7555999999999998,,2013-09-22 18:10:04,4.198985265079451,10.17188/1274532,"@misc{osti_1274532,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrNCl (SG:166) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1274532"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1758958'}},0.0,2.42682469,520.0,-48.05775582,-8.00962597,{'tags': []},-48.05775582,-8.00962597,-2.0903818983333338,"['xas', 'elasticity', 'bandstructure']",True,[151469],True,2021-05-12 10:56:22.739000,NM,6,8,mp-568592,,ZrNCl,"{'functional': 'PBE', 'labels': ['Zr_sv', 'N', 'Cl'], 'pot_type': 'paw'}","{'Zr': 1.0, 'N': 1.0, 'Cl': 1.0}",GGA,mp-568592,"['mp-655558', 'mp-655567', 'mp-658590', 'mp-568592', 'mp-1404647', 'mp-1758958', 'mp-1803879', 'mp-1625484']",1.955e-05,"{'Zr': 2.0, 'N': 2.0, 'Cl': 2.0}",111.27011177040367,[],NM,False,166,0,"[0, 0, 0, 0, 0, 0]",3.513971485952984e-07,1.955e-05,0,3.91e-05,MP,data/source/MP/cleaned/cifs/MP-mp-568592.cif,False,,data/final/MP/graphs/Cl1N1Zr1-MP-mp-568592.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ba1Bi2Ti2O1,1,0.0,1.0,True,Ba1Bi2Ti2O1,Ba1Bi2Ti2O1,4.6,Oxide,True,Ba16.667Bi33.333Ti33.333O16.666666666666668,Ba-Bi-Ti-O,4,Supercon,Ba1Ti2Bi2O1,MP-mp-1070808,Ba1Ti2Bi2O1,Ba-Bi-Ti-O,Ba16.667Bi33.333Ti33.333O16.666666666666668,P 4/m m m,tetragonal,4.115314,4.115314,8.707278,data/final/MP/cifs/Ba1Bi2Ti2O1-MP-mp-1070808.cif,data/source/MP/raw/cifs/mp-1070808.cif,mp-1070808,0.0,,2018-03-22 04:02:28,7.51104508778746,,,{'GGA': {'task_id': 'mp-1696612'}},0.020336857268524,5.51269191,520.0,-37.69302401,-6.282170668333333,{'tags': []},-37.69302401,-6.282170668333333,-1.323673253611111,['bandstructure'],True,[430063],True,2021-05-12 10:58:14.654000,NM,6,8,mp-1070808,oxide,BaTi2Bi2O,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ti_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Ti': 2.0, 'Bi': 2.0, 'O': 1.0}",GGA,mp-1070808,"['mp-1070808', 'mp-1070849', 'mp-1070911', 'mp-1426573', 'mp-1696612', 'mp-1781118', 'mp-1596315', 'mp-1070905']",0.0005019,"{'Ba': 1.0, 'Ti': 2.0, 'Bi': 2.0, 'O': 1.0}",147.4647998920059,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0]",3.403524097734242e-06,0.0005019,0,0.0005019,MP,data/source/MP/cleaned/cifs/MP-mp-1070808.cif,False,,data/final/MP/graphs/Ba1Bi2Ti2O1-MP-mp-1070808.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
C0.1N0.9Nb1,3,0.0999999999999999,1.0,True,C0.1N0.9Nb1,N1Nb1,8.5,Other,True,C5N45Nb50,C-N-Nb,3,Supercon,C0.1N0.9Nb1,MP-mp-2634,Nb1N1,N-Nb,N50Nb50,P -6 m 2,hexagonal,2.898656,2.9761920047347994,2.97619211,data/final/MP/cifs/C0.1N0.9Nb1-MP-mp-2634-synth_doped.cif,data/source/MP/raw/cifs/mp-2634.cif,mp-2634,0.0,,2011-05-12 17:49:04,7.984187332554685,10.17188/1201157,"@misc{osti_1201157,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbN (SG:187) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201157"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671304'}},0.0,7.12357548,520.0,-20.57319827,-10.286599135,"{'tags': ['Niobium nitride (1/1)', 'Niobium nitride', 'Niobium nitride (1/1) - gamma']}",-20.57319827,-10.286599135,-1.2481991524999998,"['xas', 'elasticity', 'bandstructure']",True,"[185569, 644536, 76385, 191062]",True,2021-05-12 10:56:18.721000,NM,2,17,mp-2634,,NbN,"{'functional': 'PBE', 'labels': ['Nb_pv', 'N'], 'pot_type': 'paw'}","{'Nb': 1.0, 'N': 1.0}",GGA,mp-2634,"['mp-926732', 'mp-910421', 'mp-926222', 'mp-2634', 'mp-1058402', 'mp-1058440', 'mp-1058487', 'mp-1061535', 'mp-1061589', 'mp-1061648', 'mp-1116126', 'mp-1442283', 'mp-1671304', 'mp-1924826', 'mp-1594881', 'mp-1061618', 'mp-1058457']",0.0002504,"{'Nb': 1.0, 'N': 1.0}",22.23561881453577,[],NM,False,187,0,"[0, 0]",1.1261211216496917e-05,0.0002504,0,0.0002504,MP,data/source/MP/cleaned/cifs/MP-mp-2634.cif,True,,data/final/MP/graphs/C0.1N0.9Nb1-MP-mp-2634-synth_doped.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Ba1Fe1.9Se3,2,0.0225988700564971,4.0,False,Ba4Fe7.6Se12,Ba4Fe8Se12,11.0,Ferrite,True,Ba16.949Fe32.203Se50.847,Ba-Fe-Se,3,Supercon,Ba1Fe1.9Se3,MP-mp-504563,Ba4Fe8Se12,Ba-Fe-Se,Ba16.667Fe33.333Se50,P n m a,orthorhombic,5.42469,9.198872,12.160433,data/final/MP/cifs/Ba1Fe1.9Se3-MP-mp-504563-synth_doped.cif,data/source/MP/raw/cifs/mp-504563.cif,mp-504563,0.0,,2014-02-25 21:39:28,5.318568614546303,10.17188/1261771,"@misc{osti_1261771,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BaFe2Se3 (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1261771"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1766207'}},0.0582123379166672,3.70613428,520.0,-136.72250513,-5.696771047083334,"{'tags': ['Barium diiron selenide', 'Barium diiron(II) triselenide', 'Barium diiron triselenide']}",-136.72250513,-5.696771047083334,-1.041650686588541,"['xas', 'bandstructure']",True,"[424315, 424314, 185512, 16308, 290595]",True,2021-05-12 10:57:08.928000,FM,24,12,mp-504563,,BaFe2Se3,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Fe_pv', 'Se'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Fe': 2.0, 'Se': 3.0}",GGA,mp-504563,"['mp-909153', 'mp-924980', 'mp-924189', 'mp-504563', 'mp-1190953', 'mp-1191248', 'mp-1191577', 'mp-1192240', 'mp-1387997', 'mp-1766207', 'mp-1892022', 'mp-1616921']",6.999619675,"{'Ba': 4.0, 'Fe': 8.0, 'Se': 12.0}",606.8181191736439,[],FM,True,62,1,"[0.0, 0.0, 0.0, 0.0, 3.0, 3.0, 3.0, 3.0, 3.0, 3.0, 3.0, 3.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0461398198493609,6.999619675,8,27.9984787,MP,data/source/MP/cleaned/cifs/MP-mp-504563.cif,True,,data/final/MP/graphs/Ba1Fe1.9Se3-MP-mp-504563-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Al0.967Nb3Se0.033,2,0.0165,2.0,False,Al1.934Nb6Se0.066,Al2Nb6,18.1,Other,True,Al24.175Nb75Se0.825,Al-Nb-Se,3,Supercon,Nb3Al0.967Se0.033,MP-mp-796,Nb6Al2,Al-Nb,Al25Nb75,P m -3 n,cubic,5.215254,5.215254,5.215254,data/final/MP/cifs/Al0.967Nb3Se0.033-MP-mp-796-synth_doped.cif,data/source/MP/raw/cifs/mp-796.cif,mp-796,0.0,,2011-05-13 16:07:37,7.157298025966356,,,{'GGA': {'task_id': 'mp-1686893'}},0.0460773865000003,5.52947534,520.0,-69.48918494,-8.6861481175,"{'tags': ['Aluminium niobium (1/3)', 'Niobium aluminide (3/1)', 'Aluminum niobium (1/3)']}",-69.48918494,-8.6861481175,-0.1737753800000003,"['bandstructure', 'elasticity']",True,"[608675, 608654, 608688, 608668, 608669, 608685, 608676, 608683, 58014, 608657, 107856, 608655, 608666, 608691, 608656, 608665, 608673, 608653, 608661]",True,2021-05-12 10:56:31.128000,NM,8,10,mp-796,,Nb3Al,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Al': 1.0}",GGA,mp-796,"['mp-911586', 'mp-927906', 'mp-796', 'mp-927472', 'mp-1260512', 'mp-1440919', 'mp-1686893', 'mp-1927652', 'mp-1591599', 'mp-1587739']",0.16323955,"{'Nb': 6.0, 'Al': 2.0}",141.8490379078192,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0023015954483396,0.16323955,0,0.3264791,MP,data/source/MP/cleaned/cifs/MP-mp-796.cif,True,,data/final/MP/graphs/Al0.967Nb3Se0.033-MP-mp-796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ce0.25Ge12Pr0.75Pt4,3,0.0294117647058823,1.0,True,Ce0.25Ge12Pr0.75Pt4,Ge12Pr1Pt4,1.015,Heavy_fermion,True,Ce1.471Ge70.588Pr4.412Pt23.529,Ce-Ge-Pr-Pt,4,Supercon,Pr0.75Ce0.25Pt4Ge12,MP-mp-1105939,Pr1Ge12Pt4,Ge-Pr-Pt,Ge70.588Pr5.882Pt23.529,I m -3,cubic,7.560907531676135,7.560907530000001,7.56090753,data/final/MP/cifs/Ce0.25Ge12Pr0.75Pt4-MP-mp-1105939-synth_doped.cif,data/source/MP/raw/cifs/mp-1105939.cif,mp-1105939,0.0,,2018-07-19 06:58:09,8.947691530234051,,,{'GGA': {'task_id': 'mp-1705662'}},0.0059454020588258,4.25899828,520.0,-91.15368674,-5.361981572941176,{'tags': ['Praseodymium platinum germanide (1/4/12)']},-91.15368674,-5.361981572941176,-0.3889895585294119,['bandstructure'],True,[174554],True,2021-05-12 10:58:22.271000,NM,17,5,mp-1105939,,Pr(Ge3Pt)4,"{'functional': 'PBE', 'labels': ['Pr_3', 'Ge_d', 'Pt'], 'pot_type': 'paw'}","{'Pr': 1.0, 'Ge': 12.0, 'Pt': 4.0}",GGA,mp-1105939,"['mp-1105939', 'mp-1427343', 'mp-1705662', 'mp-1805701', 'mp-1584493']",0.0022709,"{'Pr': 1.0, 'Ge': 12.0, 'Pt': 4.0}",332.73607546662794,[],NM,False,204,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.824928727115922e-06,0.0022709,0,0.0022709,MP,data/source/MP/cleaned/cifs/MP-mp-1105939.cif,True,,data/final/MP/graphs/Ce0.25Ge12Pr0.75Pt4-MP-mp-1105939-synth_doped.json,0,True,m-3,2,0,0,0,0,0,0,0,0,1,0,1.0,False
Ba1.8Cu3Pr1.2O7,3,0.0307692307692307,1.0,True,Ba1.8Cu3Pr1.2O7,Ba2Cu3Pr1O7,0.0,Cuprate,True,Ba13.846Cu23.077Pr9.231O53.84615384615385,Ba-Cu-Pr-O,4,Supercon,Pr1.2Ba1.8Cu3O7,MP-mp-20936,Ba2Pr1Cu3O7,Ba-Cu-Pr-O,Ba15.385Cu23.077Pr7.692O53.84615384615385,P m m m,orthorhombic,3.903923,3.95568,11.916432,data/final/MP/cifs/Ba1.8Cu3Pr1.2O7-MP-mp-20936-synth_doped.cif,data/source/MP/raw/cifs/mp-20936.cif,mp-20936,0.0,,2014-02-22 14:41:55,6.480717836004672,10.17188/1196129,"@misc{osti_1196129,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2PrCu3O7 (SG:47) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196129"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698257'}},0.0256000172756332,3.18514576,520.0,-78.62827906,-6.048329158461538,"{'tags': ['Dibarium praseodymium tricopper heptaoxide', 'Praseodymium dibarium dicopper copper(III) oxide', 'Praseodymium dibarium tricopper heptaoxide', 'Praseodymium dibarium copper(III) dicopper oxide']}",-78.62827906,-6.048329158461538,-2.145007016153845,"['xas', 'bandstructure']",True,"[41452, 94377, 81168, 173910, 89221]",True,2021-05-12 10:56:57.051000,NM,13,8,mp-20936,oxide,Ba2PrCu3O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Pr_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Pr': 1.0, 'Cu': 3.0, 'O': 7.0}",GGA,mp-20936,"['mp-988090', 'mp-987725', 'mp-20936', 'mp-1417367', 'mp-1698257', 'mp-1833655', 'mp-988324', 'mp-1602318']",0.0007234,"{'Ba': 2.0, 'Pr': 1.0, 'Cu': 3.0, 'O': 7.0}",184.02152853403555,[],NM,False,47,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.931061793491212e-06,0.0007234,0,0.0007234,MP,data/source/MP/cleaned/cifs/MP-mp-20936.cif,True,,data/final/MP/graphs/Ba1.8Cu3Pr1.2O7-MP-mp-20936-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Al0.33Ga0.67Nb3,3,0.085,2.0,False,Al0.66Ga1.34Nb6,Al1Ga1Nb6,18.1,Other,True,Al8.25Ga16.75Nb75,Al-Ga-Nb,3,Supercon,Nb3Ga0.67Al0.33,MP-mp-1220348,Nb6Al1Ga1,Al-Ga-Nb,Al12.5Ga12.5Nb75,P m -3,cubic,5.200229,5.200229,5.200229,data/final/MP/cifs/Al0.33Ga0.67Nb3-MP-mp-1220348-synth_doped.cif,data/source/MP/raw/cifs/mp-1220348.cif,mp-1220348,0.0,,2019-01-12 21:12:34.707000,7.724213490019127,,,{'GGA': {'task_id': 'mp-1752644'}},0.0490749666875007,5.24232507,520.0,-68.77635789,-8.59704473625,{'tags': []},-68.77635789,-8.59704473625,-0.1743569746875,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,8,5,mp-1220348,,Nb6AlGa,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al', 'Ga_d'], 'pot_type': 'paw'}","{'Nb': 6.0, 'Al': 1.0, 'Ga': 1.0}",GGA,mp-1220348,"['mp-1220348', 'mp-1411514', 'mp-1752644', 'mp-1787843', 'mp-1619126']",0.0457429,"{'Nb': 6.0, 'Al': 1.0, 'Ga': 1.0}",140.62657729809163,[],NM,False,200,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0003252791960017,0.0457429,0,0.0457429,MP,data/source/MP/cleaned/cifs/MP-mp-1220348.cif,True,,data/final/MP/graphs/Al0.33Ga0.67Nb3-MP-mp-1220348-synth_doped.json,0,True,m-3,2,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Cu3Eu1O6.5,1,0.0,2.0,False,Ba4Cu6Eu2O13,Ba4Cu6Eu2O13,92.0,Cuprate,True,Ba16Cu24Eu8O52,Ba-Cu-Eu-O,4,Supercon,Eu1Ba2Cu3O6.5,MP-mp-1228334,Ba4Eu2Cu6O13,Ba-Cu-Eu-O,Ba16Cu24Eu8O52,F m m m,orthorhombic,5.542399695079225,5.54239969,12.677941949999996,data/final/MP/cifs/Ba2Cu3Eu1O6.5-MP-mp-1228334.cif,data/source/MP/raw/cifs/mp-1228334.cif,mp-1228334,0.0,,2019-01-13 04:03:33.652000,6.46221735276749,,,,0.0205340296000011,2.97616244,520.0,-159.77099583,-6.3908398332,{'tags': []},-159.77099583,-6.3908398332,-2.0609316990000006,[],False,[],True,2021-05-12 11:00:59.151000,FiM,25,3,mp-1228334,oxide,Ba4Eu2Cu6O13,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Eu', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 4.0, 'Eu': 2.0, 'Cu': 6.0, 'O': 13.0}",GGA,mp-1228334,"['mp-1228334', 'mp-1348365', 'mp-1839682']",12.0020823,"{'Ba': 4.0, 'Eu': 2.0, 'Cu': 6.0, 'O': 13.0}",370.6675970607458,[],FiM,True,69,3,"[0.0, 0.0, 0.0, 0.0, 6.3, 6.3, -0.1, -0.1, -0.1, -0.1, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0323796371605502,12.0020823,6,12.0020823,MP,data/source/MP/cleaned/cifs/MP-mp-1228334.cif,False,,data/final/MP/graphs/Ba2Cu3Eu1O6.5-MP-mp-1228334.json,0,True,mmm,0,0,0,7,0,0,0,0,0,0,1,1.0,False
Cu2Gd1Ru0.95Sr2Ti0.05O8,2,0.0071428571428571,2.0,False,Cu4Gd2Ru1.9Sr4Ti0.1O16,Cu4Gd2Ru2Sr4O16,32.2,Cuprate,True,Cu14.286Gd7.143Ru6.786Sr14.286Ti0.357O57.142857142857146,Cu-Gd-Ru-Sr-Ti-O,6,Supercon,Ru0.95Ti0.05Sr2Gd1Cu2O8,MP-mp-1194240,Sr4Gd2Cu4Ru2O16,Cu-Gd-Ru-Sr-O,Cu14.286Gd7.143Ru7.143Sr14.286O57.142857142857146,P 4/m b m,tetragonal,5.472451,5.472451,11.740702,data/final/MP/cifs/Cu2Gd1Ru0.95Sr2Ti0.05O8-MP-mp-1194240-synth_doped.cif,data/source/MP/raw/cifs/mp-1194240.cif,mp-1194240,0.0,,2019-01-11 23:51:58.932000,6.504561898971391,,,{'GGA': {'task_id': 'mp-1765260'}},0.0213449239285443,3.93502801,520.0,-201.55352223,-7.198340079642857,"{'tags': ['Sr2Cu2GdRuO8 orth', 'Sr2Cu2GdRuO8', 'Ruthenium distrontium gadolinium dicopper octaoxide']}",-201.55352223,-7.198340079642857,-2.268654352380952,['bandstructure'],True,[245741],True,2021-05-12 10:58:35.561000,FiM,28,6,mp-1194240,oxide,Sr2GdCu2RuO8,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Gd', 'Cu_pv', 'Ru_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Gd': 1.0, 'Cu': 2.0, 'Ru': 1.0, 'O': 8.0}",GGA,mp-1194240,"['mp-1194240', 'mp-1396976', 'mp-1659973', 'mp-1765260', 'mp-1841948', 'mp-1638264']",4.23696715,"{'Sr': 4.0, 'Gd': 2.0, 'Cu': 4.0, 'Ru': 2.0, 'O': 16.0}",351.6072554818909,[],FiM,True,127,2,"[-0.0, -0.0, -0.0, -0.0, 6.9, 6.9, 0.0, 0.0, 0.0, 0.0, -1.8, -1.8, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0241005672319991,4.23696715,4,8.4739343,MP,data/source/MP/cleaned/cifs/MP-mp-1194240.cif,True,,data/final/MP/graphs/Cu2Gd1Ru0.95Sr2Ti0.05O8-MP-mp-1194240-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ga0.2Si0.8V3,3,0.0999999999999999,2.0,False,Ga0.4Si1.6V6,Si2V6,11.415,Other,True,Ga5Si20V75,Ga-Si-V,3,Supercon,V3Ga0.2Si0.8,MP-mp-2567,V6Si2,Si-V,Si25V75,P m -3 n,cubic,4.702381,4.702381,4.702381,data/final/MP/cifs/Ga0.2Si0.8V3-MP-mp-2567-synth_doped.cif,data/source/MP/raw/cifs/mp-2567.cif,mp-2567,0.0,,2011-05-13 19:15:43,5.778142190030859,10.17188/1200874,"@misc{osti_1200874,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Si (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1200874"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668672'}},0.0,7.30599425,520.0,-69.05773321,-8.63221665125,{'tags': ['Vanadium silicide (3/1)']},-69.05773321,-8.63221665125,-0.4452085937499994,"['xas', 'elasticity', 'bandstructure']",True,"[652491, 87328, 652522, 652502, 652510, 652520, 600518, 186003, 652507, 652513, 652497, 601150, 652514, 652487, 22412, 652509, 652529, 652532, 652499, 652539, 652537, 652533, 652512, 652538, 652490, 652493, 652494, 652511, 652519, 87329, 652526, 652500]",True,2021-05-12 10:56:18.721000,FM,8,13,mp-2567,,V3Si,"{'functional': 'PBE', 'labels': ['V_pv', 'Si'], 'pot_type': 'paw'}","{'V': 3.0, 'Si': 1.0}",GGA,mp-2567,"['mp-920081', 'mp-906309', 'mp-919083', 'mp-2567', 'mp-1078474', 'mp-1078852', 'mp-1138781', 'mp-1145907', 'mp-1440678', 'mp-1668672', 'mp-1795955', 'mp-1593554', 'mp-1596575']",0.8382519,"{'V': 6.0, 'Si': 2.0}",103.98086881866836,[],FM,True,131,1,"[0.2, 0.3, 0.3, 0.2, 0.3, 0.3, 0.0, 0.0]",0.0161231947669493,0.8382519,6,1.6765038,MP,data/source/MP/cleaned/cifs/MP-mp-2567.cif,True,,data/final/MP/graphs/Ga0.2Si0.8V3-MP-mp-2567-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Fe4P12Sm1,1,0.0,1.0,True,Fe4P12Sm1,Fe4P12Sm1,0.0,Ferrite,True,Fe23.529P70.588Sm5.882,Fe-P-Sm,3,Supercon,Sm1Fe4P12,MP-mp-1105927,Sm1Fe4P12,Fe-P-Sm,Fe23.529P70.588Sm5.882,I m -3,cubic,6.751295021496657,6.75129502,6.75129502,data/final/MP/cifs/Fe4P12Sm1-MP-mp-1105927.cif,data/source/MP/raw/cifs/mp-1105927.cif,mp-1105927,0.0,,2018-07-19 06:55:20,5.225330519048742,,,,0.0,8.01272665,520.0,-113.67470095,-6.686747114705883,"{'tags': ['LaFe4P12', 'Samarium iron phosphide (1/4/12)', 'SmFe4P12']}",-113.67470095,-6.686747114705883,-0.5950853491176472,[],False,[633097],True,2021-05-12 10:59:33.162000,NM,17,3,mp-1105927,,Sm(FeP3)4,"{'functional': 'PBE', 'labels': ['Sm_3', 'Fe_pv', 'P'], 'pot_type': 'paw'}","{'Sm': 1.0, 'Fe': 4.0, 'P': 12.0}",GGA,mp-1105927,"['mp-1105927', 'mp-1923864', 'mp-1983439']",0.0006698,"{'Sm': 1.0, 'Fe': 4.0, 'P': 12.0}",236.88598612576763,[],NM,False,204,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.8275205762673923e-06,0.0006698,0,0.0006698,MP,data/source/MP/cleaned/cifs/MP-mp-1105927.cif,False,,data/final/MP/graphs/Fe4P12Sm1-MP-mp-1105927.json,0,True,m-3,2,0,0,0,0,0,0,0,0,1,0,1.0,False
B2C1Co0.02Ni1.98Y1,2,0.0066666666666666,1.0,True,B2C1Co0.02Ni1.98Y1,B2C1Ni2Y1,14.3,Other,True,B33.333C16.667Co0.333Ni33Y16.667,B-C-Co-Ni-Y,5,Supercon,Y1Ni1.98Co0.02B2C1,MP-mp-6576,Y1Ni2B2C1,B-C-Ni-Y,B33.333C16.667Ni33.333Y16.667,I 4/m m m,tetragonal,3.548790000501972,3.548790000501972,5.76144136,data/final/MP/cifs/B2C1Co0.02Ni1.98Y1-MP-mp-6576-synth_doped.cif,data/source/MP/raw/cifs/mp-6576.cif,mp-6576,0.0,,2011-05-13 05:21:43,6.099730998852292,10.17188/1281366,"@misc{osti_1281366,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281366"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688230'}},0.0,6.81083016,520.0,-43.677878,-7.279646333333333,{'tags': []},-43.677878,-7.279646333333333,-0.5109282141666659,"['xas', 'bandstructure']",True,"[75816, 89142, 83231, 79574, 41549]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6576,,YNi2B2C,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6576,"['mp-6576', 'mp-1007054', 'mp-1000583', 'mp-1439516', 'mp-1688230', 'mp-1794280', 'mp-1011792', 'mp-1597064']",0.0006603,"{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.3152437079014,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",1.010943177297096e-05,0.0006603,0,0.0006603,MP,data/source/MP/cleaned/cifs/MP-mp-6576.cif,True,,data/final/MP/graphs/B2C1Co0.02Ni1.98Y1-MP-mp-6576-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Au5Sn1,1,0.0,1.0,True,Au5Sn1,Au5Sn1,0.9,Other,True,Au83.333Sn16.667,Au-Sn,2,Supercon,Au5Sn1,MP-mp-30418,Sn1Au5,Au-Sn,Au83.333Sn16.667,R 3 2,trigonal,5.203757115643156,5.203757115643156,5.73343065,data/final/MP/cifs/Au5Sn1-MP-mp-30418.cif,data/source/MP/raw/cifs/mp-30418.cif,mp-30418,0.0,,2014-02-19 17:52:25,16.001734212245303,10.17188/1204826,"@misc{osti_1204826,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SnAu5 (SG:155) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1204826"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671347'}},0.0147711583333327,6.08820296,520.0,-20.65893211,-3.4431553516666664,{'tags': ['Gold tin (5/1)']},-20.65893211,-3.4431553516666664,-0.0466587591666662,"['xas', 'elasticity', 'bandstructure']",True,[58589],True,2021-05-12 10:56:18.721000,NM,6,6,mp-30418,,SnAu5,"{'functional': 'PBE', 'labels': ['Sn_d', 'Au'], 'pot_type': 'paw'}","{'Sn': 1.0, 'Au': 5.0}",GGA,mp-30418,"['mp-30418', 'mp-1116205', 'mp-1429108', 'mp-1671347', 'mp-1804743', 'mp-1589526']",0.0015364,"{'Sn': 1.0, 'Au': 5.0}",114.51733802621897,[],NM,False,155,0,"[0, 0, 0, 0, 0, 0]",1.341630906272235e-05,0.0015364,0,0.0015364,MP,data/source/MP/cleaned/cifs/MP-mp-30418.cif,False,,data/final/MP/graphs/Au5Sn1-MP-mp-30418.json,0,True,32,0,0,0,0,0,0,4,1,0,0,0,1.0,False
Sn3Zr5,1,0.0,2.0,False,Sn6Zr10,Sn6Zr10,1.9,Other,True,Sn37.5Zr62.5,Sn-Zr,2,Supercon,Sn3Zr5,MP-mp-510522,Zr10Sn6,Sn-Zr,Sn37.5Zr62.5,P 63/m c m,hexagonal,5.812388,8.551318004282107,8.55131833,data/final/MP/cifs/Sn3Zr5-MP-mp-510522.cif,data/source/MP/raw/cifs/mp-510522.cif,mp-510522,0.0,,2014-02-25 20:19:53,7.328539753430372,10.17188/1262983,"@misc{osti_1262983,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Zr5Sn3 (SG:193) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1262983"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1705683'}},0.0,6.42840038,520.0,-118.57503319,-7.410939574375,"{'tags': ['Zirconium stannide (5/3)', 'Zirconium tin (5/3)']}",-118.57503319,-7.410939574375,-0.5650372350000001,"['xas', 'bandstructure']",True,"[150562, 652854, 656306]",True,2021-05-12 10:57:10.838000,NM,16,9,mp-510522,,Zr5Sn3,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Sn_d'], 'pot_type': 'paw'}","{'Zr': 5.0, 'Sn': 3.0}",GGA,mp-510522,"['mp-914522', 'mp-977912', 'mp-510522', 'mp-1189888', 'mp-1415063', 'mp-1705683', 'mp-1838490', 'mp-978172', 'mp-1603148']",8.065e-05,"{'Zr': 10.0, 'Sn': 6.0}",368.0877506912645,[],NM,False,193,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.382107247445221e-07,8.065e-05,0,0.0001613,MP,data/source/MP/cleaned/cifs/MP-mp-510522.cif,False,,data/final/MP/graphs/Sn3Zr5-MP-mp-510522.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Ca0.8Cu2Tl1Y0.2O7,3,0.0307692307692307,1.0,True,Ba2Ca0.8Cu2Tl1Y0.2O7,Ba2Ca1Cu2Tl1O7,97.6,Cuprate,True,Ba15.385Ca6.154Cu15.385Tl7.692Y1.538O53.84615384615385,Ba-Ca-Cu-Tl-Y-O,6,Supercon,Tl1Ba2Ca0.8Y0.2Cu2O7,MP-mp-632802,Ba2Ca1Tl1Cu2O7,Ba-Ca-Cu-Tl-O,Ba15.385Ca7.692Cu15.385Tl7.692O53.84615384615385,P 4/m m m,tetragonal,3.840502,3.840502,13.048748,data/final/MP/cifs/Ba2Ca0.8Cu2Tl1Y0.2O7-MP-mp-632802-synth_doped.cif,data/source/MP/raw/cifs/mp-632802.cif,mp-632802,0.0,,2013-06-21 12:28:47,6.541687864051921,10.17188/1279349,"@misc{osti_1279349,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2CaTlCu2O7 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1279349"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1742071'}},0.0444125982158123,2.89241018,520.0,-71.95529719,-5.535022860769231,{'tags': ['Thallium(III) calcium barium copper oxide (1/1/2/2/7)']},-71.95529719,-5.535022860769231,-1.978767086794871,"['xas', 'bandstructure']",True,[67128],True,2021-05-12 10:57:30.779000,NM,13,10,mp-632802,oxide,Ba2CaTlCu2O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ca_sv', 'Tl_d', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Ca': 1.0, 'Tl': 1.0, 'Cu': 2.0, 'O': 7.0}",GGA,mp-632802,"['mp-699409', 'mp-632802', 'mp-732256', 'mp-743134', 'mp-1182322', 'mp-1394572', 'mp-1742071', 'mp-1785618', 'mp-1654627', 'mp-749845']",0.0282595,"{'Ba': 2.0, 'Ca': 1.0, 'Tl': 1.0, 'Cu': 2.0, 'O': 7.0}",192.461929418226,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.000146831636186,0.0282595,0,0.0282595,MP,data/source/MP/cleaned/cifs/MP-mp-632802.cif,True,,data/final/MP/graphs/Ba2Ca0.8Cu2Tl1Y0.2O7-MP-mp-632802-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Cu0.975La2Li0.025O4,2,0.0071428571428571,1.0,True,Cu0.975La2Li0.025O4,Cu1La2O4,0.0,Cuprate,True,Cu13.929La28.571Li0.357O57.142857142857146,Cu-La-Li-O,4,Supercon,La2Cu0.975Li0.025O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu0.975La2Li0.025O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu0.975La2Li0.025O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ba2Ca0.2Fe3Y0.8O8,3,0.0285714285714285,1.0,True,Ba2Ca0.2Fe3Y0.8O8,Ba2Fe3Y1O8,0.0,Oxide,True,Ba14.286Ca1.429Fe21.429Y5.714O57.142857142857146,Ba-Ca-Fe-Y-O,5,Supercon,Y0.8Ca0.2Ba2Fe3O8,MP-mp-558860,Ba2Y1Fe3O8,Ba-Fe-Y-O,Ba14.286Fe21.429Y7.143O57.142857142857146,P 4/m m m,tetragonal,3.968543,3.968543,12.092968,data/final/MP/cifs/Ba2Ca0.2Fe3Y0.8O8-MP-mp-558860-synth_doped.cif,data/source/MP/raw/cifs/mp-558860.cif,mp-558860,0.0,,2014-02-12 22:16:53,5.746438570617371,,,{'GGA+U': {'task_id': 'mp-1704046'}},0.0172626554017947,3.91710739,520.0,-97.88037802,-6.991455572857142,{'tags': ['Yttrium dibarium triiron(III) oxide']},-97.88037802,-6.991455572857142,-2.489017989761904,"['xas', 'bandstructure']",True,[67711],True,2021-05-12 10:57:59.523000,FM,14,7,mp-558860,oxide,Ba2YFe3O8,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Fe_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Fe': 3.0, 'O': 8.0}",GGA+U,mp-558860,"['mvc-12906', 'mp-565449', 'mp-558860', 'mp-1416018', 'mp-1704046', 'mp-1786355', 'mp-1597604']",14.9671738,"{'Ba': 2.0, 'Y': 1.0, 'Fe': 3.0, 'O': 8.0}",190.4561865549996,[],FM,True,47,5,"[0.0, 0.0, 0.0, 4.3, 4.4, 4.3, 0.0, 0.0, 0.3, 0.3, 0.0, 0.0, 0.3, 0.0]",0.0785859155889263,14.9671738,6,14.9671738,MP,data/source/MP/cleaned/cifs/MP-mp-558860.cif,True,,data/final/MP/graphs/Ba2Ca0.2Fe3Y0.8O8-MP-mp-558860-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
C1Mo0.5Ta0.5,1,0.0,2.0,False,C2Mo1Ta1,C2Mo1Ta1,7.7,Other,True,C50Mo25Ta25,C-Mo-Ta,3,Supercon,C1Mo0.5Ta0.5,MP-mp-1217919,Ta1Mo1C2,C-Mo-Ta,C50Mo25Ta25,R -3 m,trigonal,3.144835892169353,3.144835892169353,5.38817367,data/final/MP/cifs/C1Mo0.5Ta0.5-MP-mp-1217919.cif,data/source/MP/raw/cifs/mp-1217919.cif,mp-1217919,0.0,,2019-01-12 19:10:31.332000,11.499783499146304,,,{'GGA': {'task_id': 'mp-1766664'}},0.1494032275000005,9.116434,520.0,-41.88168601,-10.4704215025,{'tags': []},-41.88168601,-10.4704215025,-0.1811759874999996,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,4,5,mp-1217919,,TaMoC2,"{'functional': 'PBE', 'labels': ['Ta_pv', 'Mo_pv', 'C'], 'pot_type': 'paw'}","{'Ta': 1.0, 'Mo': 1.0, 'C': 2.0}",GGA,mp-1217919,"['mp-1217919', 'mp-1430516', 'mp-1766664', 'mp-1794431', 'mp-1610780']",0.0004872,"{'Ta': 1.0, 'Mo': 1.0, 'C': 2.0}",43.45052365373413,[],NM,False,166,0,"[0, 0, 0, 0]",1.1212753242805398e-05,0.0004872,0,0.0004872,MP,data/source/MP/cleaned/cifs/MP-mp-1217919.cif,False,,data/final/MP/graphs/C1Mo0.5Ta0.5-MP-mp-1217919.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Si2Th1,1,0.0,1.0,True,Si2Th1,Si2Th1,2.862,Other,True,Si66.667Th33.333,Si-Th,2,Supercon,Si2Th1,MP-mp-7497,Th1Si2,Si-Th,Si66.667Th33.333,P 6/m m m,hexagonal,4.124678003560693,4.12467893,4.168382,data/final/MP/cifs/Si2Th1-MP-mp-7497.cif,data/source/MP/raw/cifs/mp-7497.cif,mp-7497,0.0,,2011-05-27 17:09:08,7.792527656352213,10.17188/1288497,"@misc{osti_1288497,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ThSi2 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1288497"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688045'}},0.0,8.78875238,520.0,-20.12426593,-6.708088643333333,"{'tags': ['Thorium silicide (1/2)', 'Thorium silicide (1/2) - beta']}",-20.12426593,-6.708088643333333,-0.5725932133333332,"['bandstructure', 'elasticity']",True,"[15449, 26569]",True,2021-05-12 10:56:29.056000,NM,3,11,mp-7497,,ThSi2,"{'functional': 'PBE', 'labels': ['Th', 'Si'], 'pot_type': 'paw'}","{'Th': 1.0, 'Si': 2.0}",GGA,mp-7497,"['mp-908777', 'mp-924352', 'mp-923780', 'mp-7497', 'mp-1125064', 'mp-1138240', 'mp-1248167', 'mp-1439624', 'mp-1688045', 'mp-1783814', 'mp-1593505']",0.0013608,"{'Th': 1.0, 'Si': 2.0}",61.41555405169961,[],NM,False,191,0,"[0, 0, 0]",2.2157253500546107e-05,0.0013608,0,0.0013608,MP,data/source/MP/cleaned/cifs/MP-mp-7497.cif,False,,data/final/MP/graphs/Si2Th1-MP-mp-7497.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
B2C1Gd0.15Ni2Y0.85,2,0.05,1.0,True,B2C1Gd0.15Ni2Y0.85,B2C1Ni2Y1,9.95,Other,True,B33.333C16.667Gd2.5Ni33.333Y14.167,B-C-Gd-Ni-Y,5,Supercon,Y0.85Gd0.15Ni2B2C1,MP-mp-6576,Y1Ni2B2C1,B-C-Ni-Y,B33.333C16.667Ni33.333Y16.667,I 4/m m m,tetragonal,3.548790000501972,3.548790000501972,5.76144136,data/final/MP/cifs/B2C1Gd0.15Ni2Y0.85-MP-mp-6576-synth_doped.cif,data/source/MP/raw/cifs/mp-6576.cif,mp-6576,0.0,,2011-05-13 05:21:43,6.099730998852292,10.17188/1281366,"@misc{osti_1281366,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281366"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688230'}},0.0,6.81083016,520.0,-43.677878,-7.279646333333333,{'tags': []},-43.677878,-7.279646333333333,-0.5109282141666659,"['xas', 'bandstructure']",True,"[75816, 89142, 83231, 79574, 41549]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6576,,YNi2B2C,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6576,"['mp-6576', 'mp-1007054', 'mp-1000583', 'mp-1439516', 'mp-1688230', 'mp-1794280', 'mp-1011792', 'mp-1597064']",0.0006603,"{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.3152437079014,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",1.010943177297096e-05,0.0006603,0,0.0006603,MP,data/source/MP/cleaned/cifs/MP-mp-6576.cif,True,,data/final/MP/graphs/B2C1Gd0.15Ni2Y0.85-MP-mp-6576-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As1Fe1Nd0.9Sr0.1O1,2,0.0499999999999999,2.0,False,As2Fe2Nd1.8Sr0.2O2,As2Fe2Nd2O2,0.0,Ferrite,True,As25Fe25Nd22.5Sr2.5O25,As-Fe-Nd-Sr-O,5,Supercon,Nd0.9Sr0.1Fe1As1O1,MP-mp-622621,Nd2Fe2As2O2,As-Fe-Nd-O,As25Fe25Nd25O25,P 4/n m m,tetragonal,4.074653,4.074653,9.170967,data/final/MP/cifs/As1Fe1Nd0.9Sr0.1O1-MP-mp-622621-synth_doped.cif,data/source/MP/raw/cifs/mp-622621.cif,mp-622621,0.0,,2014-02-16 22:28:25,6.347279619112142,10.17188/1278150,"@misc{osti_1278150,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NdFeAsO (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278150"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-1677677'}},0.2809314202083302,3.74777613,520.0,-52.70842543,-6.58855317875,{'tags': ['Neodymium iron arsenic oxide (1/1/1/1)']},-52.70842543,-6.58855317875,-1.61299541125,"['xas', 'bandstructure']",True,"[163547, 164679, 422001, 163546, 236651, 236650, 602466, 164680, 164676]",True,2021-05-12 10:57:28.836000,FM,8,8,mp-622621,oxide,NdFeAsO,"{'functional': 'PBE', 'labels': ['Nd_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Nd': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-622621,"['mp-622621', 'mp-1079381', 'mp-1173401', 'mp-1438697', 'mp-1677677', 'mp-1772072', 'mp-1926310', 'mp-1592869']",3.83954265,"{'Nd': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",152.26370404041757,[],FM,True,129,1,"[0.0, 0.0, 3.6, 3.6, -0.0, -0.0, -0.0, -0.0]",0.0504328024094411,3.83954265,2,7.6790853,MP,data/source/MP/cleaned/cifs/MP-mp-622621.cif,True,,data/final/MP/graphs/As1Fe1Nd0.9Sr0.1O1-MP-mp-622621-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Be2Mn1,1,0.0,4.0,False,Be8Mn4,Be8Mn4,0.0,Other,True,Be66.667Mn33.333,Be-Mn,2,Supercon,Be2Mn1,MP-mp-11270,Mn4Be8,Be-Mn,Be66.667Mn33.333,P 63/m m c,hexagonal,4.144466002184116,4.14446614,6.759455,data/final/MP/cifs/Be2Mn1-MP-mp-11270.cif,data/source/MP/raw/cifs/mp-11270.cif,mp-11270,0.0,,2011-05-29 16:54:55,4.81979713360536,10.17188/1187692,"@misc{osti_1187692,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MnBe2 (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187692"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703310'}},0.0,5.39203058,520.0,-69.5669912,-5.797249266666667,{'tags': ['Beryllium manganese (2/1)']},-69.5669912,-5.797249266666667,-0.2503022593103452,"['xas', 'elasticity', 'bandstructure']",True,[58714],True,2021-05-12 10:56:10.715000,FM,12,8,mp-11270,,MnBe2,"{'functional': 'PBE', 'labels': ['Mn_pv', 'Be_sv'], 'pot_type': 'paw'}","{'Mn': 1.0, 'Be': 2.0}",GGA,mp-11270,"['mp-11270', 'mp-912118', 'mp-928250', 'mp-928726', 'mp-1416584', 'mp-1703310', 'mp-1796504', 'mp-1601071']",0.283662125,"{'Mn': 4.0, 'Be': 8.0}",100.54940254061545,[],FM,True,194,1,"[0.3, 0.3, 0.3, 0.3, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0112844877376737,0.283662125,4,1.1346485,MP,data/source/MP/cleaned/cifs/MP-mp-11270.cif,False,,data/final/MP/graphs/Be2Mn1-MP-mp-11270.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ca1Tl3,1,0.0,1.0,True,Ca1Tl3,Ca1Tl3,2.04,Other,True,Ca25Tl75,Ca-Tl,2,Supercon,Ca1Tl3,MP-mp-526,Ca1Tl3,Ca-Tl,Ca25Tl75,P m -3 m,cubic,4.896214,4.896214,4.896214,data/final/MP/cifs/Ca1Tl3-MP-mp-526.cif,data/source/MP/raw/cifs/mp-526.cif,mp-526,0.0,,2011-05-13 02:36:41,9.241291063086052,10.17188/1263168,"@misc{osti_1263168,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CaTl3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1263168"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695745'}},0.0,5.68054959,520.0,-10.08040719,-2.5201017975,{'tags': ['Calcium thallium (1/3)']},-10.08040719,-2.5201017975,-0.2467194675000001,"['xas', 'bandstructure']",True,"[58942, 619625]",True,2021-05-12 10:57:10.838000,NM,4,8,mp-526,,CaTl3,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Tl_d'], 'pot_type': 'paw'}","{'Ca': 1.0, 'Tl': 3.0}",GGA,mp-526,"['mp-991404', 'mp-993354', 'mp-526', 'mp-1476017', 'mp-1695745', 'mp-1803629', 'mp-994607', 'mp-1596916']",0.0014932,"{'Ca': 1.0, 'Tl': 3.0}",117.37650507253343,[],NM,False,221,0,"[0, 0, 0, 0]",1.2721455619054846e-05,0.0014932,0,0.0014932,MP,data/source/MP/cleaned/cifs/MP-mp-526.cif,False,,data/final/MP/graphs/Ca1Tl3-MP-mp-526.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Be13Th0.026U0.974,2,0.0037142857142857,2.0,False,Be26Th0.052U1.948,Be26U2,0.58,Heavy_fermion,True,Be92.857Th0.186U6.957,Be-Th-U,3,Supercon,U0.974Th0.026Be13,MP-mp-1163,U2Be26,Be-U,Be92.857U7.143,F m -3 c,cubic,7.174675929999999,7.174675929999999,7.174675929999999,data/final/MP/cifs/Be13Th0.026U0.974-MP-mp-1163-synth_doped.cif,data/source/MP/raw/cifs/mp-1163.cif,mp-1163,0.0,,2011-05-15 13:39:09,4.516943134220159,10.17188/1188115,"@misc{osti_1188115,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UBe13 (SG:226) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188115"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1676276'}},0.0,5.60901004,520.0,-121.44122023,-4.337186436785714,"{'tags': ['Uranium beryllium (1/13)', 'Beryllium uranium (13/1)']}",-121.44122023,-4.337186436785714,-0.0583452042857146,"['xas', 'bandstructure']",True,"[616470, 58748, 616481, 58747, 58749, 659562, 107528, 600563, 58750, 616488, 58751]",True,2021-05-12 10:56:51.169000,NM,28,8,mp-1163,,UBe13,"{'functional': 'PBE', 'labels': ['U', 'Be_sv'], 'pot_type': 'paw'}","{'U': 1.0, 'Be': 13.0}",GGA,mp-1163,"['mp-1163', 'mp-906858', 'mp-920459', 'mp-921486', 'mp-1381018', 'mp-1676276', 'mp-1775695', 'mp-1603627']",0.0460573,"{'U': 2.0, 'Be': 26.0}",261.15110606061,[],NM,False,226,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0003527252914587,0.0460573,0,0.0921146,MP,data/source/MP/cleaned/cifs/MP-mp-1163.cif,True,,data/final/MP/graphs/Be13Th0.026U0.974-MP-mp-1163-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
B2C1Ho0.9La0.1Ni2,2,0.0333333333333333,1.0,True,B2C1Ho0.9La0.1Ni2,B2C1Ho1Ni2,2.25,Other,True,B33.333C16.667Ho15La1.667Ni33.333,B-C-Ho-La-Ni,5,Supercon,Ho0.9La0.1Ni2B2C1,MP-mp-6646,Ho1Ni2B2C1,B-C-Ho-Ni,B33.333C16.667Ho16.667Ni33.333,I 4/m m m,tetragonal,3.529863997734658,3.529863997734658,5.76032203,data/final/MP/cifs/B2C1Ho0.9La0.1Ni2-MP-mp-6646-synth_doped.cif,data/source/MP/raw/cifs/mp-6646.cif,mp-6646,0.0,,2011-05-13 04:24:09,8.11075125231065,10.17188/1281460,"@misc{osti_1281460,
    author = ""Persson, Kristin"",
    title = ""Materials Data on HoNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281460"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1670774'}},0.0,6.70981387,520.0,-41.84364575,-6.973940958333333,{'tags': ['Holmium dinickel diboride carbide']},-41.84364575,-6.973940958333333,-0.5192332130555558,"['xas', 'elasticity', 'bandstructure']",True,"[79064, 56650, 79065, 79062, 79063, 79575]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-6646,,HoNi2B2C,"{'functional': 'PBE', 'labels': ['Ho_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Ho': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6646,"['mp-1007146', 'mp-6646', 'mp-1000682', 'mp-1439301', 'mp-1670774', 'mp-1782657', 'mp-1011887', 'mp-1589032']",0.0032459,"{'Ho': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",64.68537905730652,[],NM,False,139,0,"[0.0, -0.0, -0.0, 0.0, 0.0, 0.0]",5.017980952271099e-05,0.0032459,0,0.0032459,MP,data/source/MP/cleaned/cifs/MP-mp-6646.cif,True,,data/final/MP/graphs/B2C1Ho0.9La0.1Ni2-MP-mp-6646-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Si2U3,1,0.0,2.0,False,Si4U6,Si4U6,0.0,Heavy_fermion,True,Si40U60,Si-U,2,Supercon,Si2U3,MP-mp-21346,U6Si4,Si-U,Si40U60,P 4/m b m,tetragonal,3.904952,7.238981,7.238981,data/final/MP/cifs/Si2U3-MP-mp-21346.cif,data/source/MP/raw/cifs/mp-21346.cif,mp-21346,0.0,,2014-02-22 11:57:01,12.50099510704088,10.17188/1196794,"@misc{osti_1196794,
    author = ""Persson, Kristin"",
    title = ""Materials Data on U3Si2 (SG:127) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196794"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696185'}},0.151176758750001,11.27793312,520.0,-90.77331041,-9.077331041,{'tags': ['Uranium silicide (3/2)']},-90.77331041,-9.077331041,-0.1039594269999995,"['xas', 'bandstructure']",True,"[657098, 31648, 31626, 652479, 69200, 73695]",True,2021-05-12 10:56:59.077000,NM,10,9,mp-21346,,U3Si2,"{'functional': 'PBE', 'labels': ['U', 'Si'], 'pot_type': 'paw'}","{'U': 3.0, 'Si': 2.0}",GGA,mp-21346,"['mp-922694', 'mp-923488', 'mp-908308', 'mp-21346', 'mp-1427824', 'mp-1659995', 'mp-1696185', 'mp-1833648', 'mp-1589211']",0.05074315,"{'U': 6.0, 'Si': 4.0}",204.6305979745956,[],NM,False,127,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0004959488024005,0.05074315,0,0.1014863,MP,data/source/MP/cleaned/cifs/MP-mp-21346.cif,False,,data/final/MP/graphs/Si2U3-MP-mp-21346.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B2Rh2Sr1,1,0.0,2.0,False,B4Rh4Sr2,B4Rh4Sr2,0.0,Other,True,B40Rh40Sr20,B-Rh-Sr,3,Supercon,Sr1Rh2B2,MP-mp-7348,Sr2B4Rh4,B-Rh-Sr,B40Rh40Sr20,F d d d,orthorhombic,5.623131182948732,5.62313119,6.163746099999999,data/final/MP/cifs/B2Rh2Sr1-MP-mp-7348.cif,data/source/MP/raw/cifs/mp-7348.cif,mp-7348,0.0,,2011-05-30 06:33:24,6.787663169664353,10.17188/1287776,"@misc{osti_1287776,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr(BRh)2 (SG:70) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1287776"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702666'}},0.0,4.99655136,520.0,-65.0544407,-6.50544407,{'tags': ['Strontium rhodium boride (1/2/2)']},-65.0544407,-6.50544407,-0.5500655229999992,['bandstructure'],True,[8153],True,2021-05-12 10:58:55.498000,NM,10,8,mp-7348,,Sr(BRh)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'B', 'Rh_pv'], 'pot_type': 'paw'}","{'Sr': 1.0, 'B': 2.0, 'Rh': 2.0}",GGA,mp-7348,"['mp-932330', 'mp-7348', 'mp-915739', 'mp-931342', 'mp-1418062', 'mp-1702666', 'mp-1787140', 'mp-1600418']",0.0026828,"{'Sr': 2.0, 'B': 4.0, 'Rh': 4.0}",154.14960980610937,[],NM,False,70,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.480774298909284e-05,0.0026828,0,0.0053656,MP,data/source/MP/cleaned/cifs/MP-mp-7348.cif,False,,data/final/MP/graphs/B2Rh2Sr1-MP-mp-7348.json,0,True,mmm,0,0,0,7,0,0,0,0,0,0,1,1.0,False
Bi0.57Sn0.43,3,0.1399999999999999,2.0,False,Bi1.14Sn0.86,Bi1Sn1,2.25,Other,True,Bi57Sn43,Bi-Sn,2,Supercon,Bi0.57Sn0.43,MP-mp-1218964,Sn1Bi1,Bi-Sn,Bi50Sn50,I -4 m 2,tetragonal,3.291755997109369,4.685661350715597,4.68566135,data/final/MP/cifs/Bi0.57Sn0.43-MP-mp-1218964-synth_doped.cif,data/source/MP/raw/cifs/mp-1218964.cif,mp-1218964,0.0,,2019-01-12 20:02:49.690000,8.588814778093932,,,{'GGA': {'task_id': 'mp-1765162'}},0.0565166274999997,6.29400761,520.0,-7.78657291,-3.893286455,{'tags': []},-7.78657291,-3.893286455,0.0565166274999997,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,2,5,mp-1218964,,SnBi,"{'functional': 'PBE', 'labels': ['Sn_d', 'Bi'], 'pot_type': 'paw'}","{'Sn': 1.0, 'Bi': 1.0}",GGA,mp-1218964,"['mp-1218964', 'mp-1414409', 'mp-1765162', 'mp-1793882', 'mp-1610233']",0.001124,"{'Sn': 1.0, 'Bi': 1.0}",63.354807969271306,[],NM,False,119,0,"[0, 0]",1.7741352803802494e-05,0.001124,0,0.001124,MP,data/source/MP/cleaned/cifs/MP-mp-1218964.cif,True,,data/final/MP/graphs/Bi0.57Sn0.43-MP-mp-1218964-synth_doped.json,0,True,-42m,0,0,0,0,6,0,0,0,0,1,0,1.0,False
Ag1Cl2,3,0.1333333333333334,3.0,False,Ag3Cl6,Ag4Cl6,0.0,Other,True,Ag33.333Cl66.667,Ag-Cl,2,Supercon,Ag1Cl2,MP-mp-864635,Ag4Cl6,Ag-Cl,Ag40Cl60,R -3 c,trigonal,6.702904730474917,6.702904730474918,7.22932503,data/final/MP/cifs/Ag1Cl2-MP-mp-864635-synth_doped.cif,data/source/MP/raw/cifs/mp-864635.cif,mp-864635,0.0,,2014-08-29 17:57:43,4.502245347141671,10.17188/1310069,"@misc{osti_1310069,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ag2Cl3 (SG:167) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1310069"",
    place = ""United States"",
    year = ""2016"",
    month = ""8"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1741398'}},0.0,0.68681867,520.0,-26.21140508,-2.621140508,{'tags': []},-26.21140508,-2.621140508,-0.7473961106666668,"['xas', 'bandstructure']",True,[],True,2021-05-12 10:57:53.781000,NM,10,11,mp-864635,,Ag2Cl3,"{'functional': 'PBE', 'labels': ['Ag', 'Cl'], 'pot_type': 'paw'}","{'Ag': 2.0, 'Cl': 3.0}",GGA,mp-864635,"['mp-864635', 'mp-1002925', 'mp-1004516', 'mp-1051369', 'mp-1051334', 'mp-1396004', 'mp-1741398', 'mp-1775885', 'mp-1654648', 'mp-1010204', 'mp-1051367']",0.76980175,"{'Ag': 4.0, 'Cl': 6.0}",237.5934466617701,[],NM,False,167,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0064799914376078,0.76980175,0,1.5396035,MP,data/source/MP/cleaned/cifs/MP-mp-864635.cif,True,,data/final/MP/graphs/Ag1Cl2-MP-mp-864635-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
B2C1Dy0.9Lu0.1Ni2,2,0.0333333333333333,1.0,True,B2C1Dy0.9Lu0.1Ni2,B2C1Dy1Ni2,2.485,Other,True,B33.333C16.667Dy15Lu1.667Ni33.333,B-C-Dy-Lu-Ni,5,Supercon,Lu0.1Dy0.9Ni2B2C1,MP-mp-6223,Dy1Ni2B2C1,B-C-Dy-Ni,B33.333C16.667Dy16.667Ni33.333,I 4/m m m,tetragonal,3.5485979995620824,3.548597999562083,5.74460959,data/final/MP/cifs/B2C1Dy0.9Lu0.1Ni2-MP-mp-6223-synth_doped.cif,data/source/MP/raw/cifs/mp-6223.cif,mp-6223,0.0,,2011-05-13 04:15:09,8.00036369104547,10.17188/1278123,"@misc{osti_1278123,
    author = ""Persson, Kristin"",
    title = ""Materials Data on DyNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278123"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687390'}},0.0,6.75219219,520.0,-41.84976027,-6.974960045,{'tags': []},-41.84976027,-6.974960045,-0.5161893047222215,"['xas', 'elasticity', 'bandstructure']",True,"[56596, 56593, 56595, 79573, 56649, 56594]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-6223,,DyNi2B2C,"{'functional': 'PBE', 'labels': ['Dy_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Dy': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6223,"['mp-1007344', 'mp-1000899', 'mp-6223', 'mp-1439353', 'mp-1687390', 'mp-1795426', 'mp-1012086', 'mp-1593735']",0.004911,"{'Dy': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.07346390684725,[],NM,False,139,0,"[0.0, -0.0, -0.0, 0.0, 0.0, 0.0]",7.546855054512086e-05,0.004911,0,0.004911,MP,data/source/MP/cleaned/cifs/MP-mp-6223.cif,True,,data/final/MP/graphs/B2C1Dy0.9Lu0.1Ni2-MP-mp-6223-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
In3Yb1,1,0.0,1.0,True,In3Yb1,In3Yb1,0.0,Heavy_fermion,True,In75Yb25,In-Yb,2,Supercon,In3Yb1,MP-mp-20469,Yb1In3,In-Yb,In75Yb25,P m -3 m,cubic,4.687176,4.687176,4.687176,data/final/MP/cifs/In3Yb1-MP-mp-20469.cif,data/source/MP/raw/cifs/mp-20469.cif,mp-20469,0.0,,2014-02-21 07:05:20,8.344890310707601,10.17188/1195598,"@misc{osti_1195598,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YbIn3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195598"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686429'}},0.0,6.35470916,520.0,-11.17913381,-2.7947834525,{'tags': ['Indium ytterbium (3/1)']},-11.17913381,-2.7947834525,-0.3461185850000001,"['xas', 'elasticity', 'bandstructure']",True,"[640704, 640708, 59574, 640701, 640713, 640714, 59573, 640705]",True,2021-05-12 10:56:14.760000,NM,4,8,mp-20469,,YbIn3,"{'functional': 'PBE', 'labels': ['Yb_2', 'In_d'], 'pot_type': 'paw'}","{'Yb': 1.0, 'In': 3.0}",GGA,mp-20469,"['mp-991697', 'mp-993604', 'mp-20469', 'mp-1440259', 'mp-1686429', 'mp-1795795', 'mp-994914', 'mp-1597054']",0.000676,"{'Yb': 1.0, 'In': 3.0}",102.975470226191,[],NM,False,221,0,"[0, 0, 0, 0]",6.564670192960816e-06,0.000676,0,0.000676,MP,data/source/MP/cleaned/cifs/MP-mp-20469.cif,False,,data/final/MP/graphs/In3Yb1-MP-mp-20469.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ta1V2,1,0.0,2.0,False,Ta2V4,Ta2V4,2.133333333,Other,True,Ta33.333V66.667,Ta-V,2,Supercon,Ta1V2,MP-mp-567276,Ta2V4,Ta-V,Ta33.333V66.667,F d -3 m,cubic,5.038434219999999,5.038434219999999,5.038434219999999,data/final/MP/cifs/Ta1V2-MP-mp-567276.cif,data/source/MP/raw/cifs/mp-567276.cif,mp-567276,0.0,,2014-02-16 10:26:50,10.385660894850238,10.17188/1273782,"@misc{osti_1273782,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TaV2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1273782"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697376'}},0.0,5.4359729,520.0,-60.67684914,-10.11280819,{'tags': ['Tantalum vanadium (1/2)']},-60.67684914,-10.11280819,-0.1042782666666681,"['bandstructure', 'elasticity']",True,"[652928, 106121]",True,2021-05-12 10:56:22.739000,NM,6,10,mp-567276,,TaV2,"{'functional': 'PBE', 'labels': ['Ta_pv', 'V_pv'], 'pot_type': 'paw'}","{'Ta': 1.0, 'V': 2.0}",GGA,mp-567276,"['mp-932850', 'mp-943125', 'mp-942113', 'mp-567276', 'mp-1072953', 'mp-1076950', 'mp-1425583', 'mp-1697376', 'mp-1798094', 'mp-1591780']",0.04269025,"{'Ta': 2.0, 'V': 4.0}",90.44233780321768,[],NM,False,227,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0009440324307601,0.04269025,0,0.0853805,MP,data/source/MP/cleaned/cifs/MP-mp-567276.cif,False,,data/final/MP/graphs/Ta1V2-MP-mp-567276.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
B4Gd0.01Rh4Y0.99,2,0.0022222222222222,2.0,False,B8Gd0.02Rh8Y1.98,B8Rh8Y2,10.1,Other,True,B44.444Gd0.111Rh44.444Y11,B-Gd-Rh-Y,4,Supercon,Y0.99Gd0.01Rh4B4,MP-mp-5984,Y2B8Rh8,B-Rh-Y,B44.444Rh44.444Y11.111,P 42/n m c,tetragonal,5.347098,5.347098,7.470892,data/final/MP/cifs/B4Gd0.01Rh4Y0.99-MP-mp-5984-synth_doped.cif,data/source/MP/raw/cifs/mp-5984.cif,mp-5984,0.0,,2011-05-17 01:51:06,8.454483259902709,10.17188/1277215,"@misc{osti_1277215,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Y(BRh)4 (SG:137) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277215"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1705290'}},0.0126497084259256,6.88552514,520.0,-135.64692549,-7.535940305,"{'tags': ['Yttrium rhodium boride (1/4/4)', 'Rhodium yttrium boride (4/1/4)']}",-135.64692549,-7.535940305,-0.5757992298148148,"['xas', 'bandstructure']",True,"[44569, 615346, 602655, 87283]",True,2021-05-12 10:57:26.891000,NM,18,8,mp-5984,,Y(BRh)4,"{'functional': 'PBE', 'labels': ['Y_sv', 'B', 'Rh_pv'], 'pot_type': 'paw'}","{'Y': 1.0, 'B': 4.0, 'Rh': 4.0}",GGA,mp-5984,"['mp-910312', 'mp-5984', 'mp-926161', 'mp-925748', 'mp-1430442', 'mp-1705290', 'mp-1828135', 'mp-1604702']",0.00010715,"{'Y': 2.0, 'B': 8.0, 'Rh': 8.0}",213.60368753104515,[],NM,False,137,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.0032598335590702e-06,0.00010715,0,0.0002143,MP,data/source/MP/cleaned/cifs/MP-mp-5984.cif,True,,data/final/MP/graphs/B4Gd0.01Rh4Y0.99-MP-mp-5984-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B2C1Ni2Tb0.15Y0.85,2,0.05,1.0,True,B2C1Ni2Tb0.15Y0.85,B2C1Ni2Y1,12.54,Other,True,B33.333C16.667Ni33.333Tb2.5Y14.167,B-C-Ni-Tb-Y,5,Supercon,Y0.85Tb0.15Ni2B2C1,MP-mp-6576,Y1Ni2B2C1,B-C-Ni-Y,B33.333C16.667Ni33.333Y16.667,I 4/m m m,tetragonal,3.548790000501972,3.548790000501972,5.76144136,data/final/MP/cifs/B2C1Ni2Tb0.15Y0.85-MP-mp-6576-synth_doped.cif,data/source/MP/raw/cifs/mp-6576.cif,mp-6576,0.0,,2011-05-13 05:21:43,6.099730998852292,10.17188/1281366,"@misc{osti_1281366,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281366"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688230'}},0.0,6.81083016,520.0,-43.677878,-7.279646333333333,{'tags': []},-43.677878,-7.279646333333333,-0.5109282141666659,"['xas', 'bandstructure']",True,"[75816, 89142, 83231, 79574, 41549]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6576,,YNi2B2C,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6576,"['mp-6576', 'mp-1007054', 'mp-1000583', 'mp-1439516', 'mp-1688230', 'mp-1794280', 'mp-1011792', 'mp-1597064']",0.0006603,"{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.3152437079014,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",1.010943177297096e-05,0.0006603,0,0.0006603,MP,data/source/MP/cleaned/cifs/MP-mp-6576.cif,True,,data/final/MP/graphs/B2C1Ni2Tb0.15Y0.85-MP-mp-6576-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Bi0.5Sn0.5,1,0.0,2.0,False,Bi1Sn1,Bi1Sn1,2.8440000000000003,Other,True,Bi50Sn50,Bi-Sn,2,Supercon,Bi0.5Sn0.5,MP-mp-1218964,Sn1Bi1,Bi-Sn,Bi50Sn50,I -4 m 2,tetragonal,3.291755997109369,4.685661350715597,4.68566135,data/final/MP/cifs/Bi0.5Sn0.5-MP-mp-1218964.cif,data/source/MP/raw/cifs/mp-1218964.cif,mp-1218964,0.0,,2019-01-12 20:02:49.690000,8.588814778093932,,,{'GGA': {'task_id': 'mp-1765162'}},0.0565166274999997,6.29400761,520.0,-7.78657291,-3.893286455,{'tags': []},-7.78657291,-3.893286455,0.0565166274999997,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,2,5,mp-1218964,,SnBi,"{'functional': 'PBE', 'labels': ['Sn_d', 'Bi'], 'pot_type': 'paw'}","{'Sn': 1.0, 'Bi': 1.0}",GGA,mp-1218964,"['mp-1218964', 'mp-1414409', 'mp-1765162', 'mp-1793882', 'mp-1610233']",0.001124,"{'Sn': 1.0, 'Bi': 1.0}",63.354807969271306,[],NM,False,119,0,"[0, 0]",1.7741352803802494e-05,0.001124,0,0.001124,MP,data/source/MP/cleaned/cifs/MP-mp-1218964.cif,False,,data/final/MP/graphs/Bi0.5Sn0.5-MP-mp-1218964.json,0,True,-42m,0,0,0,0,6,0,0,0,0,1,0,1.0,False
Bi1La1Pt1,1,0.0,1.0,True,Bi1La1Pt1,Bi1La1Pt1,0.9,Other,True,Bi33.333La33.333Pt33.333,Bi-La-Pt,3,Supercon,La1Bi1Pt1,MP-mp-1018136,La1Bi1Pt1,Bi-La-Pt,Bi33.333La33.333Pt33.333,F -4 3 m,cubic,4.92778473,4.92778473,4.92778473,data/final/MP/cifs/Bi1La1Pt1-MP-mp-1018136.cif,data/source/MP/raw/cifs/mp-1018136.cif,mp-1018136,0.1677999999999997,,2017-04-07 03:02:10,10.655765226040756,10.17188/1350197,"@article{osti_1350197,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaBiPt (SG:216) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1350197"",
    place = ""United States"",
    year = ""2017"",
    month = ""4""
}
",{'GGA': {'task_id': 'mp-1764955'}},0.0,6.98674221,520.0,-18.03397527,-6.01132509,"{'tags': ['LaPtBi', 'MgAgAs', 'Lanthanum bismuth platinum (1/1/1)']}",-18.03397527,-6.01132509,-1.0456753816666666,"['bandstructure', 'elasticity']",True,[248481],True,2021-05-12 10:56:08.727000,NM,3,12,mp-1018136,,LaBiPt,"{'functional': 'PBE', 'labels': ['La', 'Bi', 'Pt'], 'pot_type': 'paw'}","{'La': 1.0, 'Bi': 1.0, 'Pt': 1.0}",GGA,mp-1018136,"['mp-1018314', 'mp-1018542', 'mp-1018136', 'mp-1018488', 'mp-1061914', 'mp-1061930', 'mp-1061951', 'mp-1413444', 'mp-1764955', 'mp-1801385', 'mp-1612335', 'mp-1061960']",0.0003809,"{'La': 1.0, 'Bi': 1.0, 'Pt': 1.0}",84.61360230782124,[],NM,False,216,0,"[0, 0, 0]",4.501640275452397e-06,0.0003809,0,0.0003809,MP,data/source/MP/cleaned/cifs/MP-mp-1018136.cif,False,,data/final/MP/graphs/Bi1La1Pt1-MP-mp-1018136.json,0,True,-43m,5,0,0,0,0,0,0,0,0,0,1,1.0,False
B4Dy1Ru4,1,0.0,4.0,False,B16Dy4Ru16,B16Dy4Ru16,0.0,Other,True,B44.444Dy11.111Ru44.444,B-Dy-Ru,3,Supercon,Dy1Ru4B4,MP-mp-1202990,Dy4B16Ru16,B-Dy-Ru,B44.444Dy11.111Ru44.444,I 41/a c d,tetragonal,7.495554003256957,7.495554003256958,9.209426990000004,data/final/MP/cifs/B4Dy1Ru4-MP-mp-1202990.cif,data/source/MP/raw/cifs/mp-1202990.cif,mp-1202990,0.0,,2019-01-12 06:55:44.905000,9.575759401152878,,,{'GGA': {'task_id': 'mp-1743168'}},0.0,6.91933107,520.0,-291.59813668,-8.099948241111111,{'tags': ['Dysprosium ruthenium boride (1/4/4)']},-291.59813668,-8.099948241111111,-0.4975135140740734,[],False,[613688],True,2021-05-12 11:00:12.709000,NM,36,4,mp-1202990,,Dy(BRu)4,"{'functional': 'PBE', 'labels': ['Dy_3', 'B', 'Ru_pv'], 'pot_type': 'paw'}","{'Dy': 1.0, 'B': 4.0, 'Ru': 4.0}",GGA,mp-1202990,"['mp-1202990', 'mp-1402740', 'mp-1743168', 'mp-1817502']",0.00020665,"{'Dy': 4.0, 'B': 16.0, 'Ru': 16.0}",423.1387365232428,[],NM,False,142,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.953496403548001e-06,0.00020665,0,0.0008266,MP,data/source/MP/cleaned/cifs/MP-mp-1202990.cif,False,,data/final/MP/graphs/B4Dy1Ru4-MP-mp-1202990.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Rh5Y1,1,0.0,1.0,True,Rh5Y1,Rh5Y1,0.56,Other,True,Rh83.333Y16.667,Rh-Y,2,Supercon,Rh5Y1,MP-mp-11565,Y1Rh5,Rh-Y,Rh83.333Y16.667,P 6/m m m,hexagonal,4.331052,5.253196001980134,5.25319584,data/final/MP/cifs/Rh5Y1-MP-mp-11565.cif,data/source/MP/raw/cifs/mp-11565.cif,mp-11565,0.0,,2011-05-29 22:57:06,9.680709422420192,10.17188/1188070,"@misc{osti_1188070,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YRh5 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188070"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697735'}},0.0831174688888882,5.26215561,520.0,-45.0414975,-7.50691625,{'tags': ['Rhodium yttrium (5/1) - HT']},-45.0414975,-7.50691625,-0.2922478394444437,"['xas', 'elasticity', 'bandstructure']",True,[105977],True,2021-05-12 10:56:12.755000,NM,6,8,mp-11565,,YRh5,"{'functional': 'PBE', 'labels': ['Y_sv', 'Rh_pv'], 'pot_type': 'paw'}","{'Y': 1.0, 'Rh': 5.0}",GGA,mp-11565,"['mp-929119', 'mp-912820', 'mp-929507', 'mp-11565', 'mp-1429372', 'mp-1697735', 'mp-1874182', 'mp-1595458']",0.0013079,"{'Y': 1.0, 'Rh': 5.0}",103.5073575748133,[],NM,False,191,0,"[0, 0, 0, 0, 0, 0]",1.2635816724957672e-05,0.0013079,0,0.0013079,MP,data/source/MP/cleaned/cifs/MP-mp-11565.cif,False,,data/final/MP/graphs/Rh5Y1-MP-mp-11565.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Cu3N1,1,0.0,1.0,True,Cu3N1,Cu3N1,0.0,Other,True,Cu75N25,Cu-N,2,Supercon,Cu3N1,MP-mp-1933,Cu3N1,Cu-N,Cu75N25,P m -3 m,cubic,3.814706,3.814706,3.814706,data/final/MP/cifs/Cu3N1-MP-mp-1933.cif,data/source/MP/raw/cifs/mp-1933.cif,mp-1933,0.9820000000000002,,2011-05-13 06:02:30,6.12162020371774,10.17188/1194250,"@misc{osti_1194250,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Cu3N (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1194250"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686873'}},0.1923030687499993,4.25422237,520.0,-19.50390266,-4.875975665,"{'tags': ['Copper nitride (3/1)', 'Copper nitride (3/1) - LP', 'High pressure experimental phase']}",-19.50390266,-4.875975665,0.1923030687499993,"['xas', 'elasticity', 'bandstructure']",True,"[167837, 245993, 40057, 245995, 245994, 180235, 246928, 25675, 167838, 167835, 40056, 53313, 167836, 245996]",True,2021-05-12 10:56:14.760000,NM,4,9,mp-1933,,Cu3N,"{'functional': 'PBE', 'labels': ['Cu_pv', 'N'], 'pot_type': 'paw'}","{'Cu': 3.0, 'N': 1.0}",GGA,mp-1933,"['mp-659427', 'mp-664895', 'mp-656281', 'mp-1933', 'mp-1440932', 'mp-1686873', 'mp-1790613', 'mp-1596452', 'mp-1591659']",0.000334,"{'Cu': 3.0, 'N': 1.0}",55.51153253778462,[],NM,False,221,0,"[0, 0, 0, 0]",6.016767772942653e-06,0.000334,0,0.000334,MP,data/source/MP/cleaned/cifs/MP-mp-1933.cif,False,,data/final/MP/graphs/Cu3N1-MP-mp-1933.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ca1Cu2Pb0.3Sr2Tl0.7O7,3,0.0461538461538461,1.0,True,Ca1Cu2Pb0.3Sr2Tl0.7O7,Ca1Cu2Sr2Tl1O7,31.0,Cuprate,True,Ca7.692Cu15.385Pb2.308Sr15.385Tl5.385O53.84615384615385,Ca-Cu-Pb-Sr-Tl-O,6,Supercon,Tl0.7Pb0.3Ca1Sr2Cu2O7,MP-mp-20824,Sr2Ca1Tl1Cu2O7,Ca-Cu-Sr-Tl-O,Ca7.692Cu15.385Sr15.385Tl7.692O53.84615384615385,P 4/m m m,tetragonal,3.781958,3.781958,12.290585,data/final/MP/cifs/Ca1Cu2Pb0.3Sr2Tl0.7O7-MP-mp-20824-synth_doped.cif,data/source/MP/raw/cifs/mp-20824.cif,mp-20824,0.0,,2014-02-22 14:11:23,6.222853038840967,10.17188/1196027,"@misc{osti_1196027,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr2CaTlCu2O7 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196027"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701359'}},0.0167020139423028,3.36479313,520.0,-72.36482639,-5.566525106923077,{'tags': ['Thallium(III) calcium distrontium dicopper oxide']},-72.36482639,-5.566525106923077,-2.04557354474359,"['xas', 'bandstructure']",True,[74165],True,2021-05-12 10:56:57.051000,NM,13,8,mp-20824,oxide,Sr2CaTlCu2O7,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Tl_d', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ca': 1.0, 'Tl': 1.0, 'Cu': 2.0, 'O': 7.0}",GGA,mp-20824,"['mp-993717', 'mp-992012', 'mp-20824', 'mp-1420602', 'mp-1701359', 'mp-1787898', 'mp-995037', 'mp-1599885']",0.0332603,"{'Sr': 2.0, 'Ca': 1.0, 'Tl': 1.0, 'Cu': 2.0, 'O': 7.0}",175.7947729718531,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0001891995958567,0.0332603,0,0.0332603,MP,data/source/MP/cleaned/cifs/MP-mp-20824.cif,True,,data/final/MP/graphs/Ca1Cu2Pb0.3Sr2Tl0.7O7-MP-mp-20824-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B2Ir3Lu1,1,0.0,1.0,True,B2Ir3Lu1,B2Ir3Lu1,0.0,Other,True,B33.333Ir50Lu16.667,B-Ir-Lu,3,Supercon,Lu1Ir3B2,MP-mp-1024990,Lu1B2Ir3,B-Ir-Lu,B33.333Ir50Lu16.667,P 6/m m m,hexagonal,3.145349,5.440270000557415,5.44026998,data/final/MP/cifs/B2Ir3Lu1-MP-mp-1024990.cif,data/source/MP/raw/cifs/mp-1024990.cif,mp-1024990,0.0,,2016-09-26 08:17:04,15.926598466068288,10.17188/1355213,"@article{osti_1355213,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LuB2Ir3 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1355213"",
    place = ""United States"",
    year = ""2017"",
    month = ""5""
}
",{'GGA': {'task_id': 'mp-1696968'}},0.0,7.72618169,520.0,-48.53130074,-8.088550123333333,"{'tags': ['ErIr3B2', 'Lutetium iridium boride (1/3/2)', 'LuIr3B2']}",-48.53130074,-8.088550123333333,-0.689379236388889,"['bandstructure', 'elasticity']",True,[614531],True,2021-05-12 10:56:10.715000,NM,6,5,mp-1024990,,LuB2Ir3,"{'functional': 'PBE', 'labels': ['Lu_3', 'B', 'Ir'], 'pot_type': 'paw'}","{'Lu': 1.0, 'B': 2.0, 'Ir': 3.0}",GGA,mp-1024990,"['mp-1024990', 'mp-1423508', 'mp-1696968', 'mp-1800427', 'mp-1592088']",0.0012939,"{'Lu': 1.0, 'B': 2.0, 'Ir': 3.0}",80.61955166342288,[],NM,False,191,0,"[0, 0, 0, 0, 0, 0]",1.6049456655401408e-05,0.0012939,0,0.0012939,MP,data/source/MP/cleaned/cifs/MP-mp-1024990.cif,False,,data/final/MP/graphs/B2Ir3Lu1-MP-mp-1024990.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Cu1La2O4.035,2,0.0042643923240938,0.9912752994630316,True,Cu0.991La1.983O4,Cu1La2O4,35.0,Cuprate,True,Cu14.215La28.429O57.356076759061835,Cu-La-O,3,Supercon,La2Cu1O4.035,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La2O4.035-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La2O4.035-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Fe0.9Ni0.1Se1,3,0.0999999999999999,2.0,False,Fe1.8Ni0.2Se2,Fe2Se2,0.0,Ferrite,True,Fe45Ni5Se50,Fe-Ni-Se,3,Supercon,Fe0.9Ni0.1Se1,MP-mp-20311,Fe2Se2,Fe-Se,Fe50Se50,P 4/n m m,tetragonal,3.688905,3.688905,5.854194,data/final/MP/cifs/Fe0.9Ni0.1Se1-MP-mp-20311-synth_doped.cif,data/source/MP/raw/cifs/mp-20311.cif,mp-20311,0.0,,2013-10-20 07:09:24,5.619828229873189,10.17188/1195438,"@misc{osti_1195438,
    author = ""Persson, Kristin"",
    title = ""Materials Data on FeSe (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195438"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668877'}},0.0,3.48880228,520.0,-25.01949237,-6.2548730925,"{'tags': ['Iron selenide - NN AFM', 'Iron selenide - orthorhombic, LT', 'Iron selenide', 'Iron sulfide', 'Iron selenide (1/1) - nonmagnetic', 'Iron selenide - tetragonal', 'Iron selenide - alpha LT', 'Iron selenide - LT', 'High pressure experimental phase', 'Iron selenide - alpha']}",-25.01949237,-6.2548730925,-0.5079131286718743,"['xas', 'elasticity', 'bandstructure']",True,"[196301, 196298, 196299, 196297, 290701, 165958, 185464, 163561, 169257, 163560, 977900, 169311, 169303, 26889, 166440, 162901, 169283, 165957, 169271, 977903, 169259, 977901, 185465, 165959, 169306, 169267, 163557, 169287, 169297, 169289, 163556, 169299, 163562, 166441, 182544, 163559, 169269, 169263, 169265, 169315, 169255, 166439, 169293, 169313, 163555, 169291, 169301, 165960, 169253, 169295, 169970, 163558, 169285, 169261, 169309]",True,2021-05-12 10:56:14.760000,NM,4,55,mp-20311,,FeSe,"{'functional': 'PBE', 'labels': ['Fe_pv', 'Se'], 'pot_type': 'paw'}","{'Fe': 1.0, 'Se': 1.0}",GGA,mp-20311,"['mp-684656', 'mp-20311', 'mp-1063646', 'mp-1063662', 'mp-1063681', 'mp-1063669', 'mp-1063680', 'mp-1063695', 'mp-1063686', 'mp-1063699', 'mp-1063715', 'mp-1063717', 'mp-1063876', 'mp-1063734', 'mp-1063891', 'mp-1063735', 'mp-1063910', 'mp-1063918', 'mp-1063922', 'mp-1063931', 'mp-1063774', 'mp-1063781', 'mp-1064091', 'mp-1064111', 'mp-1063801', 'mp-1064112', 'mp-1064180', 'mp-1064138', 'mp-1064153', 'mp-1065102', 'mp-1065123', 'mp-1065075', 'mp-1065161', 'mp-1065131', 'mp-1065030', 'mp-1065055', 'mp-1065085', 'mp-1065094', 'mp-1440814', 'mp-1668877', 'mp-1799618', 'mp-1593782', 'mp-1592730', 'mp-1065081', 'mp-1065148', 'mp-1063928', 'mp-1063726', 'mp-1063683', 'mp-1063709', 'mp-1063911', 'mp-1063795', 'mp-1065121', 'mp-1063725', 'mp-1064139', 'mp-1064165']",3.455e-05,"{'Fe': 2.0, 'Se': 2.0}",79.66398961559156,[],NM,False,129,0,"[0, 0, 0, 0]",8.673931638803586e-07,3.455e-05,0,6.91e-05,MP,data/source/MP/cleaned/cifs/MP-mp-20311.cif,True,,data/final/MP/graphs/Fe0.9Ni0.1Se1-MP-mp-20311-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Bi2Ca1Cu1.97Ni0.03Sr2O8,2,0.004,2.0,False,Bi4Ca2Cu3.94Ni0.06Sr4O16,Bi4Ca2Cu4Sr4O16,77.0,Cuprate,True,Bi13.333Ca6.667Cu13.133Ni0.2Sr13.333O53.333333333333336,Bi-Ca-Cu-Ni-Sr-O,6,Supercon,Bi2Sr2Ca1Cu1.97Ni0.03O8,MP-mp-1218930,Sr4Ca2Cu4Bi4O16,Bi-Ca-Cu-Sr-O,Bi13.333Ca6.667Cu13.333Sr13.333O53.333333333333336,C c c 2,orthorhombic,5.417115,5.472898000129128,16.11398919,data/final/MP/cifs/Bi2Ca1Cu1.97Ni0.03Sr2O8-MP-mp-1218930-synth_doped.cif,data/source/MP/raw/cifs/mp-1218930.cif,mp-1218930,0.0,,2019-01-12 20:01:06.544000,6.266668983881059,,,,0.039252223722225,4.51768334,520.0,-173.15021002,-5.771673667333333,{'tags': []},-173.15021002,-5.771673667333333,-2.074956548222222,[],False,[],True,2021-05-12 11:00:42.526000,NM,30,3,mp-1218930,oxide,Sr2CaCu2(BiO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",GGA,mp-1218930,"['mp-1218930', 'mp-1359698', 'mp-1817714']",0.00011165,"{'Sr': 4.0, 'Ca': 2.0, 'Cu': 4.0, 'Bi': 4.0, 'O': 16.0}",470.7976286073367,[],NM,False,37,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.743014544498498e-07,0.00011165,0,0.0002233,MP,data/source/MP/cleaned/cifs/MP-mp-1218930.cif,True,,data/final/MP/graphs/Bi2Ca1Cu1.97Ni0.03Sr2O8-MP-mp-1218930-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Ce3S4,3,0.1428571428571428,0.25,False,Ce0.75S1,Ce1S1,0.0,Heavy_fermion,True,Ce42.857S57.143,Ce-S,2,Supercon,Ce3S4,MP-mp-1096,Ce1S1,Ce-S,Ce50S50,F m -3 m,cubic,4.01819085,4.01819085,4.01819085,data/final/MP/cifs/Ce3S4-MP-mp-1096-synth_doped.cif,data/source/MP/raw/cifs/mp-1096.cif,mp-1096,0.0,,2011-05-12 18:20:21,6.232433296978239,10.17188/1187481,"@misc{osti_1187481,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeS (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187481"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688412'}},0.0,8.46437524,520.0,-14.16108828,-7.08054414,"{'tags': ['Cerium sulfide (1/1)', 'Cerium(II) sulfide', 'High pressure experimental phase']}",-14.16108828,-7.08054414,-2.2972746290625,"['xas', 'elasticity', 'bandstructure']",True,"[603041, 29397, 622013, 31706, 622035, 622033, 102279, 183945, 622039, 622029, 622009, 102280, 622016, 603087, 622010]",True,2021-05-12 10:56:10.715000,FM,2,7,mp-1096,,CeS,"{'functional': 'PBE', 'labels': ['Ce', 'S'], 'pot_type': 'paw'}","{'Ce': 1.0, 'S': 1.0}",GGA,mp-1096,"['mp-1096', 'mp-1076900', 'mp-1440849', 'mp-1688412', 'mp-1790865', 'mp-1594709', 'mp-1593380']",0.1440823,"{'Ce': 1.0, 'S': 1.0}",45.875064104557374,[],FM,True,225,1,"[0.1, 0.0]",0.0031407541942962,0.1440823,1,0.1440823,MP,data/source/MP/cleaned/cifs/MP-mp-1096.cif,True,,data/final/MP/graphs/Ce3S4-MP-mp-1096-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ga3Lu1,1,0.0,1.0,True,Ga3Lu1,Ga3Lu1,2.25,Other,True,Ga75Lu25,Ga-Lu,2,Supercon,Ga3Lu1,MP-mp-495,Lu1Ga3,Ga-Lu,Ga75Lu25,P m -3 m,cubic,4.222559,4.222559,4.222559,data/final/MP/cifs/Ga3Lu1-MP-mp-495.cif,data/source/MP/raw/cifs/mp-495.cif,mp-495,0.0,,2011-05-13 01:42:55,8.472409289829647,10.17188/1208505,"@misc{osti_1208505,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LuGa3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208505"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677450'}},0.0,3.93360362,520.0,-15.60504995,-3.9012624875,{'tags': ['Gallium lutetium (3/1)']},-15.60504995,-3.9012624875,-0.4999528406249998,"['xas', 'elasticity', 'bandstructure']",True,"[103659, 106721]",True,2021-05-12 10:56:20.740000,NM,4,8,mp-495,,LuGa3,"{'functional': 'PBE', 'labels': ['Lu_3', 'Ga_d'], 'pot_type': 'paw'}","{'Lu': 1.0, 'Ga': 3.0}",GGA,mp-495,"['mp-991455', 'mp-993405', 'mp-495', 'mp-1437882', 'mp-1677450', 'mp-1798575', 'mp-994716', 'mp-1592452']",0.0066563,"{'Lu': 1.0, 'Ga': 3.0}",75.28824600732705,[],NM,False,221,0,"[0, 0, 0, 0]",8.84108788953884e-05,0.0066563,0,0.0066563,MP,data/source/MP/cleaned/cifs/MP-mp-495.cif,False,,data/final/MP/graphs/Ga3Lu1-MP-mp-495.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
C1Cu0.67Nb2S2,3,0.0970017636684303,1.0,True,C1Cu0.67Nb2S2,C1Cu1Nb2S2,4.85,Other,True,C17.637Cu11.817Nb35.273S35.273,C-Cu-Nb-S,4,Supercon,Cu0.67Nb2S2C1,MP-mp-1220693,Nb2Cu1C1S2,C-Cu-Nb-S,C16.667Cu16.667Nb33.333S33.333,P 3 m 1,trigonal,3.3706959997609327,3.37069655,9.073781,data/final/MP/cifs/C1Cu0.67Nb2S2-MP-mp-1220693-synth_doped.cif,data/source/MP/raw/cifs/mp-1220693.cif,mp-1220693,0.0,,2019-01-12 21:30:01.564000,6.053982749814308,,,{'GGA': {'task_id': 'mp-1761598'}},0.0477976855555555,6.70271839,520.0,-45.86461631,-7.644102718333333,{'tags': []},-45.86461631,-7.644102718333333,-0.8448531877083335,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,6,5,mp-1220693,,Nb2CuCS2,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Cu_pv', 'C', 'S'], 'pot_type': 'paw'}","{'Nb': 2.0, 'Cu': 1.0, 'C': 1.0, 'S': 2.0}",GGA,mp-1220693,"['mp-1220693', 'mp-1384378', 'mp-1761598', 'mp-1784318', 'mp-1627963']",0.0044225,"{'Nb': 2.0, 'Cu': 1.0, 'C': 1.0, 'S': 2.0}",89.2808241820284,[],NM,False,156,0,"[0, 0, 0, 0, 0, 0]",4.953471297468397e-05,0.0044225,0,0.0044225,MP,data/source/MP/cleaned/cifs/MP-mp-1220693.cif,True,,data/final/MP/graphs/C1Cu0.67Nb2S2-MP-mp-1220693-synth_doped.json,0,True,3m,0,0,0,0,0,0,5,1,0,0,0,1.0,False
Ca0.5Cu3Ho0.5Pb2Sr2O8,1,0.0,2.0,False,Ca1Cu6Ho1Pb4Sr4O16,Ca1Cu6Ho1Pb4Sr4O16,75.56666667,Cuprate,True,Ca3.125Cu18.75Ho3.125Pb12.5Sr12.5O50,Ca-Cu-Ho-Pb-Sr-O,6,Supercon,Pb2Sr2Ho0.5Ca0.5Cu3O8,MP-mp-1218617,Sr4Ca1Ho1Cu6Pb4O16,Ca-Cu-Ho-Pb-Sr-O,Ca3.125Cu18.75Ho3.125Pb12.5Sr12.5O50,P -1,triclinic,5.422617,5.4462875,15.92428439,data/final/MP/cifs/Ca0.5Cu3Ho0.5Pb2Sr2O8-MP-mp-1218617.cif,data/source/MP/raw/cifs/mp-1218617.cif,mp-1218617,0.0,,2019-01-12 19:45:20.170000,7.138213488991523,,,,0.0212777975862605,4.23993453,520.0,-184.92155102,-5.778798469375,{'tags': []},-184.92155102,-5.778798469375,-1.9985738773958337,[],False,[],True,2021-05-12 11:00:42.526000,NM,32,3,mp-1218617,oxide,Sr4CaHoCu6(PbO4)4,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Ho_3', 'Cu_pv', 'Pb_d', 'O'], 'pot_type': 'paw'}","{'Sr': 4.0, 'Ca': 1.0, 'Ho': 1.0, 'Cu': 6.0, 'Pb': 4.0, 'O': 16.0}",GGA,mp-1218617,"['mp-1218617', 'mp-1361992', 'mp-1818250']",0.0944834,"{'Sr': 4.0, 'Ca': 1.0, 'Ho': 1.0, 'Cu': 6.0, 'Pb': 4.0, 'O': 16.0}",470.2676086960069,[],NM,False,2,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0002009141141189,0.0944834,0,0.0944834,MP,data/source/MP/cleaned/cifs/MP-mp-1218617.cif,False,,data/final/MP/graphs/Ca0.5Cu3Ho0.5Pb2Sr2O8-MP-mp-1218617.json,0,True,-1,0,0,0,0,0,2,0,1,0,0,0,1.0,False
Dy1Rh1Si1,1,0.0,4.0,False,Dy4Rh4Si4,Dy4Rh4Si4,0.0,Other,True,Dy33.333Rh33.333Si33.333,Dy-Rh-Si,3,Supercon,Dy1Rh1Si1,MP-mp-1212831,Dy4Si4Rh4,Dy-Rh-Si,Dy33.333Rh33.333Si33.333,P n m a,orthorhombic,4.260245,6.933662,7.381833,data/final/MP/cifs/Dy1Rh1Si1-MP-mp-1212831.cif,data/source/MP/raw/cifs/mp-1212831.cif,mp-1212831,0.0,,2019-01-12 14:57:08.200000,8.940100861847796,,,{'GGA': {'task_id': 'mp-1744439'}},0.0,6.16253853,520.0,-82.17452723,-6.847877269166666,"{'tags': ['TiNiSi', 'AlB2 family', 'DyRhSi']}",-82.17452723,-6.847877269166666,-1.0254076924999989,[],False,[],True,2021-05-12 11:00:31.209000,NM,12,4,mp-1212831,,DySiRh,"{'functional': 'PBE', 'labels': ['Dy_3', 'Si', 'Rh_pv'], 'pot_type': 'paw'}","{'Dy': 1.0, 'Si': 1.0, 'Rh': 1.0}",GGA,mp-1212831,"['mp-1212831', 'mp-1400688', 'mp-1744439', 'mp-1831359']",5.3625e-05,"{'Dy': 4.0, 'Si': 4.0, 'Rh': 4.0}",218.0526948080858,[],NM,False,6,0,"[-0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",9.837071731160552e-07,5.3625e-05,0,0.0002145,MP,data/source/MP/cleaned/cifs/MP-mp-1212831.cif,False,,data/final/MP/graphs/Dy1Rh1Si1-MP-mp-1212831.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ge2Pd1.92Pt0.08Sr1,2,0.032,1.0,True,Ge2Pd1.92Pt0.08Sr1,Ge2Pd2Sr1,3.23,Other,True,Ge40Pd38.4Pt1.6Sr20,Ge-Pd-Pt-Sr,4,Supercon,Sr1Pd1.92Pt0.08Ge2,MP-mp-978986,Sr1Ge2Pd2,Ge-Pd-Sr,Ge40Pd40Sr20,I 4/m m m,tetragonal,4.438671999438209,4.438671999438209,6.03054834,data/final/MP/cifs/Ge2Pd1.92Pt0.08Sr1-MP-mp-978986-synth_doped.cif,data/source/MP/raw/cifs/mp-978986.cif,mp-978986,0.0,,2015-10-09 03:56:43,7.295677176868866,10.17188/1316057,"@misc{osti_1316057,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr(GePd)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1316057"",
    place = ""United States"",
    year = ""2016"",
    month = ""9"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688092'}},0.0,4.0155429,520.0,-24.8627221,-4.97254442,"{'tags': ['Strontium palladium germanide (1/2/2)', 'Strontium palladium germanium (1/2/2)', 'High pressure experimental phase']}",-24.8627221,-4.97254442,-0.7134818633333324,"['xas', 'elasticity', 'bandstructure']",True,"[165985, 181157, 181155, 181156, 168133]",True,2021-05-12 10:56:37.246000,NM,5,9,mp-978986,,Sr(GePd)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ge_d', 'Pd'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Ge': 2.0, 'Pd': 2.0}",GGA,mp-978986,"['mp-1005776', 'mp-978986', 'mp-1005866', 'mp-979737', 'mp-1438850', 'mp-1688092', 'mp-1782349', 'mp-1011093', 'mp-1589601']",0.0012593,"{'Sr': 1.0, 'Ge': 2.0, 'Pd': 2.0}",101.45304755163892,[],NM,False,139,0,"[0, 0, 0, 0, 0]",1.2412638460752248e-05,0.0012593,0,0.0012593,MP,data/source/MP/cleaned/cifs/MP-mp-978986.cif,True,,data/final/MP/graphs/Ge2Pd1.92Pt0.08Sr1-MP-mp-978986-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ru0.45V0.55,3,0.1,2.0,False,Ru0.9V1.1,Ru1V1,4.0,Other,True,Ru45V55,Ru-V,2,Supercon,Ru0.45V0.55,MP-mp-1395,V1Ru1,Ru-V,Ru50V50,P m -3 m,cubic,3.014694,3.014694,3.014694,data/final/MP/cifs/Ru0.45V0.55-MP-mp-1395-synth_doped.cif,data/source/MP/raw/cifs/mp-1395.cif,mp-1395,0.0,,2011-05-12 19:37:14,9.21288886283982,10.17188/1189837,"@misc{osti_1189837,
    author = ""Persson, Kristin"",
    title = ""Materials Data on VRu (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189837"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688485'}},0.0,7.72767567,520.0,-18.82570789,-9.412853945,"{'tags': ['Ruthenium vanadium (1/1)', 'Ruthenium vanadium (1/1) - HT']}",-18.82570789,-9.412853945,-0.2337060825000012,"['xas', 'elasticity', 'bandstructure']",True,"[106010, 106011]",True,2021-05-12 10:56:12.755000,FiM,2,17,mp-1395,,VRu,"{'functional': 'PBE', 'labels': ['V_pv', 'Ru_pv'], 'pot_type': 'paw'}","{'V': 1.0, 'Ru': 1.0}",GGA,mp-1395,"['mp-991544', 'mp-993492', 'mp-2829', 'mp-1395', 'mp-1059722', 'mp-1059669', 'mp-1059766', 'mp-1059703', 'mp-1059619', 'mp-1059801', 'mp-1442257', 'mp-1688485', 'mp-1792970', 'mp-994797', 'mp-1591529', 'mp-1059798', 'mp-1059699']",0.647887,"{'V': 1.0, 'Ru': 1.0}",27.39868439535897,[],FiM,True,221,2,"[0.7, -0.1]",0.023646646337141,0.647887,2,0.647887,MP,data/source/MP/cleaned/cifs/MP-mp-1395.cif,True,,data/final/MP/graphs/Ru0.45V0.55-MP-mp-1395-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ni0.08S2Ta1,3,0.1018981018981018,4.0,False,Ni0.32S8Ta4,Ni1S8Ta4,0.0,Ferrite,True,Ni2.597S64.935Ta32.468,Ni-S-Ta,3,Supercon,Ni0.08Ta1S2,MP-mp-1218136,Ta4Ni1S8,Ni-S-Ta,Ni7.692S61.538Ta30.769,P -3 m 1,trigonal,3.369069999250622,3.36906982,24.425977,data/final/MP/cifs/Ni0.08S2Ta1-MP-mp-1218136-synth_doped.cif,data/source/MP/raw/cifs/mp-1218136.cif,mp-1218136,0.0,,2019-01-12 19:21:19.076000,7.185617374365983,,,{'GGA': {'task_id': 'mp-1746242'}},0.0414952845607894,5.36411464,520.0,-98.60879648,-7.585292036923077,{'tags': []},-98.60879648,-7.585292036923077,-1.2561500265384615,[],False,[],True,2021-05-12 11:00:42.526000,FM,13,4,mp-1218136,,Ta4NiS8,"{'functional': 'PBE', 'labels': ['Ta_pv', 'Ni_pv', 'S'], 'pot_type': 'paw'}","{'Ta': 4.0, 'Ni': 1.0, 'S': 8.0}",GGA,mp-1218136,"['mp-1218136', 'mp-1395464', 'mp-1746242', 'mp-1876649']",0.5894077,"{'Ta': 4.0, 'Ni': 1.0, 'S': 8.0}",240.1057793870966,[],FM,True,164,1,"[0.0, 0.0, 0.0, 0.0, 0.5, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.002454783477118,0.5894077,1,0.5894077,MP,data/source/MP/cleaned/cifs/MP-mp-1218136.cif,True,,data/final/MP/graphs/Ni0.08S2Ta1-MP-mp-1218136-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Fe0.15V1.85Zr1,3,0.0999999999999999,2.0,False,Fe0.3V3.7Zr2,V4Zr2,6.41,Other,True,Fe5V61.667Zr33.333,Fe-V-Zr,3,Supercon,Zr1V1.85Fe0.15,MP-mp-258,Zr2V4,V-Zr,V66.667Zr33.333,F d -3 m,cubic,5.20454208,5.20454208,5.20454208,data/final/MP/cifs/Fe0.15V1.85Zr1-MP-mp-258-synth_doped.cif,data/source/MP/raw/cifs/mp-258.cif,mp-258,0.0,,2011-05-13 13:06:32,6.4334589517749015,10.17188/1201055,"@misc{osti_1201055,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrV2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201055"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686904'}},0.0488598200000005,4.89596571,520.0,-53.13786662,-8.856311103333333,"{'tags': ['Zirconium vanadium (1/2)', 'Vanadium zirconium deuteride (2/1/5)', 'Vanadium zirconium hydride (2/1/5)', 'Vanadium zirconium deuteride (2/1/4)', 'Vanadium zirconium (2/1)', 'High pressure experimental phase', 'Vanadium zirconium hydride (2/1/4)']}",-53.13786662,-8.856311103333333,0.0488598199999993,"['xas', 'elasticity', 'bandstructure']",True,"[183002, 653420, 638530, 167450, 187954, 106215, 183001, 653413, 183003, 653426, 653428, 638531, 653418, 638533, 653407, 653406, 638534, 653415, 653417, 653408, 653427, 106214, 656648, 638532, 653410, 653409, 653405, 653411]",True,2021-05-12 10:56:18.721000,NM,6,34,mp-258,,ZrV2,"{'functional': 'PBE', 'labels': ['Zr_sv', 'V_pv'], 'pot_type': 'paw'}","{'Zr': 1.0, 'V': 2.0}",GGA,mp-258,"['mp-930966', 'mp-930609', 'mp-913794', 'mp-258', 'mp-1071784', 'mp-1071714', 'mp-1071952', 'mp-1071810', 'mp-1072028', 'mp-1072052', 'mp-1072339', 'mp-1072434', 'mp-1072432', 'mp-1072450', 'mp-1072519', 'mp-1072536', 'mp-1072714', 'mp-1072786', 'mp-1072809', 'mp-1077011', 'mp-1076995', 'mp-1077180', 'mp-1077357', 'mp-1077570', 'mp-1440605', 'mp-1686904', 'mp-1928517', 'mp-1591452', 'mp-1596888', 'mp-1071821', 'mp-1072464', 'mp-1072551', 'mp-1072818', 'mp-1072068']",0.0235113,"{'Zr': 2.0, 'V': 4.0}",99.68563410059843,[],NM,False,227,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0004717088919005,0.0235113,0,0.0470226,MP,data/source/MP/cleaned/cifs/MP-mp-258.cif,True,,data/final/MP/graphs/Fe0.15V1.85Zr1-MP-mp-258-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ta0.2Zr0.8,3,0.1,8.0,False,Ta1.6Zr6.4,Ta2Zr6,5.56,Other,True,Ta20Zr80,Ta-Zr,2,Supercon,Ta0.2Zr0.8,MP-mp-1188053,Zr6Ta2,Ta-Zr,Ta25Zr75,P 63/m m c,hexagonal,5.150982,6.30609000009881,6.30608988,data/final/MP/cifs/Ta0.2Zr0.8-MP-mp-1188053-synth_doped.cif,data/source/MP/raw/cifs/mp-1188053.cif,mp-1188053,0.0,,2019-01-11 15:33:14.513000,8.511116474236113,,,{'GGA': {'task_id': 'mp-1730546'}},0.1532611537499999,4.63273908,520.0,-73.77566981,-9.22195872625,{'tags': []},-73.77566981,-9.22195872625,0.1532611537499999,['bandstructure'],True,[],True,2021-05-12 10:58:31.620000,NM,8,5,mp-1188053,,Zr3Ta,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Ta_pv'], 'pot_type': 'paw'}","{'Zr': 3.0, 'Ta': 1.0}",GGA,mp-1188053,"['mp-1188053', 'mp-1391901', 'mp-1730546', 'mp-1882910', 'mp-1619127']",0.0001004,"{'Zr': 6.0, 'Ta': 2.0}",177.394839673078,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.1319382253173517e-06,0.0001004,0,0.0002008,MP,data/source/MP/cleaned/cifs/MP-mp-1188053.cif,True,,data/final/MP/graphs/Ta0.2Zr0.8-MP-mp-1188053-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Nd0.3Os4Pr0.7Sb12,3,0.0352941176470588,1.0,True,Nd0.3Os4Pr0.7Sb12,Os4Pr1Sb12,1.27,Heavy_fermion,True,Nd1.765Os23.529Pr4.118Sb70.588,Nd-Os-Pr-Sb,4,Supercon,Pr0.7Nd0.3Os4Sb12,MP-mp-4251,Pr1Sb12Os4,Os-Pr-Sb,Os23.529Pr5.882Sb70.588,I m -3,cubic,8.16020751180899,8.16020751,8.16020751,data/final/MP/cifs/Nd0.3Os4Pr0.7Sb12-MP-mp-4251-synth_doped.cif,data/source/MP/raw/cifs/mp-4251.cif,mp-4251,0.0,,2011-05-15 09:44:04,9.380402650313032,10.17188/1208003,"@misc{osti_1208003,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Pr(Sb3Os)4 (SG:204) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208003"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700242'}},0.0086126564705901,7.28147826,520.0,-102.089288,-6.005252235294117,{'tags': ['Praseodymium osmium antimonide (1/4/12)']},-102.089288,-6.005252235294117,-0.1677005267647063,"['xas', 'elasticity', 'bandstructure']",True,"[155178, 155187, 165911, 155182, 155185, 155181, 647731, 155183, 155188, 155180, 155179, 165910, 155184, 155186, 183087]",True,2021-05-12 10:56:20.740000,NM,17,9,mp-4251,,Pr(Sb3Os)4,"{'functional': 'PBE', 'labels': ['Pr_3', 'Sb', 'Os_pv'], 'pot_type': 'paw'}","{'Pr': 1.0, 'Sb': 12.0, 'Os': 4.0}",GGA,mp-4251,"['mp-1000443', 'mp-1006919', 'mp-4251', 'mp-1188290', 'mp-1430112', 'mp-1700242', 'mp-1817791', 'mp-1011635', 'mp-1609307']",0.0526026,"{'Pr': 1.0, 'Sb': 12.0, 'Os': 4.0}",418.2940787754696,[],NM,False,204,0,"[-0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.000125755067234,0.0526026,0,0.0526026,MP,data/source/MP/cleaned/cifs/MP-mp-4251.cif,True,,data/final/MP/graphs/Nd0.3Os4Pr0.7Sb12-MP-mp-4251-synth_doped.json,0,True,m-3,2,0,0,0,0,0,0,0,0,1,0,1.0,False
Al0.215Nb0.785,3,0.07,8.0,False,Al1.72Nb6.28,Al2Nb6,17.97,Other,True,Al21.5Nb78.5,Al-Nb,2,Supercon,Al0.215Nb0.785,MP-mp-796,Nb6Al2,Al-Nb,Al25Nb75,P m -3 n,cubic,5.215254,5.215254,5.215254,data/final/MP/cifs/Al0.215Nb0.785-MP-mp-796-synth_doped.cif,data/source/MP/raw/cifs/mp-796.cif,mp-796,0.0,,2011-05-13 16:07:37,7.157298025966356,,,{'GGA': {'task_id': 'mp-1686893'}},0.0460773865000003,5.52947534,520.0,-69.48918494,-8.6861481175,"{'tags': ['Aluminium niobium (1/3)', 'Niobium aluminide (3/1)', 'Aluminum niobium (1/3)']}",-69.48918494,-8.6861481175,-0.1737753800000003,"['bandstructure', 'elasticity']",True,"[608675, 608654, 608688, 608668, 608669, 608685, 608676, 608683, 58014, 608657, 107856, 608655, 608666, 608691, 608656, 608665, 608673, 608653, 608661]",True,2021-05-12 10:56:31.128000,NM,8,10,mp-796,,Nb3Al,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Al': 1.0}",GGA,mp-796,"['mp-911586', 'mp-927906', 'mp-796', 'mp-927472', 'mp-1260512', 'mp-1440919', 'mp-1686893', 'mp-1927652', 'mp-1591599', 'mp-1587739']",0.16323955,"{'Nb': 6.0, 'Al': 2.0}",141.8490379078192,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0023015954483396,0.16323955,0,0.3264791,MP,data/source/MP/cleaned/cifs/MP-mp-796.cif,True,,data/final/MP/graphs/Al0.215Nb0.785-MP-mp-796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ir0.99Pt0.01Te2,2,0.0066666666666666,4.0,False,Ir3.96Pt0.04Te8,Ir4Te8,2.05,Other,True,Ir33Pt0.333Te66.667,Ir-Pt-Te,3,Supercon,Ir0.99Pt0.01Te2,MP-mp-569322,Te8Ir4,Ir-Te,Ir33.333Te66.667,P n m a,orthorhombic,4.049805,5.441863,13.587474,data/final/MP/cifs/Ir0.99Pt0.01Te2-MP-mp-569322-synth_doped.cif,data/source/MP/raw/cifs/mp-569322.cif,mp-569322,0.0,,2014-02-16 04:48:25,9.924328423353325,10.17188/1275037,"@misc{osti_1275037,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Te2Ir (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1275037"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1746248'}},0.0123894575000003,7.60847828,520.0,-63.94410921,-5.3286757675,{'tags': ['Iridium telluride (1/2)']},-63.94410921,-5.3286757675,-0.5683316741666667,"['xas', 'bandstructure']",True,[93894],True,2021-05-12 10:57:24.969000,NM,12,7,mp-569322,,Te2Ir,"{'functional': 'PBE', 'labels': ['Te', 'Ir'], 'pot_type': 'paw'}","{'Te': 2.0, 'Ir': 1.0}",GGA,mp-569322,"['mp-927873', 'mp-927408', 'mp-569322', 'mp-911451', 'mp-1392626', 'mp-1746248', 'mp-1810340']",0.000153075,"{'Te': 8.0, 'Ir': 4.0}",299.44732816890644,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.0447669503153013e-06,0.000153075,0,0.0006123,MP,data/source/MP/cleaned/cifs/MP-mp-569322.cif,True,,data/final/MP/graphs/Ir0.99Pt0.01Te2-MP-mp-569322-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
B2Os1Tb1,1,0.0,4.0,False,B8Os4Tb4,B8Os4Tb4,0.0,Other,True,B50Os25Tb25,B-Os-Tb,3,Supercon,Tb1Os1B2,MP-mp-1189495,Tb4B8Os4,B-Os-Tb,B50Os25Tb25,P n m a,orthorhombic,5.340445,5.926614,6.39107,data/final/MP/cifs/B2Os1Tb1-MP-mp-1189495.cif,data/source/MP/raw/cifs/mp-1189495.cif,mp-1189495,0.0,,2019-01-11 20:14:16.895000,12.174878093182988,,,{'GGA': {'task_id': 'mp-1709175'}},0.0,6.35170446,520.0,-125.75443498,-7.85965218625,"{'tags': ['TbOsB2', 'Terbium osmium boride (1/1/2)', 'LuRuB2']}",-125.75443498,-7.85965218625,-0.5545232120833328,['bandstructure'],True,[615131],True,2021-05-12 10:58:33.577000,NM,16,5,mp-1189495,,TbB2Os,"{'functional': 'PBE', 'labels': ['Tb_3', 'B', 'Os_pv'], 'pot_type': 'paw'}","{'Tb': 1.0, 'B': 2.0, 'Os': 1.0}",GGA,mp-1189495,"['mp-1189495', 'mp-1432252', 'mp-1709175', 'mp-1835592', 'mp-1600296']",4.85e-06,"{'Tb': 4.0, 'B': 8.0, 'Os': 4.0}",202.28219780867013,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",9.590562199818301e-08,4.85e-06,0,1.94e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1189495.cif,False,,data/final/MP/graphs/B2Os1Tb1-MP-mp-1189495.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
As1Fe0.92Ni0.08Sm1O1,2,0.0399999999999999,2.0,False,As2Fe1.84Ni0.16Sm2O2,As2Fe2Sm2O2,6.0,Ferrite,True,As25Fe23Ni2Sm25O25,As-Fe-Ni-Sm-O,5,Supercon,Sm1Fe0.92Ni0.08As1O1,MP-mp-20349,Sm2Fe2As2O2,As-Fe-Sm-O,As25Fe25Sm25O25,P 4/n m m,tetragonal,4.026492,4.026492,9.046755,data/final/MP/cifs/As1Fe0.92Ni0.08Sm1O1-MP-mp-20349-synth_doped.cif,data/source/MP/raw/cifs/mp-20349.cif,mp-20349,0.0,,2014-02-19 11:24:42,6.727802583283198,,,{'GGA+U': {'task_id': 'mp-1695938'}},0.3015723809374986,3.77685593,520.0,-52.73407138,-6.5917589225,{'tags': ['Samarium iron arsenic oxide (1/1/1/1)']},-52.73407138,-6.5917589225,-1.6285904237499995,"['xas', 'elasticity', 'bandstructure']",True,"[236652, 236653, 422002, 163457, 163458]",True,2021-05-12 10:56:16.728000,FM,8,10,mp-20349,oxide,SmFeAsO,"{'functional': 'PBE', 'labels': ['Sm_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Sm': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-20349,"['mp-24944', 'mp-1078897', 'mp-1079866', 'mp-1173321', 'mp-20349', 'mp-1425472', 'mp-1695938', 'mp-1772503', 'mp-1789694', 'mp-1588381']",3.75729895,"{'Sm': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",146.67176231613362,[],FM,True,129,1,"[0.0, 0.0, 3.5, 3.5, -0.0, -0.0, -0.0, -0.0]",0.0512341147425717,3.75729895,2,7.5145979,MP,data/source/MP/cleaned/cifs/MP-mp-20349.cif,True,,data/final/MP/graphs/As1Fe0.92Ni0.08Sm1O1-MP-mp-20349-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
As2Cd1Ge1,1,0.0,2.0,False,As4Cd2Ge2,As4Cd2Ge2,3.02,Other,True,As50Cd25Ge25,As-Cd-Ge,3,Supercon,As2Cd1Ge1,MP-mp-4953,Cd2Ge2As4,As-Cd-Ge,As50Cd25Ge25,I -4 2 d,tetragonal,6.068026000251692,6.068026000251692,7.16344965,data/final/MP/cifs/As2Cd1Ge1-MP-mp-4953.cif,data/source/MP/raw/cifs/mp-4953.cif,mp-4953,0.4228,,2011-05-13 17:31:58,5.265794832921725,10.17188/1208508,"@misc{osti_1208508,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CdGeAs2 (SG:122) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208508"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1670428'}},0.0,2.33465951,520.0,-30.45758378,-3.8071979725,"{'tags': ['Chalcopyrite', 'Cadmium germanium arsenide (1/1/2) - HT', 'Cadmium germanium arsenide', 'Cadmium germanium arsenide (1/1/2)']}",-30.45758378,-3.8071979725,-0.0911593662499998,"['eos', 'elasticity', 'bandstructure', 'xas']",True,"[657298, 42098, 16736, 609945, 290865, 153594, 153595, 609947, 609944, 609951, 22185, 609942, 153593]",True,2021-05-12 10:56:20.740000,NM,8,10,mp-4953,,CdGeAs2,"{'functional': 'PBE', 'labels': ['Cd', 'Ge_d', 'As'], 'pot_type': 'paw'}","{'Cd': 1.0, 'Ge': 1.0, 'As': 2.0}",GGA,mp-4953,"['mp-905747', 'mp-918732', 'mp-919719', 'mp-567432', 'mp-4953', 'mp-1079301', 'mp-1439173', 'mp-1670428', 'mp-1834808', 'mp-1587282']",1.865e-05,"{'Cd': 2.0, 'Ge': 2.0, 'As': 4.0}",211.2140407753786,[],NM,False,122,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.765981080759101e-07,1.865e-05,0,3.73e-05,MP,data/source/MP/cleaned/cifs/MP-mp-4953.cif,False,,data/final/MP/graphs/As2Cd1Ge1-MP-mp-4953.json,0,True,-42m,0,0,0,0,6,0,0,0,0,1,0,1.0,False
Fe3Te3Tl1,1,0.0,2.0,False,Fe6Te6Tl2,Fe6Te6Tl2,0.0,Ferrite,True,Fe42.857Te42.857Tl14.286,Fe-Te-Tl,3,Supercon,Tl1Fe3Te3,MP-mp-3708,Tl2Fe6Te6,Fe-Te-Tl,Fe42.857Te42.857Tl14.286,P 63/m,hexagonal,4.251849,9.452910002885623,9.452909829999998,data/final/MP/cifs/Fe3Te3Tl1-MP-mp-3708.cif,data/source/MP/raw/cifs/mp-3708.cif,mp-3708,0.0,,2011-05-16 03:59:08,7.617710676605935,10.17188/1207305,"@misc{osti_1207305,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Tl(FeTe)3 (SG:176) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207305"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1676052'}},0.0307887957954546,6.04782538,520.0,-76.22976167,-5.444982976428571,"{'tags': ['Iron thallium telluride (3/1/3)', 'Thallium iron telluride (1/3/3)']}",-76.22976167,-5.444982976428571,-0.311187078333333,"['xas', 'bandstructure']",True,"[53564, 633881, 633883, 100352, 53565]",True,2021-05-12 10:57:06.958000,FM,14,9,mp-3708,,Tl(FeTe)3,"{'functional': 'PBE', 'labels': ['Tl_d', 'Fe_pv', 'Te'], 'pot_type': 'paw'}","{'Tl': 1.0, 'Fe': 3.0, 'Te': 3.0}",GGA,mp-3708,"['mp-917496', 'mp-925184', 'mp-3708', 'mp-924425', 'mp-1104665', 'mp-1442597', 'mp-1676052', 'mp-1813362', 'mp-1599452']",6.1342297,"{'Tl': 2.0, 'Fe': 6.0, 'Te': 6.0}",329.03303226693777,[],FM,True,176,1,"[0.0, 0.0, 2.2, 2.2, 2.2, 2.2, 2.2, 2.2, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0372864065211752,6.1342297,6,12.2684594,MP,data/source/MP/cleaned/cifs/MP-mp-3708.cif,False,,data/final/MP/graphs/Fe3Te3Tl1-MP-mp-3708.json,0,True,6/m,0,3,0,0,0,0,0,1,0,0,0,1.0,False
B2Co3Ho1,1,0.0,1.0,True,B2Co3Ho1,B2Co3Ho1,0.0,Other,True,B33.333Co50Ho16.667,B-Co-Ho,3,Supercon,Ho1Co3B2,MP-mp-5313,Ho1Co3B2,B-Co-Ho,B33.333Co50Ho16.667,P 6/m m m,hexagonal,3.02885,4.980773995414455,4.98077329,data/final/MP/cifs/B2Co3Ho1-MP-mp-5313.cif,data/source/MP/raw/cifs/mp-5313.cif,mp-5313,0.0,,2011-05-12 23:52:57,9.272024076586527,10.17188/1263316,"@misc{osti_1263316,
    author = ""Persson, Kristin"",
    title = ""Materials Data on HoCo3B2 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1263316"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1674300'}},0.0,5.62173008,520.0,-42.31489608,-7.05248268,"{'tags': ['Holmium cobalt boride (1/3/2)', 'Cobalt holmium boride (3/1/2)']}",-42.31489608,-7.05248268,-0.5081250472222211,"['xas', 'elasticity', 'bandstructure']",True,"[613120, 153962, 44170, 87165]",True,2021-05-12 10:56:22.739000,NM,6,8,mp-5313,,HoCo3B2,"{'functional': 'PBE', 'labels': ['Ho_3', 'Co', 'B'], 'pot_type': 'paw'}","{'Ho': 1.0, 'Co': 3.0, 'B': 2.0}",GGA,mp-5313,"['mp-5313', 'mp-926019', 'mp-910091', 'mp-925572', 'mp-1437844', 'mp-1674300', 'mp-1925494', 'mp-1591923']",0.0094744,"{'Ho': 1.0, 'Co': 3.0, 'B': 2.0}",65.07317368810773,[],NM,False,65,0,"[-0.0, 0.0, 0.0, -0.0, 0.0, 0.0]",0.0001455960953343,0.0094744,0,0.0094744,MP,data/source/MP/cleaned/cifs/MP-mp-5313.cif,False,,data/final/MP/graphs/B2Co3Ho1-MP-mp-5313.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
P1Zr3,1,0.0,8.0,False,P8Zr24,P8Zr24,4.5,Other,True,P25Zr75,P-Zr,2,Supercon,P1Zr3,MP-mp-22447,Zr24P8,P-Zr,P25Zr75,P 42/n,tetragonal,5.380752,10.858663,10.858663,data/final/MP/cifs/P1Zr3-MP-mp-22447.cif,data/source/MP/raw/cifs/mp-22447.cif,mp-22447,0.0,,2014-02-19 15:37:34,6.378793451366757,10.17188/1197654,"@misc{osti_1197654,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Zr3P (SG:86) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197654"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1732231'}},0.0,5.55530017,520.0,-276.04247754,-8.626327423125,{'tags': ['Zirconium phosphide (3/1)']},-276.04247754,-8.626327423125,-0.8622263239583337,"['xas', 'elasticity', 'bandstructure']",True,"[648318, 68530, 43207]",True,2021-05-12 10:56:16.728000,NM,32,10,mp-22447,,Zr3P,"{'functional': 'PBE', 'labels': ['Zr_sv', 'P'], 'pot_type': 'paw'}","{'Zr': 3.0, 'P': 1.0}",GGA,mp-22447,"['mp-909964', 'mp-925661', 'mp-925982', 'mp-22447', 'mp-1178628', 'mp-1202321', 'mp-1236844', 'mp-1400683', 'mp-1732231', 'mp-1873705']",0.000209675,"{'Zr': 24.0, 'P': 8.0}",634.4474930966562,[],NM,False,86,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.643875211505411e-06,0.000209675,0,0.0016774,MP,data/source/MP/cleaned/cifs/MP-mp-22447.cif,False,,data/final/MP/graphs/P1Zr3-MP-mp-22447.json,0,True,4/m,0,0,0,0,3,0,0,1,0,0,0,1.0,False
Na1Pb3,1,0.0,1.0,True,Na1Pb3,Na1Pb3,5.62,Other,True,Na25Pb75,Na-Pb,2,Supercon,Na1Pb3,MP-mp-20555,Na1Pb3,Na-Pb,Na25Pb75,P m -3 m,cubic,4.946585,4.946585,4.946585,data/final/MP/cifs/Na1Pb3-MP-mp-20555.cif,data/source/MP/raw/cifs/mp-20555.cif,mp-20555,0.0,,2014-02-21 10:43:04,8.843334999549363,10.17188/1195705,"@misc{osti_1195705,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NaPb3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195705"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695207'}},0.0,5.5226126,520.0,-12.97603743,-3.2440093575,{'tags': ['Sodium lead (1/3)']},-12.97603743,-3.2440093575,-0.1288927316379307,"['xas', 'elasticity', 'bandstructure']",True,"[644932, 105157]",True,2021-05-12 10:56:14.760000,NM,4,9,mp-20555,,NaPb3,"{'functional': 'PBE', 'labels': ['Na_pv', 'Pb_d'], 'pot_type': 'paw'}","{'Na': 1.0, 'Pb': 3.0}",GGA,mp-20555,"['mp-991524', 'mp-993472', 'mp-20555', 'mp-1141157', 'mp-1441090', 'mp-1695207', 'mp-1925117', 'mp-994781', 'mp-1590680']",0.0176396,"{'Na': 1.0, 'Pb': 3.0}",121.03652003171472,[],NM,False,221,0,"[0, 0, 0, 0]",0.0001457378318161,0.0176396,0,0.0176396,MP,data/source/MP/cleaned/cifs/MP-mp-20555.cif,False,,data/final/MP/graphs/Na1Pb3-MP-mp-20555.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Rh3Sc1,1,0.0,1.0,True,Rh3Sc1,Rh3Sc1,0.0,Other,True,Rh75Sc25,Rh-Sc,2,Supercon,Rh3Sc1,MP-mp-635,Sc1Rh3,Rh-Sc,Rh75Sc25,P m -3 m,cubic,3.940428,3.940428,3.940428,data/final/MP/cifs/Rh3Sc1-MP-mp-635.cif,data/source/MP/raw/cifs/mp-635.cif,mp-635,0.0,,2011-05-13 05:43:33,9.598869612840824,10.17188/1279530,"@misc{osti_1279530,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ScRh3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1279530"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687686'}},0.0,6.04946072,520.0,-30.85275825,-7.7131895625,{'tags': ['Rhodium scandium (3/1)']},-30.85275825,-7.7131895625,-0.60684138375,"['xas', 'elasticity', 'bandstructure']",True,"[650268, 105921, 105920]",True,2021-05-12 10:56:27.046000,NM,4,8,mp-635,,ScRh3,"{'functional': 'PBE', 'labels': ['Sc_sv', 'Rh_pv'], 'pot_type': 'paw'}","{'Sc': 1.0, 'Rh': 3.0}",GGA,mp-635,"['mp-929147', 'mp-912784', 'mp-635', 'mp-929516', 'mp-1439815', 'mp-1687686', 'mp-1794820', 'mp-1595582']",6.76e-05,"{'Sc': 1.0, 'Rh': 3.0}",61.18291846771327,[],NM,False,221,0,"[0, 0, 0, 0]",1.1048835474507985e-06,6.76e-05,0,6.76e-05,MP,data/source/MP/cleaned/cifs/MP-mp-635.cif,False,,data/final/MP/graphs/Rh3Sc1-MP-mp-635.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ru0.452V0.548,3,0.096,2.0,False,Ru0.904V1.096,Ru1V1,4.2,Other,True,Ru45.2V54.8,Ru-V,2,Supercon,Ru0.452V0.548,MP-mp-1395,V1Ru1,Ru-V,Ru50V50,P m -3 m,cubic,3.014694,3.014694,3.014694,data/final/MP/cifs/Ru0.452V0.548-MP-mp-1395-synth_doped.cif,data/source/MP/raw/cifs/mp-1395.cif,mp-1395,0.0,,2011-05-12 19:37:14,9.21288886283982,10.17188/1189837,"@misc{osti_1189837,
    author = ""Persson, Kristin"",
    title = ""Materials Data on VRu (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189837"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688485'}},0.0,7.72767567,520.0,-18.82570789,-9.412853945,"{'tags': ['Ruthenium vanadium (1/1)', 'Ruthenium vanadium (1/1) - HT']}",-18.82570789,-9.412853945,-0.2337060825000012,"['xas', 'elasticity', 'bandstructure']",True,"[106010, 106011]",True,2021-05-12 10:56:12.755000,FiM,2,17,mp-1395,,VRu,"{'functional': 'PBE', 'labels': ['V_pv', 'Ru_pv'], 'pot_type': 'paw'}","{'V': 1.0, 'Ru': 1.0}",GGA,mp-1395,"['mp-991544', 'mp-993492', 'mp-2829', 'mp-1395', 'mp-1059722', 'mp-1059669', 'mp-1059766', 'mp-1059703', 'mp-1059619', 'mp-1059801', 'mp-1442257', 'mp-1688485', 'mp-1792970', 'mp-994797', 'mp-1591529', 'mp-1059798', 'mp-1059699']",0.647887,"{'V': 1.0, 'Ru': 1.0}",27.39868439535897,[],FiM,True,221,2,"[0.7, -0.1]",0.023646646337141,0.647887,2,0.647887,MP,data/source/MP/cleaned/cifs/MP-mp-1395.cif,True,,data/final/MP/graphs/Ru0.452V0.548-MP-mp-1395-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Bi2Ca1Cu2Sr2O8.293,2,0.0178818195688658,1.9293675991800316,False,Bi3.859Ca1.929Cu3.859Sr3.859O16,Bi4Ca2Cu4Sr4O16,87.5,Cuprate,True,Bi13.078Ca6.539Cu13.078Sr13.078O54.22742431177663,Bi-Ca-Cu-Sr-O,5,Supercon,Bi2Sr2Ca1Cu2O8.293,MP-mp-1218930,Sr4Ca2Cu4Bi4O16,Bi-Ca-Cu-Sr-O,Bi13.333Ca6.667Cu13.333Sr13.333O53.333333333333336,C c c 2,orthorhombic,5.417115,5.472898000129128,16.11398919,data/final/MP/cifs/Bi2Ca1Cu2Sr2O8.293-MP-mp-1218930-synth_doped.cif,data/source/MP/raw/cifs/mp-1218930.cif,mp-1218930,0.0,,2019-01-12 20:01:06.544000,6.266668983881059,,,,0.039252223722225,4.51768334,520.0,-173.15021002,-5.771673667333333,{'tags': []},-173.15021002,-5.771673667333333,-2.074956548222222,[],False,[],True,2021-05-12 11:00:42.526000,NM,30,3,mp-1218930,oxide,Sr2CaCu2(BiO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",GGA,mp-1218930,"['mp-1218930', 'mp-1359698', 'mp-1817714']",0.00011165,"{'Sr': 4.0, 'Ca': 2.0, 'Cu': 4.0, 'Bi': 4.0, 'O': 16.0}",470.7976286073367,[],NM,False,37,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.743014544498498e-07,0.00011165,0,0.0002233,MP,data/source/MP/cleaned/cifs/MP-mp-1218930.cif,True,,data/final/MP/graphs/Bi2Ca1Cu2Sr2O8.293-MP-mp-1218930-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
B2C1Lu0.84Ni2Y0.16,3,0.0533333333333333,1.0,True,B2C1Lu0.84Ni2Y0.16,B2C1Lu1Ni2,15.2,Other,True,B33.333C16.667Lu14Ni33.333Y2.667,B-C-Lu-Ni-Y,5,Supercon,Y0.16Lu0.84Ni2B2C1,MP-mp-6544,Lu1Ni2B2C1,B-C-Lu-Ni,B33.333C16.667Lu16.667Ni33.333,I 4/m m m,tetragonal,3.4660159989239463,3.4660159989239463,5.81490896,data/final/MP/cifs/B2C1Lu0.84Ni2Y0.16-MP-mp-6544-synth_doped.cif,data/source/MP/raw/cifs/mp-6544.cif,mp-6544,0.0,,2011-05-13 04:17:06,8.54504130524706,10.17188/1281287,"@misc{osti_1281287,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LuNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281287"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702891'}},0.0,6.71335166,520.0,-41.78223818,-6.963706363333333,{'tags': []},-41.78223818,-6.963706363333333,-0.5192416763888884,"['xas', 'bandstructure']",True,"[75609, 83230, 79564]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6544,,LuNi2B2C,"{'functional': 'PBE', 'labels': ['Lu_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Lu': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6544,"['mp-1000584', 'mp-1007055', 'mp-6544', 'mp-1441469', 'mp-1702891', 'mp-1783160', 'mp-1011794', 'mp-1588498']",0.0023161,"{'Lu': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",63.34823894903922,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",3.656139520884231e-05,0.0023161,0,0.0023161,MP,data/source/MP/cleaned/cifs/MP-mp-6544.cif,True,,data/final/MP/graphs/B2C1Lu0.84Ni2Y0.16-MP-mp-6544-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B0.015C0.985Cu1Sr2O5,2,0.0033333333333333,4.0,False,B0.06C3.94Cu4Sr8O20,C4Cu4Sr8O20,0.0,Cuprate,True,B0.167C10.944Cu11.111Sr22.222O55.55555555555556,B-C-Cu-Sr-O,5,Supercon,Sr2Cu1C0.985B0.015O5,MP-mp-1198030,Sr8Cu4C4O20,C-Cu-Sr-O,C11.111Cu11.111Sr22.222O55.55555555555556,I -4,tetragonal,7.877744002100394,7.877744002100395,9.46755054,data/final/MP/cifs/B0.015C0.985Cu1Sr2O5-MP-mp-1198030-synth_doped.cif,data/source/MP/raw/cifs/mp-1198030.cif,mp-1198030,0.0,,2019-01-12 02:53:33.853000,4.624821022244182,,,{'GGA': {'task_id': 'mp-1742814'}},0.0386187874999981,3.47889523,520.0,-237.90163358,-6.608378710555556,"{'tags': ['Distrontium copper dioxide carbonate - LT', 'Distrontium copper dioxide carbonate']}",-237.90163358,-6.608378710555556,-2.385069899259259,['bandstructure'],True,"[78650, 83095]",True,2021-05-12 10:58:37.524000,NM,36,6,mp-1198030,oxide,Sr2CuCO5,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Cu_pv', 'C', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Cu': 1.0, 'C': 1.0, 'O': 5.0}",GGA,mp-1198030,"['mp-1198030', 'mp-1200477', 'mp-1399692', 'mp-1742814', 'mp-1929945', 'mp-1655225']",0.000743875,"{'Sr': 8.0, 'Cu': 4.0, 'C': 4.0, 'O': 20.0}",475.08507610840775,[],NM,False,82,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.263088759540475e-06,0.000743875,0,0.0029755,MP,data/source/MP/cleaned/cifs/MP-mp-1198030.cif,True,,data/final/MP/graphs/B0.015C0.985Cu1Sr2O5-MP-mp-1198030-synth_doped.json,0,True,-4,0,0,0,0,2,0,0,0,0,1,0,1.0,False
Al0.3Ga0.7V3,3,0.0999999999999999,2.0,False,Al0.6Ga1.4V6,Al1Ga1V6,13.9,Other,True,Al7.5Ga17.5V75,Al-Ga-V,3,Supercon,Al0.3Ga0.7V3,MP-mp-1228807,Al1V6Ga1,Al-Ga-V,Al12.5Ga12.5V75,P m -3,cubic,4.799259,4.799259,4.799259,data/final/MP/cifs/Al0.3Ga0.7V3-MP-mp-1228807-synth_doped.cif,data/source/MP/raw/cifs/mp-1228807.cif,mp-1228807,0.0,,2019-01-13 04:28:37.659000,6.04413782018833,,,,0.0,6.03197746,520.0,-62.52669909,-7.81583738625,{'tags': []},-62.52669909,-7.81583738625,-0.1561988521874999,[],False,[],True,2021-05-12 11:01:01.648000,FM,8,2,mp-1228807,,AlV6Ga,"{'functional': 'PBE', 'labels': ['Al', 'V_pv', 'Ga_d'], 'pot_type': 'paw'}","{'Al': 1.0, 'V': 6.0, 'Ga': 1.0}",GGA,mp-1228807,"['mp-1228807', 'mp-1868775']",2.7611609,"{'Al': 1.0, 'V': 6.0, 'Ga': 1.0}",110.54078998635951,[],FM,True,200,1,"[0.0, 0.4, 0.4, 0.4, 0.4, 0.4, 0.4, 0.0]",0.02497866082141,2.7611609,6,2.7611609,MP,data/source/MP/cleaned/cifs/MP-mp-1228807.cif,True,,data/final/MP/graphs/Al0.3Ga0.7V3-MP-mp-1228807-synth_doped.json,0,True,m-3,2,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba0.157Cu1La1.843O4,3,0.0448571428571428,1.0,True,Ba0.157Cu1La1.843O4,Cu1La2O4,25.3,Cuprate,True,Ba2.243Cu14.286La26.329O57.142857142857146,Ba-Cu-La-O,4,Supercon,La1.843Ba0.157Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ba0.157Cu1La1.843O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ba0.157Cu1La1.843O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Cu1K0.08La1.92O4,2,0.0228571428571428,1.0,True,Cu1K0.08La1.92O4,Cu1La2O4,21.0,Cuprate,True,Cu14.286K1.143La27.429O57.142857142857146,Cu-K-La-O,4,Supercon,La1.92K0.08Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1K0.08La1.92O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1K0.08La1.92O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Co0.3Sc0.7,3,0.0666666666666666,6.0,False,Co1.8Sc4.2,Co2Sc4,0.35,Other,True,Co30Sc70,Co-Sc,2,Supercon,Co0.3Sc0.7,MP-mp-30562,Sc4Co2,Co-Sc,Co33.333Sc66.667,I 4/m c m,tetragonal,5.272609899873553,5.2726099,5.2726099,data/final/MP/cifs/Co0.3Sc0.7-MP-mp-30562-synth_doped.cif,data/source/MP/raw/cifs/mp-30562.cif,mp-30562,0.0,,2014-02-24 01:16:57,4.415786223151739,10.17188/1204954,"@misc{osti_1204954,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sc2Co (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1204954"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695556'}},0.0109378991666675,4.44988416,520.0,-41.11138879,-6.851898131666666,{'tags': ['Cobalt scandium (1/2)']},-41.11138879,-6.851898131666666,-0.2608127966666664,"['xas', 'elasticity', 'bandstructure']",True,"[102643, 624942, 624931]",True,2021-05-12 10:56:18.721000,NM,6,12,mp-30562,,Sc2Co,"{'functional': 'PBE', 'labels': ['Sc_sv', 'Co'], 'pot_type': 'paw'}","{'Sc': 2.0, 'Co': 1.0}",GGA,mp-30562,"['mp-928342', 'mp-928888', 'mp-912320', 'mp-30562', 'mp-1072941', 'mp-1072964', 'mp-1076942', 'mp-1077806', 'mp-1434420', 'mp-1695556', 'mp-1802541', 'mp-1592259']",0.0069484,"{'Sc': 4.0, 'Co': 2.0}",111.94516963817522,[],NM,False,140,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001241393446891,0.0069484,0,0.0138968,MP,data/source/MP/cleaned/cifs/MP-mp-30562.cif,True,,data/final/MP/graphs/Co0.3Sc0.7-MP-mp-30562-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Hf0.65N1Nb0.35,3,0.15,2.0,False,Hf1.3N2Nb0.7,Hf1N2Nb1,6.05,Other,True,Hf32.5N50Nb17.5,Hf-N-Nb,3,Supercon,Nb0.35Hf0.65N1,MP-mp-1224419,Hf1Nb1N2,Hf-N-Nb,Hf25N50Nb25,R -3 m,trigonal,3.1789064006174512,3.1789064006174512,5.51998619,data/final/MP/cifs/Hf0.65N1Nb0.35-MP-mp-1224419-synth_doped.cif,data/source/MP/raw/cifs/mp-1224419.cif,mp-1224419,0.0,,2019-01-13 00:40:18.234000,10.912650625559788,,,{'GGA': {'task_id': 'mp-1767998'}},0.0551133950000011,8.17866067,520.0,-42.14249665,-10.5356241625,{'tags': []},-42.14249665,-10.5356241625,-1.5332532274999997,['bandstructure'],True,[],True,2021-05-12 10:58:45.495000,NM,4,5,mp-1224419,,HfNbN2,"{'functional': 'PBE', 'labels': ['Hf_pv', 'Nb_pv', 'N'], 'pot_type': 'paw'}","{'Hf': 1.0, 'Nb': 1.0, 'N': 2.0}",GGA,mp-1224419,"['mp-1224419', 'mp-1415404', 'mp-1767998', 'mp-1792520', 'mp-1612274']",6.51e-05,"{'Hf': 1.0, 'Nb': 1.0, 'N': 2.0}",45.56011675546584,[],NM,False,166,0,"[0, 0, 0, 0]",1.4288813250723278e-06,6.51e-05,0,6.51e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1224419.cif,True,,data/final/MP/graphs/Hf0.65N1Nb0.35-MP-mp-1224419-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
B2Nb0.84,3,0.0751173708920188,1.0,True,B2Nb0.84,B2Nb1,9.1,Other,True,B70.423Nb29.577,B-Nb,2,Supercon,B2Nb0.84,MP-mp-450,Nb1B2,B-Nb,B66.667Nb33.333,P 6/m m m,hexagonal,3.1120839952382067,3.1120833,3.337463,data/final/MP/cifs/B2Nb0.84-MP-mp-450-synth_doped.cif,data/source/MP/raw/cifs/mp-450.cif,mp-450,0.0,,2011-05-12 17:50:32,6.793798027120384,10.17188/1208214,"@misc{osti_1208214,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbB2 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208214"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668420'}},0.0,8.5150746,520.0,-25.54163782,-8.513879273333332,{'tags': ['Niobium boride (1/2)']},-25.54163782,-8.513879273333332,-0.6938497461111103,"['xas', 'elasticity', 'bandstructure']",True,"[614908, 614900, 614887, 30421, 30328, 614889, 614902, 614904, 191901, 614894, 614884, 614892, 44457, 656214, 108068]",True,2021-05-12 10:56:20.740000,NM,3,18,mp-450,,NbB2,"{'functional': 'PBE', 'labels': ['Nb_pv', 'B'], 'pot_type': 'paw'}","{'Nb': 1.0, 'B': 2.0}",GGA,mp-450,"['mp-1000549', 'mp-1007025', 'mp-672219', 'mp-450', 'mp-1062058', 'mp-1062041', 'mp-1062083', 'mp-1062744', 'mp-1062870', 'mp-1062829', 'mp-1440923', 'mp-1668420', 'mp-1792772', 'mp-1011762', 'mp-1595532', 'mp-1592705', 'mp-1062075', 'mp-1062849']",0.0024194,"{'Nb': 1.0, 'B': 2.0}",27.99300898631796,[],NM,False,191,0,"[0, 0, 0]",8.642872229928986e-05,0.0024194,0,0.0024194,MP,data/source/MP/cleaned/cifs/MP-mp-450.cif,True,,data/final/MP/graphs/B2Nb0.84-MP-mp-450-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Cu2La1Nb1O8,1,0.0,2.0,False,Ba4Cu4La2Nb2O16,Ba4Cu4La2Nb2O16,0.0,Cuprate,True,Ba14.286Cu14.286La7.143Nb7.143O57.142857142857146,Ba-Cu-La-Nb-O,5,Supercon,La1Ba2Cu2Nb1O8,MP-mp-1214654,Ba4La2Nb2Cu4O16,Ba-Cu-La-Nb-O,Ba14.286Cu14.286La7.143Nb7.143O57.142857142857146,I 4/m c m,tetragonal,5.668500000741109,5.66850000074111,12.829132800000002,data/final/MP/cifs/Ba2Cu2La1Nb1O8-MP-mp-1214654.cif,data/source/MP/raw/cifs/mp-1214654.cif,mp-1214654,0.2363999999999997,,2019-01-12 16:27:40.701000,6.458764595957471,,,,0.0013355270535715,4.17004082,520.0,-197.78756134,-7.063841476428571,"{'tags': ['Ba2Cu2LaNbO8 tet2', 'high-Tc cuprate family', 'Ba2Cu2LaNbO8']}",-197.78756134,-7.063841476428571,-2.695173248928571,[],False,[],True,2021-05-12 11:00:37.845000,NM,28,3,mp-1214654,oxide,Ba2LaNb(CuO4)2,"{'functional': 'PBE', 'labels': ['Ba_sv', 'La', 'Nb_pv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'La': 1.0, 'Nb': 1.0, 'Cu': 2.0, 'O': 8.0}",GGA,mp-1214654,"['mp-1214654', 'mp-1345889', 'mp-1836936']",0.0012278,"{'Ba': 4.0, 'La': 2.0, 'Nb': 2.0, 'Cu': 4.0, 'O': 16.0}",391.5883825847706,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.2708704068063465e-06,0.0012278,0,0.0024556,MP,data/source/MP/cleaned/cifs/MP-mp-1214654.cif,False,,data/final/MP/graphs/Ba2Cu2La1Nb1O8-MP-mp-1214654.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B2C1Ho0.95Lu0.05Ni2,2,0.0166666666666666,1.0,True,B2C1Ho0.95Lu0.05Ni2,B2C1Ho1Ni2,8.77,Other,True,B33.333C16.667Ho15.833Lu0.833Ni33.333,B-C-Ho-Lu-Ni,5,Supercon,Ho0.95Lu0.05Ni2B2C1,MP-mp-6646,Ho1Ni2B2C1,B-C-Ho-Ni,B33.333C16.667Ho16.667Ni33.333,I 4/m m m,tetragonal,3.529863997734658,3.529863997734658,5.76032203,data/final/MP/cifs/B2C1Ho0.95Lu0.05Ni2-MP-mp-6646-synth_doped.cif,data/source/MP/raw/cifs/mp-6646.cif,mp-6646,0.0,,2011-05-13 04:24:09,8.11075125231065,10.17188/1281460,"@misc{osti_1281460,
    author = ""Persson, Kristin"",
    title = ""Materials Data on HoNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281460"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1670774'}},0.0,6.70981387,520.0,-41.84364575,-6.973940958333333,{'tags': ['Holmium dinickel diboride carbide']},-41.84364575,-6.973940958333333,-0.5192332130555558,"['xas', 'elasticity', 'bandstructure']",True,"[79064, 56650, 79065, 79062, 79063, 79575]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-6646,,HoNi2B2C,"{'functional': 'PBE', 'labels': ['Ho_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Ho': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6646,"['mp-1007146', 'mp-6646', 'mp-1000682', 'mp-1439301', 'mp-1670774', 'mp-1782657', 'mp-1011887', 'mp-1589032']",0.0032459,"{'Ho': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",64.68537905730652,[],NM,False,139,0,"[0.0, -0.0, -0.0, 0.0, 0.0, 0.0]",5.017980952271099e-05,0.0032459,0,0.0032459,MP,data/source/MP/cleaned/cifs/MP-mp-6646.cif,True,,data/final/MP/graphs/B2C1Ho0.95Lu0.05Ni2-MP-mp-6646-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B2C1Co0.14Ni1.86Y1,2,0.0466666666666666,1.0,True,B2C1Co0.14Ni1.86Y1,B2C1Ni2Y1,8.13,Other,True,B33.333C16.667Co2.333Ni31Y16.667,B-C-Co-Ni-Y,5,Supercon,Y1Ni1.86Co0.14B2C1,MP-mp-6576,Y1Ni2B2C1,B-C-Ni-Y,B33.333C16.667Ni33.333Y16.667,I 4/m m m,tetragonal,3.548790000501972,3.548790000501972,5.76144136,data/final/MP/cifs/B2C1Co0.14Ni1.86Y1-MP-mp-6576-synth_doped.cif,data/source/MP/raw/cifs/mp-6576.cif,mp-6576,0.0,,2011-05-13 05:21:43,6.099730998852292,10.17188/1281366,"@misc{osti_1281366,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281366"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688230'}},0.0,6.81083016,520.0,-43.677878,-7.279646333333333,{'tags': []},-43.677878,-7.279646333333333,-0.5109282141666659,"['xas', 'bandstructure']",True,"[75816, 89142, 83231, 79574, 41549]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6576,,YNi2B2C,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6576,"['mp-6576', 'mp-1007054', 'mp-1000583', 'mp-1439516', 'mp-1688230', 'mp-1794280', 'mp-1011792', 'mp-1597064']",0.0006603,"{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.3152437079014,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",1.010943177297096e-05,0.0006603,0,0.0006603,MP,data/source/MP/cleaned/cifs/MP-mp-6576.cif,True,,data/final/MP/graphs/B2C1Co0.14Ni1.86Y1-MP-mp-6576-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B0.9C1.1Lu1Ni1,2,0.05,2.0,False,B1.8C2.2Lu2Ni2,B2C2Lu2Ni2,2.9,Other,True,B22.5C27.5Lu25Ni25,B-C-Lu-Ni,4,Supercon,Lu1Ni1B0.9C1.1,MP-mp-6188,Lu2Ni2B2C2,B-C-Lu-Ni,B25C25Lu25Ni25,P 4/n m m,tetragonal,3.499459,3.499459,7.54108,data/final/MP/cifs/B0.9C1.1Lu1Ni1-MP-mp-6188-synth_doped.cif,data/source/MP/raw/cifs/mp-6188.cif,mp-6188,0.0,,2011-05-13 11:39:58,9.22360692471969,10.17188/1277950,"@misc{osti_1277950,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LuNiBC (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277950"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701902'}},0.0,5.56637243,520.0,-56.94584528,-7.11823066,{'tags': []},-56.94584528,-7.11823066,-0.5664157422916656,"['xas', 'bandstructure']",True,"[54041, 75610]",True,2021-05-12 10:57:28.836000,NM,8,8,mp-6188,,LuNiBC,"{'functional': 'PBE', 'labels': ['Lu_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Lu': 1.0, 'Ni': 1.0, 'B': 1.0, 'C': 1.0}",GGA,mp-6188,"['mp-6188', 'mp-1007095', 'mp-1000629', 'mp-1426768', 'mp-1701902', 'mp-1796435', 'mp-1011840', 'mp-1591367']",0.0004347,"{'Lu': 2.0, 'Ni': 2.0, 'B': 2.0, 'C': 2.0}",92.34967413717082,[],NM,False,129,0,"[0, 0, 0, 0, 0, 0, 0, 0]",9.414218383798992e-06,0.0004347,0,0.0008694,MP,data/source/MP/cleaned/cifs/MP-mp-6188.cif,True,,data/final/MP/graphs/B0.9C1.1Lu1Ni1-MP-mp-6188-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B2Nb0.7,3,0.1481481481481481,1.0,True,B2Nb0.7,B2Nb1,7.96,Other,True,B74.074Nb25.926,B-Nb,2,Supercon,B2Nb0.7,MP-mp-450,Nb1B2,B-Nb,B66.667Nb33.333,P 6/m m m,hexagonal,3.1120839952382067,3.1120833,3.337463,data/final/MP/cifs/B2Nb0.7-MP-mp-450-synth_doped.cif,data/source/MP/raw/cifs/mp-450.cif,mp-450,0.0,,2011-05-12 17:50:32,6.793798027120384,10.17188/1208214,"@misc{osti_1208214,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbB2 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208214"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668420'}},0.0,8.5150746,520.0,-25.54163782,-8.513879273333332,{'tags': ['Niobium boride (1/2)']},-25.54163782,-8.513879273333332,-0.6938497461111103,"['xas', 'elasticity', 'bandstructure']",True,"[614908, 614900, 614887, 30421, 30328, 614889, 614902, 614904, 191901, 614894, 614884, 614892, 44457, 656214, 108068]",True,2021-05-12 10:56:20.740000,NM,3,18,mp-450,,NbB2,"{'functional': 'PBE', 'labels': ['Nb_pv', 'B'], 'pot_type': 'paw'}","{'Nb': 1.0, 'B': 2.0}",GGA,mp-450,"['mp-1000549', 'mp-1007025', 'mp-672219', 'mp-450', 'mp-1062058', 'mp-1062041', 'mp-1062083', 'mp-1062744', 'mp-1062870', 'mp-1062829', 'mp-1440923', 'mp-1668420', 'mp-1792772', 'mp-1011762', 'mp-1595532', 'mp-1592705', 'mp-1062075', 'mp-1062849']",0.0024194,"{'Nb': 1.0, 'B': 2.0}",27.99300898631796,[],NM,False,191,0,"[0, 0, 0]",8.642872229928986e-05,0.0024194,0,0.0024194,MP,data/source/MP/cleaned/cifs/MP-mp-450.cif,True,,data/final/MP/graphs/B2Nb0.7-MP-mp-450-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Al2Gd0.003La0.997,2,0.002,2.0,False,Al4Gd0.006La1.994,Al4La2,1.89,Other,True,Al66.667Gd0.1La33.233,Al-Gd-La,3,Supercon,La0.997Gd0.003Al2,MP-mp-2694,La2Al4,Al-La,Al66.667La33.333,F d -3 m,cubic,5.75810346,5.75810346,5.75810346,data/final/MP/cifs/Al2Gd0.003La0.997-MP-mp-2694-synth_doped.cif,data/source/MP/raw/cifs/mp-2694.cif,mp-2694,0.0,,2011-05-12 21:07:48,4.744791242841679,10.17188/1201263,"@misc{osti_1201263,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaAl2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201263"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686658'}},0.0,8.10972418,520.0,-27.8605497,-4.64342495,{'tags': ['Aluminium lanthanum (2/1)']},-27.8605497,-4.64342495,-0.5010386950000001,"['xas', 'elasticity', 'bandstructure']",True,"[608275, 608277, 608265, 608290, 608288, 57933, 608270, 608269, 603920, 608272, 608286, 608273, 608289, 604450, 608266]",True,2021-05-12 10:56:18.721000,NM,6,10,mp-2694,,LaAl2,"{'functional': 'PBE', 'labels': ['La', 'Al'], 'pot_type': 'paw'}","{'La': 1.0, 'Al': 2.0}",GGA,mp-2694,"['mp-940230', 'mp-925817', 'mp-940644', 'mp-2694', 'mp-1258643', 'mp-1440554', 'mp-1686658', 'mp-1787219', 'mp-1596037', 'mp-1594760']",0.0008869,"{'La': 2.0, 'Al': 4.0}",134.99677475891534,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",1.3139573172527638e-05,0.0008869,0,0.0017738,MP,data/source/MP/cleaned/cifs/MP-mp-2694.cif,True,,data/final/MP/graphs/Al2Gd0.003La0.997-MP-mp-2694-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ni21Zr79,3,0.08,0.0759508740204942,False,Ni1.595Zr6,Ni2Zr6,3.06,Other,True,Ni21Zr79,Ni-Zr,2,Supercon,Ni21Zr79,MP-mp-1188073,Zr6Ni2,Ni-Zr,Ni25Zr75,P 63/m m c,hexagonal,4.896295,6.064418005027057,6.06441883,data/final/MP/cifs/Ni21Zr79-MP-mp-1188073-synth_doped.cif,data/source/MP/raw/cifs/mp-1188073.cif,mp-1188073,0.0,,2019-01-11 15:34:08.753000,7.07812709883652,,,{'GGA': {'task_id': 'mp-1730307'}},0.2678923887499991,4.81016384,520.0,-62.64172784,-7.83021598,{'tags': []},-62.64172784,-7.83021598,0.0255936624999986,['bandstructure'],True,[],True,2021-05-12 10:58:31.620000,NM,8,5,mp-1188073,,Zr3Ni,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Ni_pv'], 'pot_type': 'paw'}","{'Zr': 3.0, 'Ni': 1.0}",GGA,mp-1188073,"['mp-1188073', 'mp-1399727', 'mp-1730307', 'mp-1929912', 'mp-1619498']",0.00082625,"{'Zr': 6.0, 'Ni': 2.0}",155.94682700084778,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.0596560582736426e-05,0.00082625,0,0.0016525,MP,data/source/MP/cleaned/cifs/MP-mp-1188073.cif,True,,data/final/MP/graphs/Ni21Zr79-MP-mp-1188073-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ce1Co0.1In5Rh0.9,2,0.0285714285714285,1.0,True,Ce1Co0.1In5Rh0.9,Ce1In5Rh1,0.0,Heavy_fermion,True,Ce14.286Co1.429In71.429Rh12.857,Ce-Co-In-Rh,4,Supercon,Ce1Rh0.9Co0.1In5,MP-mp-20294,Ce1In5Rh1,Ce-In-Rh,Ce14.286In71.429Rh14.286,P 4/m m m,tetragonal,4.709358,4.709358,7.592679,data/final/MP/cifs/Ce1Co0.1In5Rh0.9-MP-mp-20294-synth_doped.cif,data/source/MP/raw/cifs/mp-20294.cif,mp-20294,0.0,,2015-11-23 15:12:00,8.05771622389016,10.17188/1195421,"@misc{osti_1195421,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeIn5Rh (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195421"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701496'}},0.0,7.74909127,520.0,-30.04466451,-4.29209493,"{'tags': ['High pressure experimental phase', 'Cerium rhodium indium (1/1/5) - HP', 'Cerium rhodium indide (1/1/5)']}",-30.04466451,-4.29209493,-0.4269784049999998,"['xas', 'bandstructure']",True,"[150226, 110780, 110777, 110779, 110778]",True,2021-05-12 10:56:57.051000,FM,7,8,mp-20294,,CeIn5Rh,"{'functional': 'PBE', 'labels': ['Ce', 'In_d', 'Rh_pv'], 'pot_type': 'paw'}","{'Ce': 1.0, 'In': 5.0, 'Rh': 1.0}",GGA,mp-20294,"['mp-986842', 'mp-988024', 'mp-1430916', 'mp-1701496', 'mp-1780117', 'mp-988278', 'mp-1588425', 'mp-20294']",0.0607598,"{'Ce': 1.0, 'In': 5.0, 'Rh': 1.0}",168.39083554410138,[],FM,True,123,1,"[0.1, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0003608260497293,0.0607598,1,0.0607598,MP,data/source/MP/cleaned/cifs/MP-mp-20294.cif,True,,data/final/MP/graphs/Ce1Co0.1In5Rh0.9-MP-mp-20294-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Rh0.1Si1.9Th1,3,0.0666666666666667,1.0,True,Rh0.1Si1.9Th1,Si2Th1,2.15,Other,True,Rh3.333Si63.333Th33.333,Rh-Si-Th,3,Supercon,Th1Rh0.1Si1.9,MP-mp-7497,Th1Si2,Si-Th,Si66.667Th33.333,P 6/m m m,hexagonal,4.124678003560693,4.12467893,4.168382,data/final/MP/cifs/Rh0.1Si1.9Th1-MP-mp-7497-synth_doped.cif,data/source/MP/raw/cifs/mp-7497.cif,mp-7497,0.0,,2011-05-27 17:09:08,7.792527656352213,10.17188/1288497,"@misc{osti_1288497,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ThSi2 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1288497"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688045'}},0.0,8.78875238,520.0,-20.12426593,-6.708088643333333,"{'tags': ['Thorium silicide (1/2)', 'Thorium silicide (1/2) - beta']}",-20.12426593,-6.708088643333333,-0.5725932133333332,"['bandstructure', 'elasticity']",True,"[15449, 26569]",True,2021-05-12 10:56:29.056000,NM,3,11,mp-7497,,ThSi2,"{'functional': 'PBE', 'labels': ['Th', 'Si'], 'pot_type': 'paw'}","{'Th': 1.0, 'Si': 2.0}",GGA,mp-7497,"['mp-908777', 'mp-924352', 'mp-923780', 'mp-7497', 'mp-1125064', 'mp-1138240', 'mp-1248167', 'mp-1439624', 'mp-1688045', 'mp-1783814', 'mp-1593505']",0.0013608,"{'Th': 1.0, 'Si': 2.0}",61.41555405169961,[],NM,False,191,0,"[0, 0, 0]",2.2157253500546107e-05,0.0013608,0,0.0013608,MP,data/source/MP/cleaned/cifs/MP-mp-7497.cif,True,,data/final/MP/graphs/Rh0.1Si1.9Th1-MP-mp-7497-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Hf0.87Mo0.13,3,0.1399999999999999,10.0,False,Hf8.7Mo1.3,Hf8Mo2,2.6,Other,True,Hf87Mo13,Hf-Mo,2,Supercon,Hf0.87Mo0.13,MP-mp-1212251,Hf8Mo2,Hf-Mo,Hf80Mo20,F d -3 m,cubic,6.9826229,6.982622899999999,6.9826229,data/final/MP/cifs/Hf0.87Mo0.13-MP-mp-1212251-synth_doped.cif,data/source/MP/raw/cifs/mp-1212251.cif,mp-1212251,0.0,,2019-01-12 14:28:20.330000,11.172998117034384,,,,1.0408028685,4.35760682,520.0,-91.45346281,-9.145346281,"{'tags': ['MgCu2', 'HfMo2 rt', 'Friauf-Laves phase, Frank-Kasper phase']}",-91.45346281,-9.145346281,0.9895334049999988,[],False,[],True,2021-05-12 11:00:28.874000,NM,10,2,mp-1212251,,Hf4Mo,"{'functional': 'PBE', 'labels': ['Hf_pv', 'Mo_pv'], 'pot_type': 'paw'}","{'Hf': 4.0, 'Mo': 1.0}",GGA,mp-1212251,"['mp-1212251', 'mp-1867039']",0.002263,"{'Hf': 8.0, 'Mo': 2.0}",240.73584832864984,[],NM,False,227,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0]",1.8800689766075704e-05,0.002263,0,0.004526,MP,data/source/MP/cleaned/cifs/MP-mp-1212251.cif,True,,data/final/MP/graphs/Hf0.87Mo0.13-MP-mp-1212251-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Cd0.18Sn0.72,3,0.1,4.166666666666667,False,Cd0.75Sn3,Cd1Sn3,3.65,Other,True,Cd20Sn80,Cd-Sn,2,Supercon,Cd0.18Sn0.72,MP-mp-1183720,Cd1Sn3,Cd-Sn,Cd25Sn75,I 4/m m m,tetragonal,4.5322259966596485,4.5322259966596485,6.167401279999999,data/final/MP/cifs/Cd0.18Sn0.72-MP-mp-1183720-synth_doped.cif,data/source/MP/raw/cifs/mp-1183720.cif,mp-1183720,0.0,,2019-01-11 12:14:13.493000,7.188107402865962,,,{'GGA': {'task_id': 'mp-1760544'}},0.0722525387499999,6.54411466,520.0,-12.66259517,-3.1656487925,{'tags': []},-12.66259517,-3.1656487925,0.0722525387499999,['bandstructure'],True,[],True,2021-05-12 10:58:25.879000,NM,4,5,mp-1183720,,CdSn3,"{'functional': 'PBE', 'labels': ['Cd', 'Sn_d'], 'pot_type': 'paw'}","{'Cd': 1.0, 'Sn': 3.0}",GGA,mp-1183720,"['mp-1183720', 'mp-1433681', 'mp-1760544', 'mp-1864345', 'mp-1613740']",0.0002476,"{'Cd': 1.0, 'Sn': 3.0}",108.23859344305606,[],NM,False,139,0,"[0, 0, 0, 0]",2.287538964835694e-06,0.0002476,0,0.0002476,MP,data/source/MP/cleaned/cifs/MP-mp-1183720.cif,True,,data/final/MP/graphs/Cd0.18Sn0.72-MP-mp-1183720-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ru1Si1Ta1,1,0.0,6.0,False,Ru6Si6Ta6,Ru6Si6Ta6,3.15,Other,True,Ru33.333Si33.333Ta33.333,Ru-Si-Ta,3,Supercon,Ta1Ru1Si1,MP-mp-1189212,Ta6Si6Ru6,Ru-Si-Ta,Ru33.333Si33.333Ta33.333,I m a 2,orthorhombic,6.513405999769664,7.44236331022901,7.333535999119923,data/final/MP/cifs/Ru1Si1Ta1-MP-mp-1189212.cif,data/source/MP/raw/cifs/mp-1189212.cif,mp-1189212,0.0,,2019-01-11 20:01:27.675000,11.55455718853079,,,{'GGA': {'task_id': 'mp-1669590'}},0.0,8.54454949,520.0,-170.97319944,-9.49851108,{'tags': ['Tantalum ruthenium silicide (1/1/1)']},-170.97319944,-9.49851108,-0.6460173116666665,['bandstructure'],True,[600058],True,2021-05-12 10:58:33.577000,NM,18,4,mp-1189212,,TaSiRu,"{'functional': 'PBE', 'labels': ['Ta_pv', 'Si', 'Ru_pv'], 'pot_type': 'paw'}","{'Ta': 1.0, 'Si': 1.0, 'Ru': 1.0}",GGA,mp-1189212,"['mp-1189212', 'mp-1414464', 'mp-1669590', 'mp-1603401']",4.033333333333333e-06,"{'Ta': 6.0, 'Si': 6.0, 'Ru': 6.0}",267.39515955791376,[],NM,False,46,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",9.050276018462724e-08,4.033333333333333e-06,0,2.42e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1189212.cif,False,,data/final/MP/graphs/Ru1Si1Ta1-MP-mp-1189212.json,0,True,mm2,0,0,0,6,0,0,0,0,0,1,0,1.0,False
Ga6Tb1,1,0.0,2.0,False,Ga12Tb2,Ga12Tb2,2.5,Other,True,Ga85.714Tb14.286,Ga-Tb,2,Supercon,Ga6Tb1,MP-mp-1104458,Tb2Ga12,Ga-Tb,Ga85.714Tb14.286,P 4/n b m,tetragonal,6.017784,6.017784,7.570965,data/final/MP/cifs/Ga6Tb1-MP-mp-1104458.cif,data/source/MP/raw/cifs/mp-1104458.cif,mp-1104458,0.0,,2018-07-18 22:05:25,6.992438404786926,,,{'GGA': {'task_id': 'mp-1705776'}},0.0010856996428576,3.86040206,520.0,-49.92175588,-3.5658397057142857,{'tags': ['Terbium gallide (1/6)']},-49.92175588,-3.5658397057142857,-0.3082765292857137,['bandstructure'],True,[635498],True,2021-05-12 10:58:20.361000,NM,14,4,mp-1104458,,TbGa6,"{'functional': 'PBE', 'labels': ['Tb_3', 'Ga_d'], 'pot_type': 'paw'}","{'Tb': 1.0, 'Ga': 6.0}",GGA,mp-1104458,"['mp-1104458', 'mp-1504235', 'mp-1705776', 'mp-1599424']",1.135e-05,"{'Tb': 2.0, 'Ga': 12.0}",274.1728389727871,[],NM,False,125,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",8.279448863369387e-08,1.135e-05,0,2.27e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1104458.cif,False,,data/final/MP/graphs/Ga6Tb1-MP-mp-1104458.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ir0.815Rh0.185,3,0.1299999999999999,4.0,False,Ir3.26Rh0.74,Ir3Rh1,0.028,Other,True,Ir81.5Rh18.5,Ir-Rh,2,Supercon,Ir0.815Rh0.185,MP-mp-1184771,Ir3Rh1,Ir-Rh,Ir75Rh25,P m -3 m,cubic,3.869173,3.869173,3.869173,data/final/MP/cifs/Ir0.815Rh0.185-MP-mp-1184771-synth_doped.cif,data/source/MP/raw/cifs/mp-1184771.cif,mp-1184771,0.0,,2019-01-11 13:02:54.339000,19.48140265952555,,,{'GGA': {'task_id': 'mp-1733856'}},0.0094591199999989,9.11965125,520.0,-33.92588706,-8.481471765,{'tags': []},-33.92588706,-8.481471765,-0.0115719825000013,['bandstructure'],True,[],True,2021-05-12 10:58:27.755000,NM,4,5,mp-1184771,,Ir3Rh,"{'functional': 'PBE', 'labels': ['Ir', 'Rh_pv'], 'pot_type': 'paw'}","{'Ir': 3.0, 'Rh': 1.0}",GGA,mp-1184771,"['mp-1184771', 'mp-1415898', 'mp-1733856', 'mp-1795000', 'mp-1618109']",0.0007013,"{'Ir': 3.0, 'Rh': 1.0}",57.92345325095008,[],NM,False,221,0,"[0, 0, 0, 0]",1.2107358257140806e-05,0.0007013,0,0.0007013,MP,data/source/MP/cleaned/cifs/MP-mp-1184771.cif,True,,data/final/MP/graphs/Ir0.815Rh0.185-MP-mp-1184771-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Ca1Cu2Hg1O6.13,2,0.010717230008244,0.978958564437194,True,Ba1.958Ca0.979Cu1.958Hg0.979O6,Ba2Ca1Cu2Hg1O6,102.0,Cuprate,True,Ba16.488Ca8.244Cu16.488Hg8.244O50.53586150041221,Ba-Ca-Cu-Hg-O,5,Supercon,Hg1Ba2Ca1Cu2O6.13,MP-mp-6879,Ba2Ca1Cu2Hg1O6,Ba-Ca-Cu-Hg-O,Ba16.667Ca8.333Cu16.667Hg8.333O50,P 4/m m m,tetragonal,3.904834,3.904834,13.058604,data/final/MP/cifs/Ba2Ca1Cu2Hg1O6.13-MP-mp-6879-synth_doped.cif,data/source/MP/raw/cifs/mp-6879.cif,mp-6879,0.0,,2011-05-14 23:17:39,6.158075338837193,10.17188/1284432,"@misc{osti_1284432,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2CaCu2HgO6 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1284432"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698891'}},0.017586347638888,3.04291167,520.0,-64.08791228,-5.3406593566666665,"{'tags': ['High pressure experimental phase', 'Mercury dibarium calcium dicopper oxide', 'Mercury barium calcium copper oxide (1/2/1/2/6)']}",-64.08791228,-5.3406593566666665,-2.0147092504166664,"['bandstructure', 'elasticity']",True,"[83087, 75729, 75727, 75726, 75725, 75728]",True,2021-05-12 10:56:27.046000,NM,12,12,mp-6879,oxide,Ba2CaCu2HgO6,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ca_sv', 'Cu_pv', 'Hg', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Hg': 1.0, 'O': 6.0}",GGA,mp-6879,"['mp-917434', 'mp-924375', 'mp-6879', 'mp-923788', 'mvc-16307', 'mp-1045026', 'mp-1045039', 'mp-1422313', 'mp-1698891', 'mp-1833979', 'mp-1592102', 'mp-1045044']",0.0305618,"{'Ba': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Hg': 1.0, 'O': 6.0}",199.11404926320108,[],NM,False,123,0,"[0.0, 0.0, 0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001534889181004,0.0305618,0,0.0305618,MP,data/source/MP/cleaned/cifs/MP-mp-6879.cif,True,,data/final/MP/graphs/Ba2Ca1Cu2Hg1O6.13-MP-mp-6879-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Bi2Cu1La0.3Sr1.7O6,3,0.0545454545454545,2.0,False,Bi4Cu2La0.6Sr3.4O12,Bi4Cu2Sr4O12,30.0,Cuprate,True,Bi18.182Cu9.091La2.727Sr15.455O54.54545454545455,Bi-Cu-La-Sr-O,5,Supercon,Bi2Sr1.7La0.3Cu1O6,MP-mp-555827,Sr4Cu2Bi4O12,Bi-Cu-Sr-O,Bi18.182Cu9.091Sr18.182O54.54545454545455,C c c m,orthorhombic,5.133052,5.52519599964684,13.01880065,data/final/MP/cifs/Bi2Cu1La0.3Sr1.7O6-MP-mp-555827-synth_doped.cif,data/source/MP/raw/cifs/mp-555827.cif,mp-555827,0.0,,2014-02-22 10:13:35,6.928457216674172,10.17188/1269010,"@misc{osti_1269010,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr2Cu(BiO3)2 (SG:66) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1269010"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1707731'}},0.0585641377272736,4.75363105,520.0,-126.5422218,-5.7519191727272725,{'tags': ['Dibismuth distrontium copper hexaoxide']},-126.5422218,-5.7519191727272725,-2.0406438793939388,"['xas', 'bandstructure']",True,[67426],True,2021-05-12 10:57:17.297000,NM,22,8,mp-555827,oxide,Sr2Cu(BiO3)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Cu': 1.0, 'Bi': 2.0, 'O': 6.0}",GGA,mp-555827,"['mp-932594', 'mp-931549', 'mp-918058', 'mp-555827', 'mp-1418436', 'mp-1707731', 'mp-1837530', 'mp-1605675']",0.00627605,"{'Sr': 4.0, 'Cu': 2.0, 'Bi': 4.0, 'O': 12.0}",360.8189966762927,[],NM,False,66,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",3.478780251490214e-05,0.00627605,0,0.0125521,MP,data/source/MP/cleaned/cifs/MP-mp-555827.cif,True,,data/final/MP/graphs/Bi2Cu1La0.3Sr1.7O6-MP-mp-555827-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Cu1Sr2Tl1O5,1,0.0,1.0,True,Cu1Sr2Tl1O5,Cu1Sr2Tl1O5,0.0,Cuprate,True,Cu11.111Sr22.222Tl11.111O55.55555555555556,Cu-Sr-Tl-O,4,Supercon,Tl1Sr2Cu1O5,MP-mp-620290,Sr2Tl1Cu1O5,Cu-Sr-Tl-O,Cu11.111Sr22.222Tl11.111O55.55555555555556,P 4/m m m,tetragonal,3.740781,3.740781,9.120042,data/final/MP/cifs/Cu1Sr2Tl1O5-MP-mp-620290.cif,data/source/MP/raw/cifs/mp-620290.cif,mp-620290,0.0,,2013-06-10 20:36:13,6.807183418489958,10.17188/1278018,"@misc{osti_1278018,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr2TlCuO5 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278018"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688212'}},0.0150626706944256,2.9352323,520.0,-49.02279836,-5.446977595555556,{'tags': []},-49.02279836,-5.446977595555556,-1.98635073462963,"['xas', 'elasticity', 'bandstructure']",True,[],True,2021-05-12 10:56:27.046000,NM,9,11,mp-620290,oxide,Sr2TlCuO5,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Tl_d', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Tl': 1.0, 'Cu': 1.0, 'O': 5.0}",GGA,mp-620290,"['mp-931763', 'mp-662520', 'mp-620290', 'mp-937195', 'mp-916489', 'mp-1079736', 'mp-1179105', 'mp-1300946', 'mp-1688212', 'mp-1805203', 'mp-1590970']",0.0238853,"{'Sr': 2.0, 'Tl': 1.0, 'Cu': 1.0, 'O': 5.0}",127.6207832330289,[],NM,False,123,0,"[0.0, 0.0, 0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001871583874891,0.0238853,0,0.0238853,MP,data/source/MP/cleaned/cifs/MP-mp-620290.cif,False,,data/final/MP/graphs/Cu1Sr2Tl1O5-MP-mp-620290.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ba2Cu3Ho0.1Pr0.9O7,2,0.0153846153846153,1.0,True,Ba2Cu3Ho0.1Pr0.9O7,Ba2Cu3Pr1O7,0.0,Cuprate,True,Ba15.385Cu23.077Ho0.769Pr6.923O53.84615384615385,Ba-Cu-Ho-Pr-O,5,Supercon,Ho0.1Pr0.9Ba2Cu3O7,MP-mp-20936,Ba2Pr1Cu3O7,Ba-Cu-Pr-O,Ba15.385Cu23.077Pr7.692O53.84615384615385,P m m m,orthorhombic,3.903923,3.95568,11.916432,data/final/MP/cifs/Ba2Cu3Ho0.1Pr0.9O7-MP-mp-20936-synth_doped.cif,data/source/MP/raw/cifs/mp-20936.cif,mp-20936,0.0,,2014-02-22 14:41:55,6.480717836004672,10.17188/1196129,"@misc{osti_1196129,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2PrCu3O7 (SG:47) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196129"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698257'}},0.0256000172756332,3.18514576,520.0,-78.62827906,-6.048329158461538,"{'tags': ['Dibarium praseodymium tricopper heptaoxide', 'Praseodymium dibarium dicopper copper(III) oxide', 'Praseodymium dibarium tricopper heptaoxide', 'Praseodymium dibarium copper(III) dicopper oxide']}",-78.62827906,-6.048329158461538,-2.145007016153845,"['xas', 'bandstructure']",True,"[41452, 94377, 81168, 173910, 89221]",True,2021-05-12 10:56:57.051000,NM,13,8,mp-20936,oxide,Ba2PrCu3O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Pr_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Pr': 1.0, 'Cu': 3.0, 'O': 7.0}",GGA,mp-20936,"['mp-988090', 'mp-987725', 'mp-20936', 'mp-1417367', 'mp-1698257', 'mp-1833655', 'mp-988324', 'mp-1602318']",0.0007234,"{'Ba': 2.0, 'Pr': 1.0, 'Cu': 3.0, 'O': 7.0}",184.02152853403555,[],NM,False,47,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.931061793491212e-06,0.0007234,0,0.0007234,MP,data/source/MP/cleaned/cifs/MP-mp-20936.cif,True,,data/final/MP/graphs/Ba2Cu3Ho0.1Pr0.9O7-MP-mp-20936-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Bi2Ca0.9Cu2Er0.1Sr2O8,2,0.0133333333333333,2.0,False,Bi4Ca1.8Cu4Er0.2Sr4O16,Bi4Ca2Cu4Sr4O16,87.0,Cuprate,True,Bi13.333Ca6Cu13.333Er0.667Sr13.333O53.333333333333336,Bi-Ca-Cu-Er-Sr-O,6,Supercon,Bi2Sr2Ca0.9Er0.1Cu2O8,MP-mp-1218930,Sr4Ca2Cu4Bi4O16,Bi-Ca-Cu-Sr-O,Bi13.333Ca6.667Cu13.333Sr13.333O53.333333333333336,C c c 2,orthorhombic,5.417115,5.472898000129128,16.11398919,data/final/MP/cifs/Bi2Ca0.9Cu2Er0.1Sr2O8-MP-mp-1218930-synth_doped.cif,data/source/MP/raw/cifs/mp-1218930.cif,mp-1218930,0.0,,2019-01-12 20:01:06.544000,6.266668983881059,,,,0.039252223722225,4.51768334,520.0,-173.15021002,-5.771673667333333,{'tags': []},-173.15021002,-5.771673667333333,-2.074956548222222,[],False,[],True,2021-05-12 11:00:42.526000,NM,30,3,mp-1218930,oxide,Sr2CaCu2(BiO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",GGA,mp-1218930,"['mp-1218930', 'mp-1359698', 'mp-1817714']",0.00011165,"{'Sr': 4.0, 'Ca': 2.0, 'Cu': 4.0, 'Bi': 4.0, 'O': 16.0}",470.7976286073367,[],NM,False,37,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.743014544498498e-07,0.00011165,0,0.0002233,MP,data/source/MP/cleaned/cifs/MP-mp-1218930.cif,True,,data/final/MP/graphs/Bi2Ca0.9Cu2Er0.1Sr2O8-MP-mp-1218930-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
B2C1Ni2Tb0.7Y0.3,3,0.1,1.0,True,B2C1Ni2Tb0.7Y0.3,B2C1Ni2Tb1,0.0,Other,True,B33.333C16.667Ni33.333Tb11.667Y5,B-C-Ni-Tb-Y,5,Supercon,Y0.3Tb0.7Ni2B2C1,MP-mp-6092,Tb1Ni2B2C1,B-C-Ni-Tb,B33.333C16.667Ni33.333Tb16.667,I 4/m m m,tetragonal,3.5665140003823987,3.5665140003823987,5.7333997100000005,data/final/MP/cifs/B2C1Ni2Tb0.7Y0.3-MP-mp-6092-synth_doped.cif,data/source/MP/raw/cifs/mp-6092.cif,mp-6092,0.0,,2011-05-13 04:21:03,7.858244682564482,10.17188/1277657,"@misc{osti_1277657,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TbNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277657"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686417'}},0.0,6.76233636,520.0,-41.85355222,-6.975592036666666,{'tags': []},-41.85355222,-6.975592036666666,-0.5122247530555543,"['xas', 'elasticity', 'bandstructure']",True,"[89159, 89157, 79572, 56648, 89155, 89156, 89160, 89158]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-6092,,TbNi2B2C,"{'functional': 'PBE', 'labels': ['Tb_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Tb': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6092,"['mp-1007320', 'mp-1000865', 'mp-6092', 'mp-1440112', 'mp-1686417', 'mp-1793943', 'mp-1012059', 'mp-1590555']",0.0029604,"{'Tb': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.4949740949675,[],NM,False,139,0,"[-0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",4.520041485484718e-05,0.0029604,0,0.0029604,MP,data/source/MP/cleaned/cifs/MP-mp-6092.cif,True,,data/final/MP/graphs/B2C1Ni2Tb0.7Y0.3-MP-mp-6092-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ba1Cu1Gd2O5,1,0.0,4.0,False,Ba4Cu4Gd8O20,Ba4Cu4Gd8O20,0.0,Cuprate,True,Ba11.111Cu11.111Gd22.222O55.55555555555556,Ba-Cu-Gd-O,4,Supercon,Gd2Ba1Cu1O5,MP-mp-1182677,Ba4Gd8Cu4O20,Ba-Cu-Gd-O,Ba11.111Cu11.111Gd22.222O55.55555555555556,P n m a,orthorhombic,5.767158,7.337294,12.376706,data/final/MP/cifs/Ba1Cu1Gd2O5-MP-mp-1182677.cif,data/source/MP/raw/cifs/mp-1182677.cif,mp-1182677,0.3772999999999999,,2019-01-11 11:24:45.274000,7.550803880603818,,,,0.0258974052777869,3.20677901,520.0,-330.74828693,-9.187452414722223,"{'tags': ['Digadolinium barium copper oxide', 'BaCuGd2O5', 'BaCuY2O5', 'Barium copper digadolinium oxide']}",-330.74828693,-9.187452414722223,-3.0235383030555565,[],False,"[32708, 68376]",True,2021-05-12 10:59:50.205000,FiM,36,3,mp-1182677,oxide,BaGd2CuO5,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Gd', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Gd': 2.0, 'Cu': 1.0, 'O': 5.0}",GGA,mp-1182677,"['mp-1182677', 'mp-1197001', 'mp-1981969']",12.99999975,"{'Ba': 4.0, 'Gd': 8.0, 'Cu': 4.0, 'O': 20.0}",523.7244456162902,[],FiM,True,62,3,"[0.0, 0.0, 0.0, 0.0, 6.9, 6.9, 6.9, 6.9, 6.9, 6.9, 6.9, 6.9, -0.5, -0.5, -0.5, -0.5, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.099288852058088,12.99999975,12,51.999999,MP,data/source/MP/cleaned/cifs/MP-mp-1182677.cif,False,,data/final/MP/graphs/Ba1Cu1Gd2O5-MP-mp-1182677.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
B2Ru1Y1,1,0.0,4.0,False,B8Ru4Y4,B8Ru4Y4,7.7,Other,True,B50Ru25Y25,B-Ru-Y,3,Supercon,Y1Ru1B2,MP-mp-1188195,Y4B8Ru4,B-Ru-Y,B50Ru25Y25,P n m a,orthorhombic,5.326399,5.924459,6.362677,data/final/MP/cifs/B2Ru1Y1-MP-mp-1188195.cif,data/source/MP/raw/cifs/mp-1188195.cif,mp-1188195,0.0,,2019-01-11 19:15:33.337000,7.000000449478844,,,,0.0,6.19814435,520.0,-125.97096122,-7.87318507625,"{'tags': ['Yttrium ruthenium boride (1/1/2)', 'LuRuB2', 'YRuB2']}",-125.97096122,-7.87318507625,-0.5982739987499999,[],False,[615399],True,2021-05-12 10:59:52.436000,NM,16,3,mp-1188195,,YB2Ru,"{'functional': 'PBE', 'labels': ['Y_sv', 'B', 'Ru_pv'], 'pot_type': 'paw'}","{'Y': 1.0, 'B': 2.0, 'Ru': 1.0}",GGA,mp-1188195,"['mp-1188195', 'mp-1834131', 'mp-1982221']",0.001016,"{'Y': 4.0, 'B': 8.0, 'Ru': 4.0}",200.7808421553609,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.024097496739925e-05,0.001016,0,0.004064,MP,data/source/MP/cleaned/cifs/MP-mp-1188195.cif,False,,data/final/MP/graphs/B2Ru1Y1-MP-mp-1188195.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
C1V2,1,0.0,4.0,False,C4V8,C4V8,0.0,Other,True,C33.333V66.667,C-V,2,Supercon,C1V2,MP-mp-20648,V8C4,C-V,C33.333V66.667,P b c n,orthorhombic,4.556936,5.043075,5.733799,data/final/MP/cifs/C1V2-MP-mp-20648.cif,data/source/MP/raw/cifs/mp-20648.cif,mp-20648,0.0,,2014-02-22 08:48:12,5.74113778580138,10.17188/1195779,"@misc{osti_1195779,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V2C (SG:60) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195779"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701177'}},0.0,6.35126599,520.0,-115.23670049,-9.603058374166666,"{'tags': ['Vanadium carbide (2/1)', 'Vanadium carbide (1/2)']}",-115.23670049,-9.603058374166666,-0.4715274274999999,"['xas', 'elasticity', 'bandstructure']",True,"[601748, 9965, 9982, 108192]",True,2021-05-12 10:56:14.760000,NM,12,8,mp-20648,,V2C,"{'functional': 'PBE', 'labels': ['V_pv', 'C'], 'pot_type': 'paw'}","{'V': 2.0, 'C': 1.0}",GGA,mp-20648,"['mp-923194', 'mp-907884', 'mp-922414', 'mp-20648', 'mp-1428740', 'mp-1701177', 'mp-1932427', 'mp-1593244']",0.000418175,"{'V': 8.0, 'C': 4.0}",131.76826290938516,[],NM,False,60,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.2694255529119998e-05,0.000418175,0,0.0016727,MP,data/source/MP/cleaned/cifs/MP-mp-20648.cif,False,,data/final/MP/graphs/C1V2-MP-mp-20648.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Si0.8Sn0.2V3,3,0.0999999999999999,2.0,False,Si1.6Sn0.4V6,Si2V6,12.85,Other,True,Si20Sn5V75,Si-Sn-V,3,Supercon,V3Si0.8Sn0.2,MP-mp-2567,V6Si2,Si-V,Si25V75,P m -3 n,cubic,4.702381,4.702381,4.702381,data/final/MP/cifs/Si0.8Sn0.2V3-MP-mp-2567-synth_doped.cif,data/source/MP/raw/cifs/mp-2567.cif,mp-2567,0.0,,2011-05-13 19:15:43,5.778142190030859,10.17188/1200874,"@misc{osti_1200874,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Si (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1200874"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668672'}},0.0,7.30599425,520.0,-69.05773321,-8.63221665125,{'tags': ['Vanadium silicide (3/1)']},-69.05773321,-8.63221665125,-0.4452085937499994,"['xas', 'elasticity', 'bandstructure']",True,"[652491, 87328, 652522, 652502, 652510, 652520, 600518, 186003, 652507, 652513, 652497, 601150, 652514, 652487, 22412, 652509, 652529, 652532, 652499, 652539, 652537, 652533, 652512, 652538, 652490, 652493, 652494, 652511, 652519, 87329, 652526, 652500]",True,2021-05-12 10:56:18.721000,FM,8,13,mp-2567,,V3Si,"{'functional': 'PBE', 'labels': ['V_pv', 'Si'], 'pot_type': 'paw'}","{'V': 3.0, 'Si': 1.0}",GGA,mp-2567,"['mp-920081', 'mp-906309', 'mp-919083', 'mp-2567', 'mp-1078474', 'mp-1078852', 'mp-1138781', 'mp-1145907', 'mp-1440678', 'mp-1668672', 'mp-1795955', 'mp-1593554', 'mp-1596575']",0.8382519,"{'V': 6.0, 'Si': 2.0}",103.98086881866836,[],FM,True,131,1,"[0.2, 0.3, 0.3, 0.2, 0.3, 0.3, 0.0, 0.0]",0.0161231947669493,0.8382519,6,1.6765038,MP,data/source/MP/cleaned/cifs/MP-mp-2567.cif,True,,data/final/MP/graphs/Si0.8Sn0.2V3-MP-mp-2567-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ir0.1Nb3Rh0.9,2,0.0499999999999999,2.0,False,Ir0.2Nb6Rh1.8,Nb6Rh2,0.0,Other,True,Ir2.5Nb75Rh22.5,Ir-Nb-Rh,3,Supercon,Nb3Rh0.9Ir0.1,MP-mp-1545,Nb6Rh2,Nb-Rh,Nb75Rh25,P m -3 n,cubic,5.186072,5.186072,5.186072,data/final/MP/cifs/Ir0.1Nb3Rh0.9-MP-mp-1545-synth_doped.cif,data/source/MP/raw/cifs/mp-1545.cif,mp-1545,0.0,,2011-05-14 11:20:25,9.086567873234834,10.17188/1191190,"@misc{osti_1191190,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Rh (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191190"",
    place = ""United States"",
    year = ""2015"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700041'}},0.0,5.48706495,520.0,-77.37430008,-9.67178751,{'tags': ['Niobium rhodium (3/1)']},-77.37430008,-9.67178751,-0.2547317625000005,"['xas', 'elasticity', 'bandstructure']",True,"[105216, 645269]",True,2021-05-12 10:56:12.755000,NM,8,8,mp-1545,,Nb3Rh,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Rh_pv'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Rh': 1.0}",GGA,mp-1545,"['mp-942004', 'mp-943019', 'mp-935201', 'mp-1545', 'mp-1433570', 'mp-1700041', 'mp-1786474', 'mp-1591392']",0.00021655,"{'Nb': 6.0, 'Rh': 2.0}",139.48118416938905,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",3.1050783127424102e-06,0.00021655,0,0.0004331,MP,data/source/MP/cleaned/cifs/MP-mp-1545.cif,True,,data/final/MP/graphs/Ir0.1Nb3Rh0.9-MP-mp-1545-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
B2C1Fe0.04Ni1.96Tm1,2,0.0133333333333333,1.0,True,B2C1Fe0.04Ni1.96Tm1,B2C1Ni2Tm1,7.97,Other,True,B33.333C16.667Fe0.667Ni32.667Tm16.667,B-C-Fe-Ni-Tm,5,Supercon,Tm1Ni1.96Fe0.04B2C1,MP-mp-6754,Tm1Ni2B2C1,B-C-Ni-Tm,B33.333C16.667Ni33.333Tm16.667,I 4/m m m,tetragonal,3.4928639994202824,3.492863999420283,5.7937603300000005,data/final/MP/cifs/B2C1Fe0.04Ni1.96Tm1-MP-mp-6754-synth_doped.cif,data/source/MP/raw/cifs/mp-6754.cif,mp-6754,0.0,,2011-05-13 04:35:22,8.309262229712736,10.17188/1282688,"@misc{osti_1282688,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TmNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1282688"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696752'}},0.0,6.71149537,520.0,-41.76249282,-6.96041547,{'tags': []},-41.76249282,-6.96041547,-0.5234699658333332,"['xas', 'elasticity', 'bandstructure']",True,"[79577, 56652, 164574]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-6754,,TmNi2B2C,"{'functional': 'PBE', 'labels': ['Tm_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Tm': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6754,"['mp-6754', 'mp-1000684', 'mp-1007145', 'mp-1412917', 'mp-1696752', 'mp-1790753', 'mp-1011888', 'mp-1590290']",0.0028138,"{'Tm': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",63.94016944835002,[],NM,False,139,0,"[0.0, -0.0, -0.0, 0.0, 0.0, 0.0]",4.40067648283752e-05,0.0028138,0,0.0028138,MP,data/source/MP/cleaned/cifs/MP-mp-6754.cif,True,,data/final/MP/graphs/B2C1Fe0.04Ni1.96Tm1-MP-mp-6754-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Mo6Pb0.8Se8Yb0.2,3,0.0266666666666666,1.0,True,Mo6Pb0.8Se8Yb0.2,Mo6Pb1Se8,12.2,Chevrel,True,Mo40Pb5.333Se53.333Yb1.333,Mo-Pb-Se-Yb,4,Supercon,Pb0.8Yb0.2Mo6Se8,MP-mp-22721,Mo6Pb1Se8,Mo-Pb-Se,Mo40Pb6.667Se53.333,R -3,trigonal,6.899290530000001,6.899290530000001,6.89929066,data/final/MP/cifs/Mo6Pb0.8Se8Yb0.2-MP-mp-22721-synth_doped.cif,data/source/MP/raw/cifs/mp-22721.cif,mp-22721,0.0,,2014-02-22 15:21:31,7.154597309388712,10.17188/1198925,"@misc{osti_1198925,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Mo6PbSe8 (SG:148) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198925"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699368'}},0.0408857626666643,4.99431959,520.0,-104.32887755,-6.955258503333334,"{'tags': ['Molydenum lead selenide (6/1/8)', 'Lead molybdenum(II/III) selenide (1/6/8)', 'Lead molybdenum selenide (1/6/8)', 'Lead molybdenum selenide (0.5/3/4)']}",-104.32887755,-6.955258503333334,-0.7567386985833328,"['xas', 'bandstructure']",True,"[644124, 603578, 644120, 644122, 644118, 68]",True,2021-05-12 10:56:59.077000,NM,15,12,mp-22721,,Mo6PbSe8,"{'functional': 'PBE', 'labels': ['Mo_pv', 'Pb_d', 'Se'], 'pot_type': 'paw'}","{'Mo': 6.0, 'Pb': 1.0, 'Se': 8.0}",GGA,mp-22721,"['mp-909170', 'mp-925012', 'mp-924202', 'mp-22721', 'mp-1103563', 'mp-1103882', 'mp-1104035', 'mp-1237387', 'mp-1422308', 'mp-1699368', 'mp-1808985', 'mp-1603460']",0.0003647,"{'Mo': 6.0, 'Pb': 1.0, 'Se': 8.0}",328.30159670967123,[],NM,False,148,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.1108687976394985e-06,0.0003647,0,0.0003647,MP,data/source/MP/cleaned/cifs/MP-mp-22721.cif,True,,data/final/MP/graphs/Mo6Pb0.8Se8Yb0.2-MP-mp-22721-synth_doped.json,0,True,-3,0,0,0,0,0,0,2,1,0,0,0,1.0,False
C1Mg1Ni2.99Ru0.01,2,0.0039999999999999,1.0,True,C1Mg1Ni2.99Ru0.01,C1Mg1Ni3,6.715,Other,True,C20Mg20Ni59.8Ru0.2,C-Mg-Ni-Ru,4,Supercon,Mg1C1Ni2.99Ru0.01,MP-mp-10700,Mg1Ni3C1,C-Mg-Ni,C20Mg20Ni60,P m -3 m,cubic,3.810209,3.810209,3.810209,data/final/MP/cifs/C1Mg1Ni2.99Ru0.01-MP-mp-10700-synth_doped.cif,data/source/MP/raw/cifs/mp-10700.cif,mp-10700,0.0,,2011-05-28 10:04:44,6.376007671789427,10.17188/1187303,"@misc{osti_1187303,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MgNi3C (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187303"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678621'}},0.0,6.64260176,520.0,-28.85099542,-5.770199084,{'tags': ['Magnesium nickel carbide (1/3/1)']},-28.85099542,-5.770199084,-0.1367049259999994,"['xas', 'elasticity', 'bandstructure']",True,[77152],True,2021-05-12 10:56:10.715000,NM,5,8,mp-10700,,MgNi3C,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Ni_pv', 'C'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",GGA,mp-10700,"['mp-927245', 'mp-927653', 'mp-911184', 'mp-10700', 'mp-1438083', 'mp-1678621', 'mp-1791467', 'mp-1591421']",0.0387875,"{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",55.31544309398296,[],NM,False,221,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",0.0007012056277683,0.0387875,0,0.0387875,MP,data/source/MP/cleaned/cifs/MP-mp-10700.cif,True,,data/final/MP/graphs/C1Mg1Ni2.99Ru0.01-MP-mp-10700-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Fe2Te3,3,0.1333333333333333,1.0,True,Fe2Te3,Fe2Te4,0.0,Ferrite,True,Fe40Te60,Fe-Te,2,Supercon,Fe2Te3,MP-mp-19880,Fe2Te4,Fe-Te,Fe33.333Te66.667,P n n m,orthorhombic,3.896028,5.260009,6.258678,data/final/MP/cifs/Fe2Te3-MP-mp-19880-synth_doped.cif,data/source/MP/raw/cifs/mp-19880.cif,mp-19880,0.1232000000000006,,2014-02-21 08:48:52,8.0539912360884,10.17188/1195070,"@misc{osti_1195070,
    author = ""Persson, Kristin"",
    title = ""Materials Data on FeTe2 (SG:58) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195070"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672276'}},0.0,8.355741,520.0,-30.59723645,-5.099539408333333,"{'tags': ['Iron telluride (1/2)', 'Frohbergite', 'Iron telluride (1/2) - delta']}",-30.59723645,-5.099539408333333,-0.4620026383333335,"['xas', 'elasticity', 'bandstructure']",True,"[633866, 77319, 25679, 633879, 633870, 86518, 633871]",True,2021-05-12 10:56:14.760000,NM,6,16,mp-19880,,FeTe2,"{'functional': 'PBE', 'labels': ['Fe_pv', 'Te'], 'pot_type': 'paw'}","{'Fe': 1.0, 'Te': 2.0}",GGA,mp-19880,"['mp-906535', 'mp-921252', 'mp-920236', 'mp-20653', 'mp-19880', 'mp-1071886', 'mp-1071949', 'mp-1071907', 'mp-1077206', 'mp-1077359', 'mp-1077447', 'mp-1439704', 'mp-1672276', 'mp-1788915', 'mp-1591667', 'mp-1071936']",5.5e-07,"{'Fe': 2.0, 'Te': 4.0}",128.25997914083842,[],NM,False,58,0,"[0, 0, 0, 0, 0, 0]",8.576330725830878e-09,5.5e-07,0,1.1e-06,MP,data/source/MP/cleaned/cifs/MP-mp-19880.cif,True,,data/final/MP/graphs/Fe2Te3-MP-mp-19880-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ce1,1,0.0,1.0,True,Ce1,Ce1,0.85,Heavy_fermion,True,Ce100,Ce,1,Supercon,Ce1,MP-mp-567332,Ce2,Ce,Ce100,F m -3 m,cubic,3.324219996333088,3.330025139432379,3.3301064,data/final/MP/cifs/Ce1-MP-mp-567332.cif,data/source/MP/raw/cifs/mp-567332.cif,mp-567332,0.0,,2014-02-16 04:30:12,8.917866649861772,10.17188/1273811,"@misc{osti_1273811,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ce (SG:12) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1273811"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687572'}},0.0,9.59848751,520.0,-11.86617831,-5.933089155,"{'tags': ['Cerium - alpha', 'High pressure experimental phase']}",-11.86617831,-5.933089155,0.0,"['xas', 'elasticity', 'bandstructure', 'surfaces']",True,[2284],True,2021-05-12 10:56:22.739000,NM,2,10,mp-567332,,Ce,"{'functional': 'PBE', 'labels': ['Ce'], 'pot_type': 'paw'}",{'Ce': 1.0},GGA,mp-567332,"['mp-923879', 'mp-924515', 'mp-917451', 'mp-567332', 'mp-1181892', 'mp-1439094', 'mp-1687572', 'mp-1791249', 'mp-1868644', 'mp-1593731']",0.00059195,{'Ce': 2.0},52.18021327092438,[],NM,False,225,0,[0],2.268867691002113e-05,0.00059195,0,0.0011839,MP,data/source/MP/cleaned/cifs/MP-mp-567332.cif,False,,data/final/MP/graphs/Ce1-MP-mp-567332.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Co0.5Ni0.5Zr2,1,0.0,2.0,False,Co1Ni1Zr4,Co1Ni1Zr4,3.1325,Other,True,Co16.667Ni16.667Zr66.667,Co-Ni-Zr,3,Supercon,Zr2Co0.5Ni0.5,MP-mp-1215379,Zr4Co1Ni1,Co-Ni-Zr,Co16.667Ni16.667Zr66.667,I 4 2 2,tetragonal,5.30408692094024,5.30408692,5.30408692,data/final/MP/cifs/Co0.5Ni0.5Zr2-MP-mp-1215379.cif,data/source/MP/raw/cifs/mp-1215379.cif,mp-1215379,0.0,,2019-01-12 17:04:40.863000,7.126495060084947,,,{'GGA': {'task_id': 'mp-1759199'}},0.0060319050000003,4.68660376,520.0,-48.79738245,-8.132897075,{'tags': []},-48.79738245,-8.132897075,-0.286354242500001,['bandstructure'],True,[],True,2021-05-12 10:58:39.488000,NM,6,5,mp-1215379,,Zr4CoNi,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Co', 'Ni_pv'], 'pot_type': 'paw'}","{'Zr': 4.0, 'Co': 1.0, 'Ni': 1.0}",GGA,mp-1215379,"['mp-1215379', 'mp-1385448', 'mp-1759199', 'mp-1802552', 'mp-1624939']",0.0012606,"{'Zr': 4.0, 'Co': 1.0, 'Ni': 1.0}",112.4322142594959,[],NM,False,97,0,"[0.0, 0.0, 0.0, 0.0, -0.0, 0.0]",1.1212089064531888e-05,0.0012606,0,0.0012606,MP,data/source/MP/cleaned/cifs/MP-mp-1215379.cif,False,,data/final/MP/graphs/Co0.5Ni0.5Zr2-MP-mp-1215379.json,0,True,422,0,0,0,0,4,0,0,0,0,1,0,1.0,False
Pd0.9Pt0.1Te2,3,0.0666666666666666,1.0,True,Pd0.9Pt0.1Te2,Pd1Te2,1.65,Other,True,Pd30Pt3.333Te66.667,Pd-Pt-Te,3,Supercon,Pd0.9Pt0.1Te2,MP-mp-782,Te2Pd1,Pd-Te,Pd33.333Te66.667,P -3 m 1,trigonal,4.116332001551086,4.11633193,5.170725,data/final/MP/cifs/Pd0.9Pt0.1Te2-MP-mp-782-synth_doped.cif,data/source/MP/raw/cifs/mp-782.cif,mp-782,0.0,,2011-05-12 19:10:21,7.914048115404642,10.17188/1307608,"@misc{osti_1307608,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Te2Pd (SG:164) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1307608"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671974'}},0.0,6.78872762,520.0,-12.46921459,-4.156404863333333,"{'tags': ['Merenskyite', 'Palladium(IV) telluride', 'Palladium telluride (1/2) - 2H', 'Palladium telluride (1/2)']}",-12.46921459,-4.156404863333333,-0.6155769733333329,"['xas', 'elasticity', 'bandstructure']",True,"[41387, 648995, 649013, 649016, 42555, 42554, 83642]",True,2021-05-12 10:56:31.128000,NM,3,8,mp-782,,Te2Pd,"{'functional': 'PBE', 'labels': ['Te', 'Pd'], 'pot_type': 'paw'}","{'Te': 2.0, 'Pd': 1.0}",GGA,mp-782,"['mp-908021', 'mp-923293', 'mp-922494', 'mp-782', 'mp-1442195', 'mp-1671974', 'mp-1800542', 'mp-1587195']",4.83e-05,"{'Te': 2.0, 'Pd': 1.0}",75.87572485123682,[],NM,False,164,0,"[0, 0, 0]",6.365672300949712e-07,4.83e-05,0,4.83e-05,MP,data/source/MP/cleaned/cifs/MP-mp-782.cif,True,,data/final/MP/graphs/Pd0.9Pt0.1Te2-MP-mp-782-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ba1.9Cu3La0.1Y1O6.5,2,0.016,2.0,False,Ba3.8Cu6La0.2Y2O13,Ba4Cu6Y2O13,32.9,Cuprate,True,Ba15.2Cu24La0.8Y8O52,Ba-Cu-La-Y-O,5,Supercon,Y1Ba1.9La0.1Cu3O6.5,MP-mp-20897,Ba4Y2Cu6O13,Ba-Cu-Y-O,Ba16Cu24Y8O52,P m m m,orthorhombic,3.909175,7.72064,11.972045,data/final/MP/cifs/Ba1.9Cu3La0.1Y1O6.5-MP-mp-20897-synth_doped.cif,data/source/MP/raw/cifs/mp-20897.cif,mp-20897,0.0,,2014-02-25 20:12:33,6.049593917158658,10.17188/1196091,"@misc{osti_1196091,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba4Y2Cu6O13 (SG:47) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196091"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1669318'}},0.0223745503700012,3.31128034,520.0,-155.75476866,-6.2301907464,"{'tags': ['Yttrium barium copper oxide (1/2/3/6.5)', 'Yttrium barium copper oxide (2/4/6/13)']}",-155.75476866,-6.2301907464,-2.2063284011333337,"['xas', 'elasticity', 'bandstructure']",True,"[96019, 96018, 390001, 75697, 73896, 96020, 96017, 96016]",True,2021-05-12 10:56:14.760000,NM,25,8,mp-20897,oxide,Ba4Y2Cu6O13,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 4.0, 'Y': 2.0, 'Cu': 6.0, 'O': 13.0}",GGA,mp-20897,"['mp-993255', 'mp-991266', 'mp-20897', 'mp-1435084', 'mp-1669318', 'mp-1838426', 'mp-994634', 'mp-1584471']",0.0060136,"{'Ba': 4.0, 'Y': 2.0, 'Cu': 6.0, 'O': 13.0}",361.3322753035632,[],NM,False,47,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0, -0.0, -0.0, 0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",1.6642853160426486e-05,0.0060136,0,0.0060136,MP,data/source/MP/cleaned/cifs/MP-mp-20897.cif,True,,data/final/MP/graphs/Ba1.9Cu3La0.1Y1O6.5-MP-mp-20897-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
As1Fe1Pr1O1,1,0.0,2.0,False,As2Fe2Pr2O2,As2Fe2Pr2O2,0.0,Ferrite,True,As25Fe25Pr25O25,As-Fe-Pr-O,4,Supercon,Pr1Fe1As1O1,MP-mp-22491,Pr2Fe2As2O2,As-Fe-Pr-O,As25Fe25Pr25O25,P 4/n m m,tetragonal,4.094889,4.094889,9.258722,data/final/MP/cifs/As1Fe1Pr1O1-MP-mp-22491.cif,data/source/MP/raw/cifs/mp-22491.cif,mp-22491,0.0,,2014-02-25 19:17:30,6.153806906111091,,,{'GGA+U': {'task_id': 'mp-1695715'}},0.3808778432291664,4.12348168,520.0,-51.7633941,-6.4704242625,{'tags': ['Praseodymium iron arsenic oxide (1/1/1/1)']},-51.7633941,-6.4704242625,-1.491677511249999,"['xas', 'bandstructure']",True,"[162830, 162833, 246832, 90316, 422000, 236649, 236648, 602491]",True,2021-05-12 10:57:10.838000,FM,8,8,mp-22491,oxide,PrFeAsO,"{'functional': 'PBE', 'labels': ['Pr_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Pr': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-22491,"['mp-510622', 'mp-1079608', 'mp-1079857', 'mp-22491', 'mp-1476145', 'mp-1695715', 'mp-1778524', 'mp-1596397']",3.7947681,"{'Pr': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",155.25132378854377,[],FM,True,129,1,"[0.0, 0.0, 3.5, 3.5, 0.0, 0.0, 0.0, 0.0]",0.0488854846116297,3.7947681,2,7.5895362,MP,data/source/MP/cleaned/cifs/MP-mp-22491.cif,False,,data/final/MP/graphs/As1Fe1Pr1O1-MP-mp-22491.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ga1,1,0.0,4.0,False,Ga4,Ga4,5.527454545,Other,True,Ga100,Ga,1,Supercon,Ga1,MP-mp-142,Ga4,Ga,Ga100,C m c a,orthorhombic,4.48901475,4.48901475,4.592971,data/final/MP/cifs/Ga1-MP-mp-142.cif,data/source/MP/raw/cifs/mp-142.cif,mp-142,0.0,,2011-05-13 03:55:58,5.742583400308233,10.17188/1190202,"@misc{osti_1190202,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ga (SG:64) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1190202"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1670916'}},0.0,2.88645814,520.0,-12.11238409,-3.0280960225,"{'tags': ['Gallium - alpha', 'Gallium']}",-12.11238409,-3.0280960225,0.0,"['surfaces', 'eos', 'bandstructure', 'xas', 'elasticity']",True,"[43388, 654170, 109032, 634203, 52271, 191767, 151376, 426940, 634202]",True,2021-05-12 10:56:12.755000,NM,4,17,mp-142,,Ga,"{'functional': 'PBE', 'labels': ['Ga_d'], 'pot_type': 'paw'}",{'Ga': 1.0},GGA,mp-142,"['mp-905527', 'mp-919621', 'mp-918653', 'mp-142', 'mp-1066603', 'mp-1066618', 'mp-1066878', 'mp-1066719', 'mp-1066916', 'mp-1067028', 'mp-1442131', 'mp-1670916', 'mp-1800795', 'mp-1923393', 'mp-1592031', 'mp-1066661', 'mp-1066968']",5.7e-06,{'Ga': 4.0},80.6450736679505,[],NM,False,64,0,"[0, 0, 0, 0]",2.82720307180537e-07,5.7e-06,0,2.28e-05,MP,data/source/MP/cleaned/cifs/MP-mp-142.cif,False,,data/final/MP/graphs/Ga1-MP-mp-142.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Bi1,1,0.0,2.0,False,Bi2,Bi2,5.867142857,Other,True,Bi100,Bi,1,Supercon,Bi1,MP-mp-23152,Bi2,Bi,Bi100,R -3 m,trigonal,4.609586232612552,4.609586232612551,4.79764744,data/final/MP/cifs/Bi1-MP-mp-23152.cif,data/source/MP/raw/cifs/mp-23152.cif,mp-23152,0.0,,2014-12-22 15:59:41,9.44840978387041,10.17188/1199272,"@misc{osti_1199272,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Bi (SG:166) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199272"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668521'}},0.0,4.7362445,520.0,-7.78006862,-3.89003431,{'tags': ['Bismuth']},-7.78006862,-3.89003431,0.0,"['surfaces', 'eos', 'bandstructure', 'xas', 'elasticity']",True,"[64705, 53797, 616527, 426929, 246663, 64704, 64703, 616519]",True,2021-05-12 10:56:16.728000,NM,2,12,mp-23152,,Bi,"{'functional': 'PBE', 'labels': ['Bi'], 'pot_type': 'paw'}",{'Bi': 1.0},GGA,mp-23152,"['mp-907926', 'mp-922430', 'mp-23152', 'mp-1059071', 'mp-1059130', 'mp-1442102', 'mp-1668521', 'mp-1783015', 'mp-923215', 'mp-1588594', 'mp-1591070', 'mp-1059103']",0.0001038,{'Bi': 2.0},73.45577219694691,[],NM,False,166,0,"[0, 0]",2.826190424401101e-06,0.0001038,0,0.0002076,MP,data/source/MP/cleaned/cifs/MP-mp-23152.cif,False,,data/final/MP/graphs/Bi1-MP-mp-23152.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Al0.94Ge0.06Nb3,2,0.03,2.0,False,Al1.88Ge0.12Nb6,Al2Nb6,20.0,Other,True,Al23.5Ge1.5Nb75,Al-Ge-Nb,3,Supercon,Nb3Al0.94Ge0.06,MP-mp-796,Nb6Al2,Al-Nb,Al25Nb75,P m -3 n,cubic,5.215254,5.215254,5.215254,data/final/MP/cifs/Al0.94Ge0.06Nb3-MP-mp-796-synth_doped.cif,data/source/MP/raw/cifs/mp-796.cif,mp-796,0.0,,2011-05-13 16:07:37,7.157298025966356,,,{'GGA': {'task_id': 'mp-1686893'}},0.0460773865000003,5.52947534,520.0,-69.48918494,-8.6861481175,"{'tags': ['Aluminium niobium (1/3)', 'Niobium aluminide (3/1)', 'Aluminum niobium (1/3)']}",-69.48918494,-8.6861481175,-0.1737753800000003,"['bandstructure', 'elasticity']",True,"[608675, 608654, 608688, 608668, 608669, 608685, 608676, 608683, 58014, 608657, 107856, 608655, 608666, 608691, 608656, 608665, 608673, 608653, 608661]",True,2021-05-12 10:56:31.128000,NM,8,10,mp-796,,Nb3Al,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Al': 1.0}",GGA,mp-796,"['mp-911586', 'mp-927906', 'mp-796', 'mp-927472', 'mp-1260512', 'mp-1440919', 'mp-1686893', 'mp-1927652', 'mp-1591599', 'mp-1587739']",0.16323955,"{'Nb': 6.0, 'Al': 2.0}",141.8490379078192,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0023015954483396,0.16323955,0,0.3264791,MP,data/source/MP/cleaned/cifs/MP-mp-796.cif,True,,data/final/MP/graphs/Al0.94Ge0.06Nb3-MP-mp-796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Bi2K3,1,0.0,2.0,False,Bi4K6,Bi4K6,0.0,Other,True,Bi40K60,Bi-K,2,Supercon,Bi2K3,MP-mp-1206573,K6Bi4,Bi-K,Bi40K60,C 1 2/c 1,monoclinic,6.8596306600000005,6.8596306600000005,9.55412348,data/final/MP/cifs/Bi2K3-MP-mp-1206573.cif,data/source/MP/raw/cifs/mp-1206573.cif,mp-1206573,0.0,,2019-01-12 09:51:25.091000,4.118949995777433,,,,0.0256121909583333,1.55397487,520.0,-25.52610842,-2.552610842,"{'tags': ['K3Bi2', 'Eu3Ga2']}",-25.52610842,-2.552610842,-0.3303577498000002,[],False,[],True,2021-05-12 11:00:17.126000,NM,10,3,mp-1206573,,K3Bi2,"{'functional': 'PBE', 'labels': ['K_sv', 'Bi'], 'pot_type': 'paw'}","{'K': 3.0, 'Bi': 2.0}",GGA,mp-1206573,"['mp-1206573', 'mp-1372228', 'mp-1816493']",0.0022769,"{'K': 6.0, 'Bi': 4.0}",431.5726101950748,[],NM,False,15,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.0551642741974843e-05,0.0022769,0,0.0045538,MP,data/source/MP/cleaned/cifs/MP-mp-1206573.cif,False,,data/final/MP/graphs/Bi2K3-MP-mp-1206573.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
Er1Rh1.1Sn3.6,2,0.027828191167574,5.0,False,Er5Rh5.5Sn18,Er5Rh6Sn18,1.36,Other,True,Er17.544Rh19.298Sn63.158,Er-Rh-Sn,3,Supercon,Er1Rh1.1Sn3.6,MP-mp-1225985,Er5Sn18Rh6,Er-Rh-Sn,Er17.241Rh20.69Sn62.069,F -4 3 m,cubic,9.87751947,9.877519469999998,9.877519469999998,data/final/MP/cifs/Er1Rh1.1Sn3.6-MP-mp-1225985-synth_doped.cif,data/source/MP/raw/cifs/mp-1225985.cif,mp-1225985,0.0,,2019-01-13 02:01:09.684000,8.749360487241622,,,,0.0035110409195393,7.76895036,520.0,-154.67852654,-5.333742294482759,{'tags': []},-154.67852654,-5.333742294482759,-0.5338548924137932,[],False,[],True,2021-05-12 11:00:56.634000,NM,29,2,mp-1225985,,Er5(Sn3Rh)6,"{'functional': 'PBE', 'labels': ['Er_3', 'Sn_d', 'Rh_pv'], 'pot_type': 'paw'}","{'Er': 5.0, 'Sn': 18.0, 'Rh': 6.0}",GGA,mp-1225985,"['mp-1225985', 'mp-1379951']",0.0673589,"{'Er': 5.0, 'Sn': 18.0, 'Rh': 6.0}",681.4416678377719,[],NM,False,216,0,"[-0.0, -0.0, -0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",9.884763902643514e-05,0.0673589,0,0.0673589,MP,data/source/MP/cleaned/cifs/MP-mp-1225985.cif,True,,data/final/MP/graphs/Er1Rh1.1Sn3.6-MP-mp-1225985-synth_doped.json,0,True,-43m,5,0,0,0,0,0,0,0,0,0,1,1.0,False
Al1La3,1,0.0,2.0,False,Al2La6,Al2La6,4.9833333335,Other,True,Al25La75,Al-La,2,Supercon,Al1La3,MP-mp-1084828,La6Al2,Al-La,Al25La75,P 63/m m c,hexagonal,5.462619,7.265429996073226,7.26543004,data/final/MP/cifs/Al1La3-MP-mp-1084828.cif,data/source/MP/raw/cifs/mp-1084828.cif,mp-1084828,0.0,,2018-04-25 13:28:11,5.900819389809003,,,{'GGA': {'task_id': 'mp-1699786'}},0.0043635418749996,7.93832938,520.0,-38.71831372,-4.839789215,"{'tags': ['Lanthanum aluminium (3/1)', 'Lanthanum aluminide (3/1)']}",-38.71831372,-4.839789215,-0.2013899287500002,['bandstructure'],True,"[603210, 608280]",True,2021-05-12 10:58:18.470000,NM,8,6,mp-1084828,,La3Al,"{'functional': 'PBE', 'labels': ['La', 'Al'], 'pot_type': 'paw'}","{'La': 3.0, 'Al': 1.0}",GGA,mp-1084828,"['mp-1084828', 'mp-1095107', 'mp-1414408', 'mp-1699786', 'mp-1777076', 'mp-1599938']",0.00020505,"{'La': 6.0, 'Al': 2.0}",249.72049769665185,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.6422360350177154e-06,0.00020505,0,0.0004101,MP,data/source/MP/cleaned/cifs/MP-mp-1084828.cif,False,,data/final/MP/graphs/Al1La3-MP-mp-1084828.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Fe1Se0.92,2,0.0416666666666666,2.0,False,Fe2Se1.84,Fe2Se2,7.4,Ferrite,True,Fe52.083Se47.917,Fe-Se,2,Supercon,Fe1Se0.92,MP-mp-20311,Fe2Se2,Fe-Se,Fe50Se50,P 4/n m m,tetragonal,3.688905,3.688905,5.854194,data/final/MP/cifs/Fe1Se0.92-MP-mp-20311-synth_doped.cif,data/source/MP/raw/cifs/mp-20311.cif,mp-20311,0.0,,2013-10-20 07:09:24,5.619828229873189,10.17188/1195438,"@misc{osti_1195438,
    author = ""Persson, Kristin"",
    title = ""Materials Data on FeSe (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195438"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668877'}},0.0,3.48880228,520.0,-25.01949237,-6.2548730925,"{'tags': ['Iron selenide - NN AFM', 'Iron selenide - orthorhombic, LT', 'Iron selenide', 'Iron sulfide', 'Iron selenide (1/1) - nonmagnetic', 'Iron selenide - tetragonal', 'Iron selenide - alpha LT', 'Iron selenide - LT', 'High pressure experimental phase', 'Iron selenide - alpha']}",-25.01949237,-6.2548730925,-0.5079131286718743,"['xas', 'elasticity', 'bandstructure']",True,"[196301, 196298, 196299, 196297, 290701, 165958, 185464, 163561, 169257, 163560, 977900, 169311, 169303, 26889, 166440, 162901, 169283, 165957, 169271, 977903, 169259, 977901, 185465, 165959, 169306, 169267, 163557, 169287, 169297, 169289, 163556, 169299, 163562, 166441, 182544, 163559, 169269, 169263, 169265, 169315, 169255, 166439, 169293, 169313, 163555, 169291, 169301, 165960, 169253, 169295, 169970, 163558, 169285, 169261, 169309]",True,2021-05-12 10:56:14.760000,NM,4,55,mp-20311,,FeSe,"{'functional': 'PBE', 'labels': ['Fe_pv', 'Se'], 'pot_type': 'paw'}","{'Fe': 1.0, 'Se': 1.0}",GGA,mp-20311,"['mp-684656', 'mp-20311', 'mp-1063646', 'mp-1063662', 'mp-1063681', 'mp-1063669', 'mp-1063680', 'mp-1063695', 'mp-1063686', 'mp-1063699', 'mp-1063715', 'mp-1063717', 'mp-1063876', 'mp-1063734', 'mp-1063891', 'mp-1063735', 'mp-1063910', 'mp-1063918', 'mp-1063922', 'mp-1063931', 'mp-1063774', 'mp-1063781', 'mp-1064091', 'mp-1064111', 'mp-1063801', 'mp-1064112', 'mp-1064180', 'mp-1064138', 'mp-1064153', 'mp-1065102', 'mp-1065123', 'mp-1065075', 'mp-1065161', 'mp-1065131', 'mp-1065030', 'mp-1065055', 'mp-1065085', 'mp-1065094', 'mp-1440814', 'mp-1668877', 'mp-1799618', 'mp-1593782', 'mp-1592730', 'mp-1065081', 'mp-1065148', 'mp-1063928', 'mp-1063726', 'mp-1063683', 'mp-1063709', 'mp-1063911', 'mp-1063795', 'mp-1065121', 'mp-1063725', 'mp-1064139', 'mp-1064165']",3.455e-05,"{'Fe': 2.0, 'Se': 2.0}",79.66398961559156,[],NM,False,129,0,"[0, 0, 0, 0]",8.673931638803586e-07,3.455e-05,0,6.91e-05,MP,data/source/MP/cleaned/cifs/MP-mp-20311.cif,True,,data/final/MP/graphs/Fe1Se0.92-MP-mp-20311-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ge1Hf2,1,0.0,2.0,False,Ge2Hf4,Ge2Hf4,0.0,Other,True,Ge33.333Hf66.667,Ge-Hf,2,Supercon,Ge1Hf2,MP-mp-9939,Hf4Ge2,Ge-Hf,Ge33.333Hf66.667,I 4/m c m,tetragonal,5.297946001597336,5.391280790818566,5.39128079,data/final/MP/cifs/Ge1Hf2-MP-mp-9939.cif,data/source/MP/raw/cifs/mp-9939.cif,mp-9939,0.0,,2011-05-28 18:33:34,12.214342731881771,10.17188/1317000,"@misc{osti_1317000,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Hf2Ge (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1317000"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702585'}},0.0,4.97515293,520.0,-52.98046844,-8.830078073333334,{'tags': ['Hafnium germanide (2/1)']},-52.98046844,-8.830078073333334,-0.650942888333334,"['xas', 'elasticity', 'bandstructure']",True,"[636548, 42524, 636547]",True,2021-05-12 10:56:37.246000,NM,6,13,mp-9939,,Hf2Ge,"{'functional': 'PBE', 'labels': ['Hf_pv', 'Ge_d'], 'pot_type': 'paw'}","{'Hf': 2.0, 'Ge': 1.0}",GGA,mp-9939,"['mp-9939', 'mp-925461', 'mp-924863', 'mp-909831', 'mp-1072152', 'mp-1072166', 'mp-1072200', 'mp-1077186', 'mp-1436803', 'mp-1702585', 'mp-1805388', 'mp-1591675', 'mp-1072194']",0.00096745,"{'Hf': 4.0, 'Ge': 2.0}",116.81361976696124,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0]",1.656399317014619e-05,0.00096745,0,0.0019349,MP,data/source/MP/cleaned/cifs/MP-mp-9939.cif,False,,data/final/MP/graphs/Ge1Hf2-MP-mp-9939.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As2Ba1Pd2,1,0.0,2.0,False,As4Ba2Pd4,As4Ba2Pd4,2.0,Other,True,As40Ba20Pd40,As-Ba-Pd,3,Supercon,Ba1Pd2As2,MP-mp-571350,Ba2As4Pd4,As-Ba-Pd,As40Ba20Pd40,I 4/m m m,tetragonal,4.541074000600572,4.541074000600572,11.00802737,data/final/MP/cifs/As2Ba1Pd2-MP-mp-571350.cif,data/source/MP/raw/cifs/mp-571350.cif,mp-571350,0.0,,2014-02-16 11:31:41,7.647889932829184,10.17188/1276214,"@misc{osti_1276214,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba(AsPd)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1276214"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696531'}},0.0,4.54000195,520.0,-51.02664261,-5.102664261,{'tags': ['Barium dipalladium arsenide']},-51.02664261,-5.102664261,-0.7832700090000003,"['bandstructure', 'elasticity']",True,[36377],True,2021-05-12 10:56:27.046000,NM,10,8,mp-571350,,Ba(AsPd)2,"{'functional': 'PBE', 'labels': ['Ba_sv', 'As', 'Pd'], 'pot_type': 'paw'}","{'Ba': 1.0, 'As': 2.0, 'Pd': 2.0}",GGA,mp-571350,"['mp-920817', 'mp-921848', 'mp-907421', 'mp-571350', 'mp-1417455', 'mp-1696531', 'mp-1832610', 'mp-1597551']",7.2e-06,"{'Ba': 2.0, 'As': 4.0, 'Pd': 4.0}",217.12824794572623,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.632025144696717e-08,7.2e-06,0,1.44e-05,MP,data/source/MP/cleaned/cifs/MP-mp-571350.cif,False,,data/final/MP/graphs/As2Ba1Pd2-MP-mp-571350.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Nb3Pt0.9Rh0.1,2,0.0499999999999999,2.0,False,Nb6Pt1.8Rh0.2,Nb6Pt2,7.9,Other,True,Nb75Pt22.5Rh2.5,Nb-Pt-Rh,3,Supercon,Nb3Rh0.1Pt0.9,MP-mp-2663,Nb6Pt2,Nb-Pt,Nb75Pt25,P m -3 n,cubic,5.206284,5.206284,5.206284,data/final/MP/cifs/Nb3Pt0.9Rh0.1-MP-mp-2663-synth_doped.cif,data/source/MP/raw/cifs/mp-2663.cif,mp-2663,0.0,,2011-05-14 02:42:41,11.150477426700435,10.17188/1201206,"@misc{osti_1201206,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Pt (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201206"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1667983'}},0.0,5.9039275,520.0,-75.80228808,-9.47528601,{'tags': ['Niobium platinum (3/1)']},-75.80228808,-9.47528601,-0.3815803024999997,"['xas', 'elasticity', 'bandstructure']",True,"[645231, 645226, 645216, 645227, 105203, 645228, 645218, 645236, 645224]",True,2021-05-12 10:56:18.721000,NM,8,8,mp-2663,,Nb3Pt,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Pt'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Pt': 1.0}",GGA,mp-2663,"['mp-929425', 'mp-912670', 'mp-929036', 'mp-2663', 'mp-1438686', 'mp-1667983', 'mp-1778280', 'mp-1593946']",0.0004491,"{'Nb': 6.0, 'Pt': 2.0}",141.11837435118034,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",6.364869239244375e-06,0.0004491,0,0.0008982,MP,data/source/MP/cleaned/cifs/MP-mp-2663.cif,True,,data/final/MP/graphs/Nb3Pt0.9Rh0.1-MP-mp-2663-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Hg1S1,1,0.0,1.0,True,Hg1S1,Hg1S1,0.0,Other,True,Hg50S50,Hg-S,2,Supercon,Hg1S1,MP-mp-1123,Hg1S1,Hg-S,Hg50S50,F -4 3 m,cubic,4.24784782,4.24784782,4.24784782,data/final/MP/cifs/Hg1S1-MP-mp-1123.cif,data/source/MP/raw/cifs/mp-1123.cif,mp-1123,0.0,,2011-05-12 18:13:40,7.128031926948116,10.17188/1187653,"@misc{osti_1187653,
    author = ""Persson, Kristin"",
    title = ""Materials Data on HgS (SG:216) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187653"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668515'}},0.0,1.36577844,520.0,-4.69514689,-2.347573445,"{'tags': ['Mercury sulfide - beta', 'Metacinnabar', 'Mercury sulfide (1/1)', 'Mercury sulfide']}",-4.69514689,-2.347573445,-0.3790083290625001,"['eos', 'elasticity', 'bandstructure', 'xas']",True,"[104340, 639163, 81917, 56476, 24094, 639164, 639169, 31066, 56207]",True,2021-05-12 10:56:10.715000,NM,2,10,mp-1123,,HgS,"{'functional': 'PBE', 'labels': ['Hg', 'S'], 'pot_type': 'paw'}","{'Hg': 1.0, 'S': 1.0}",GGA,mp-1123,"['mp-920216', 'mp-921226', 'mp-906491', 'mp-1123', 'mp-1114823', 'mp-1440834', 'mp-1668515', 'mp-1783341', 'mp-1594311', 'mp-1590823']",0.0,"{'Hg': 1.0, 'S': 1.0}",54.19907212806666,[],NM,False,216,0,"[0, 0]",0.0,0.0,0,0.0,MP,data/source/MP/cleaned/cifs/MP-mp-1123.cif,False,,data/final/MP/graphs/Hg1S1-MP-mp-1123.json,0,True,-43m,5,0,0,0,0,0,0,0,0,0,1,1.0,False
B4Os1Y1,1,0.0,4.0,False,B16Os4Y4,B16Os4Y4,1.4,Other,True,B66.667Os16.667Y16.667,B-Os-Y,3,Supercon,Y1Os1B4,MP-mp-980205,Y4B16Os4,B-Os-Y,B66.667Os16.667Y16.667,P b a m,orthorhombic,3.570844,5.978252,11.567744,data/final/MP/cifs/B4Os1Y1-MP-mp-980205.cif,data/source/MP/raw/cifs/mp-980205.cif,mp-980205,0.0,,2015-10-10 21:15:02,8.671280067924167,10.17188/1316257,"@misc{osti_1316257,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YB4Os (SG:55) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1316257"",
    place = ""United States"",
    year = ""2016"",
    month = ""9"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672531'}},0.0,7.35794203,520.0,-191.31587172,-7.971494655,{'tags': ['Yttrium osmium boride (1/1/4)']},-191.31587172,-7.971494655,-0.5695939130555546,"['xas', 'bandstructure']",True,[615147],True,2021-05-12 10:57:57.486000,NM,24,9,mp-980205,,YB4Os,"{'functional': 'PBE', 'labels': ['Y_sv', 'B', 'Os_pv'], 'pot_type': 'paw'}","{'Y': 1.0, 'B': 4.0, 'Os': 1.0}",GGA,mp-980205,"['mp-980205', 'mp-981080', 'mp-1006005', 'mp-1005953', 'mp-1416001', 'mp-1672531', 'mp-1774693', 'mp-1011165', 'mp-1605470']",3.325e-05,"{'Y': 4.0, 'B': 16.0, 'Os': 4.0}",246.9413193975179,[],NM,False,55,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.385894929390129e-07,3.325e-05,0,0.000133,MP,data/source/MP/cleaned/cifs/MP-mp-980205.cif,False,,data/final/MP/graphs/B4Os1Y1-MP-mp-980205.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ba7.61Si46,2,0.0018120286726889,0.2608552819516654,False,Ba1.985Si12,Ba2Si12,8.2,Other,True,Ba14.195Si85.805,Ba-Si,2,Supercon,Ba7.61Si46,MP-mp-1480,Ba2Si12,Ba-Si,Ba14.286Si85.714,C m c m,orthorhombic,4.504218002155348,5.70181207,12.007895,data/final/MP/cifs/Ba7.61Si46-MP-mp-1480-synth_doped.cif,data/source/MP/raw/cifs/mp-1480.cif,mp-1480,0.0,,2011-05-13 14:58:38,3.5851357009979075,10.17188/1190902,"@misc{osti_1190902,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BaSi6 (SG:63) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1190902"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1676787'}},0.1132404973214287,6.94706542,520.0,-70.08572671,-5.006123336428572,{'tags': ['Barium hexasilicide']},-70.08572671,-5.006123336428572,-0.020858343571429,"['xas', 'bandstructure']",True,"[245296, 245295, 710014]",True,2021-05-12 10:56:53.126000,NM,14,11,mp-1480,,BaSi6,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Si'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Si': 6.0}",GGA,mp-1480,"['mp-915185', 'mp-1001475', 'mp-1001236', 'mp-1480', 'mp-1143447', 'mp-1264071', 'mp-1381521', 'mp-1676787', 'mp-1925742', 'mp-1007985', 'mp-1604242']",0.0011983,"{'Ba': 2.0, 'Si': 12.0}",283.3138327163368,[],NM,False,63,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",8.459170443680933e-06,0.0011983,0,0.0023966,MP,data/source/MP/cleaned/cifs/MP-mp-1480.cif,True,,data/final/MP/graphs/Ba7.61Si46-MP-mp-1480-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Al0.8In0.2Nb3,3,0.0999999999999999,2.0,False,Al1.6In0.4Nb6,Al2Nb6,18.1,Other,True,Al20In5Nb75,Al-In-Nb,3,Supercon,Nb3Al0.8In0.2,MP-mp-796,Nb6Al2,Al-Nb,Al25Nb75,P m -3 n,cubic,5.215254,5.215254,5.215254,data/final/MP/cifs/Al0.8In0.2Nb3-MP-mp-796-synth_doped.cif,data/source/MP/raw/cifs/mp-796.cif,mp-796,0.0,,2011-05-13 16:07:37,7.157298025966356,,,{'GGA': {'task_id': 'mp-1686893'}},0.0460773865000003,5.52947534,520.0,-69.48918494,-8.6861481175,"{'tags': ['Aluminium niobium (1/3)', 'Niobium aluminide (3/1)', 'Aluminum niobium (1/3)']}",-69.48918494,-8.6861481175,-0.1737753800000003,"['bandstructure', 'elasticity']",True,"[608675, 608654, 608688, 608668, 608669, 608685, 608676, 608683, 58014, 608657, 107856, 608655, 608666, 608691, 608656, 608665, 608673, 608653, 608661]",True,2021-05-12 10:56:31.128000,NM,8,10,mp-796,,Nb3Al,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Al': 1.0}",GGA,mp-796,"['mp-911586', 'mp-927906', 'mp-796', 'mp-927472', 'mp-1260512', 'mp-1440919', 'mp-1686893', 'mp-1927652', 'mp-1591599', 'mp-1587739']",0.16323955,"{'Nb': 6.0, 'Al': 2.0}",141.8490379078192,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0023015954483396,0.16323955,0,0.3264791,MP,data/source/MP/cleaned/cifs/MP-mp-796.cif,True,,data/final/MP/graphs/Al0.8In0.2Nb3-MP-mp-796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Co0.06La1Ru2.94Si2,2,0.02,1.0,True,Co0.06La1Ru2.94Si2,La1Ru3Si2,6.62,Other,True,Co1La16.667Ru49Si33.333,Co-La-Ru-Si,4,Supercon,La1Ru2.94Co0.06Si2,MP-mp-29240,La2Si4Ru6,La-Ru-Si,La16.667Ru50Si33.333,P 6/m m m,hexagonal,3.6088705,5.693851997310984,5.69385245,data/final/MP/cifs/Co0.06La1Ru2.94Si2-MP-mp-29240-synth_doped.cif,data/source/MP/raw/cifs/mp-29240.cif,mp-29240,0.0,,2014-02-24 11:42:03,8.166084465628895,10.17188/1203620,"@misc{osti_1203620,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaSi2Ru3 (SG:193) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1203620"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1719509'}},0.0844490616666675,8.56766587,520.0,-95.13702135,-7.9280851125,{'tags': []},-95.13702135,-7.9280851125,-0.6361177608333328,"['xas', 'bandstructure']",True,[],True,2021-05-12 10:57:03.017000,NM,12,10,mp-29240,,LaSi2Ru3,"{'functional': 'PBE', 'labels': ['La', 'Si', 'Ru_pv'], 'pot_type': 'paw'}","{'La': 1.0, 'Si': 2.0, 'Ru': 3.0}",GGA,mp-29240,"['mp-925171', 'mp-924493', 'mp-909454', 'mp-29240', 'mp-1172476', 'mp-1254946', 'mp-1406081', 'mp-1719509', 'mp-1834844', 'mp-1618500']",0.00014945,"{'La': 2.0, 'Si': 4.0, 'Ru': 6.0}",202.6489324904347,[],NM,False,38,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, 0.0, 0.0, 0.0, -0.0]",1.4749645918520125e-06,0.00014945,0,0.0002989,MP,data/source/MP/cleaned/cifs/MP-mp-29240.cif,True,,data/final/MP/graphs/Co0.06La1Ru2.94Si2-MP-mp-29240-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ag0.95Se2Sn1.05,2,0.025,1.0,True,Ag0.95Se2Sn1.05,Ag1Se2Sn1,5.245,Other,True,Ag23.75Se50Sn26.25,Ag-Se-Sn,3,Supercon,Ag0.95Sn1.05Se2,MP-mp-1229011,Ag1Sn1Se2,Ag-Se-Sn,Ag25Se50Sn25,R -3 m,trigonal,4.0598026973764,4.0598026973764,7.0325229,data/final/MP/cifs/Ag0.95Se2Sn1.05-MP-mp-1229011-synth_doped.cif,data/source/MP/raw/cifs/mp-1229011.cif,mp-1229011,0.0,,2019-01-13 04:39:21.201000,6.746249424080593,,,{'GGA': {'task_id': 'mp-1766738'}},0.0,4.6965768,520.0,-14.98910359,-3.7472758975,{'tags': []},-14.98910359,-3.7472758975,-0.5247881940885413,['bandstructure'],True,[],True,2021-05-12 10:58:49.477000,NM,4,5,mp-1229011,,AgSnSe2,"{'functional': 'PBE', 'labels': ['Ag', 'Sn_d', 'Se'], 'pot_type': 'paw'}","{'Ag': 1.0, 'Sn': 1.0, 'Se': 2.0}",GGA,mp-1229011,"['mp-1229011', 'mp-1422543', 'mp-1766738', 'mp-1796245', 'mp-1612963']",0.0080447,"{'Ag': 1.0, 'Sn': 1.0, 'Se': 2.0}",94.64136915222257,[],NM,False,166,0,"[0, 0, 0, 0]",8.50019401881305e-05,0.0080447,0,0.0080447,MP,data/source/MP/cleaned/cifs/MP-mp-1229011.cif,True,,data/final/MP/graphs/Ag0.95Se2Sn1.05-MP-mp-1229011-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ba1Bi0.22Pb0.78O3,3,0.088,2.0,False,Ba2Bi0.44Pb1.56O6,Ba2Pb2O6,10.3,Oxide,True,Ba20Bi4.4Pb15.6O60,Ba-Bi-Pb-O,4,Supercon,Ba1Pb0.78Bi0.22O3,MP-mp-22230,Ba2Pb2O6,Ba-Pb-O,Ba20Pb20O60,I m m a,orthorhombic,6.133862002250079,6.155866510000001,6.155866509646406,data/final/MP/cifs/Ba1Bi0.22Pb0.78O3-MP-mp-22230-synth_doped.cif,data/source/MP/raw/cifs/mp-22230.cif,mp-22230,0.2093999999999996,,2014-02-21 02:34:22,7.878976238337828,10.17188/1197446,"@misc{osti_1197446,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BaPbO3 (SG:74) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197446"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677620'}},0.0,2.99294363,520.0,-57.91751158,-5.791751158,"{'tags': ['Barium plumbate(IV)', 'Barium lead oxide', 'Barium plumbate', 'Barium lead(IV) oxide']}",-57.91751158,-5.791751158,-2.1088509750000006,"['xas', 'bandstructure']",True,"[252031, 94313, 154038, 245600, 51657, 94312, 245601, 78681, 154039, 15933, 67811, 245602]",True,2021-05-12 10:56:59.077000,NM,10,7,mp-22230,oxide,BaPbO3,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Pb_d', 'O'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Pb': 1.0, 'O': 3.0}",GGA,mp-22230,"['mp-547522', 'mp-22230', 'mp-1078282', 'mp-1437547', 'mp-1677620', 'mp-1828697', 'mp-1589590']",5.66e-05,"{'Ba': 2.0, 'Pb': 2.0, 'O': 6.0}",165.45383803885784,[],NM,False,74,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.841787494431788e-07,5.66e-05,0,0.0001132,MP,data/source/MP/cleaned/cifs/MP-mp-22230.cif,True,,data/final/MP/graphs/Ba1Bi0.22Pb0.78O3-MP-mp-22230-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,0,1,0,0.5,False
Ga0.5Sn0.5V3,1,0.0,2.0,False,Ga1Sn1V6,Ga1Sn1V6,5.6,Other,True,Ga12.5Sn12.5V75,Ga-Sn-V,3,Supercon,V3Ga0.5Sn0.5,MP-mp-1216451,V6Ga1Sn1,Ga-Sn-V,Ga12.5Sn12.5V75,P m -3,cubic,4.882871,4.882871,4.882871,data/final/MP/cifs/Ga0.5Sn0.5V3-MP-mp-1216451.cif,data/source/MP/raw/cifs/mp-1216451.cif,mp-1216451,0.0,,2019-01-12 17:57:29.635000,7.04729379487434,,,{'GGA': {'task_id': 'mp-1754060'}},0.0192496874999994,6.72642508,520.0,-62.34394115,-7.79299264375,{'tags': []},-62.34394115,-7.79299264375,-0.1003546065625,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,FM,8,5,mp-1216451,,V6GaSn,"{'functional': 'PBE', 'labels': ['V_pv', 'Ga_d', 'Sn_d'], 'pot_type': 'paw'}","{'V': 6.0, 'Ga': 1.0, 'Sn': 1.0}",GGA,mp-1216451,"['mp-1216451', 'mp-1398394', 'mp-1754060', 'mp-1803827', 'mp-1620626']",2.4842372,"{'V': 6.0, 'Ga': 1.0, 'Sn': 1.0}",116.41950612312884,[],FM,True,47,1,"[0.3, 0.4, 0.4, 0.3, 0.4, 0.4, 0.0, 0.0]",0.0213386680868805,2.4842372,6,2.4842372,MP,data/source/MP/cleaned/cifs/MP-mp-1216451.cif,False,,data/final/MP/graphs/Ga0.5Sn0.5V3-MP-mp-1216451.json,0,True,m-3,2,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba0.8Rb0.2Sb2Ti2O1,3,0.0666666666666666,1.0,True,Ba0.8Rb0.2Sb2Ti2O1,Ba1Sb2Ti2O1,6.19,Oxide,True,Ba13.333Rb3.333Sb33.333Ti33.333O16.666666666666668,Ba-Rb-Sb-Ti-O,5,Supercon,Ba0.8Rb0.2Ti2Sb2O1,MP-mp-1070806,Ba1Ti2Sb2O1,Ba-Sb-Ti-O,Ba16.667Sb33.333Ti33.333O16.666666666666668,P 4/m m m,tetragonal,4.113474,4.113474,8.312382,data/final/MP/cifs/Ba0.8Rb0.2Sb2Ti2O1-MP-mp-1070806-synth_doped.cif,data/source/MP/raw/cifs/mp-1070806.cif,mp-1070806,0.0,,2018-03-22 04:02:04,5.8154485533321445,,,{'GGA': {'task_id': 'mp-1702174'}},0.0,5.89751533,520.0,-39.14932631,-6.524887718333333,{'tags': []},-39.14932631,-6.524887718333333,-1.5507346602777776,['bandstructure'],True,"[430061, 237789, 430060]",True,2021-05-12 10:58:14.654000,NM,6,16,mp-1070806,oxide,BaTi2Sb2O,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ti_pv', 'Sb', 'O'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Ti': 2.0, 'Sb': 2.0, 'O': 1.0}",GGA,mp-1070806,"['mp-1071055', 'mp-1071068', 'mp-1071083', 'mp-1071088', 'mp-1070806', 'mp-1071124', 'mp-1070846', 'mp-1070900', 'mp-1071137', 'mp-1423542', 'mp-1702174', 'mp-1785425', 'mp-1588663', 'mp-1070899', 'mp-1071129', 'mp-1071119']",0.001055,"{'Ba': 1.0, 'Ti': 2.0, 'Sb': 2.0, 'O': 1.0}",140.65105900950408,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0]",7.500832254158225e-06,0.001055,0,0.001055,MP,data/source/MP/cleaned/cifs/MP-mp-1070806.cif,True,,data/final/MP/graphs/Ba0.8Rb0.2Sb2Ti2O1-MP-mp-1070806-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
As1Fe0.7Gd1Ir0.3O1,3,0.15,2.0,False,As2Fe1.4Gd2Ir0.6O2,As2Fe2Gd2O2,11.6,Ferrite,True,As25Fe17.5Gd25Ir7.5O25,As-Fe-Gd-Ir-O,5,Supercon,Gd1Fe0.7Ir0.3As1O1,MP-mp-1078679,Gd2Fe2As2O2,As-Fe-Gd-O,As25Fe25Gd25O25,P 4/n m m,tetragonal,3.996524,3.996524,9.110606,data/final/MP/cifs/As1Fe0.7Gd1Ir0.3O1-MP-mp-1078679-synth_doped.cif,data/source/MP/raw/cifs/mp-1078679.cif,mp-1078679,0.0,,2018-04-12 14:54:44,6.938465251324023,,,{'GGA+U': {'task_id': 'mp-1704492'}},0.2756975050000001,4.06882668,520.0,-71.78498399,-8.97312299875,{'tags': ['Gadolinium iron arsenic oxide (1/1/1/1)']},-71.78498399,-8.97312299875,-1.670570473750001,['bandstructure'],True,"[425013, 422003, 425006, 425015, 425010, 236655, 425016]",True,2021-05-12 10:58:16.596000,FM,8,10,mp-1078679,oxide,GdFeAsO,"{'functional': 'PBE', 'labels': ['Gd', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Gd': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-1078679,"['mp-1078679', 'mp-1079389', 'mp-1079927', 'mp-1080502', 'mp-1080613', 'mp-1095209', 'mp-1438268', 'mp-1704492', 'mp-1864230', 'mp-1589235']",10.7990939,"{'Gd': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",145.5164583479414,[],FM,True,129,2,"[6.9, 6.9, 3.6, 3.6, 0.0, 0.0, 0.0, 0.0]",0.1484243641248952,10.7990939,4,21.5981878,MP,data/source/MP/cleaned/cifs/MP-mp-1078679.cif,True,,data/final/MP/graphs/As1Fe0.7Gd1Ir0.3O1-MP-mp-1078679-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Co4La3Sn13,1,0.0,2.0,False,Co8La6Sn26,Co8La6Sn26,2.425,Other,True,Co20La15Sn65,Co-La-Sn,3,Supercon,La3Co4Sn13,MP-mp-672373,La6Co8Sn26,Co-La-Sn,Co20La15Sn65,P m -3 n,cubic,9.698914,9.698914,9.698914,data/final/MP/cifs/Co4La3Sn13-MP-mp-672373.cif,data/source/MP/raw/cifs/mp-672373.cif,mp-672373,0.0,,2013-10-14 09:15:11,7.99242654410874,10.17188/1281868,"@misc{osti_1281868,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La3Co4Sn13 (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281868"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-944045'}},0.0,8.911701,520.0,-206.73708001,-5.16842700025,"{'tags': ['Perovskite', 'Lanthanum cobalt stannide (3/4/13)']}",-206.73708001,-5.16842700025,-0.4001406697500002,"['xas', 'bandstructure']",True,"[190476, 190477, 600229, 172793]",True,2021-05-12 10:57:34.594000,NM,40,8,mp-672373,,La3Co4Sn13,"{'functional': 'PBE', 'labels': ['La', 'Co', 'Sn_d'], 'pot_type': 'paw'}","{'La': 3.0, 'Co': 4.0, 'Sn': 13.0}",GGA,mp-672373,"['mp-944045', 'mp-672373', 'mp-933999', 'mp-944711', 'mp-1195815', 'mp-1199179', 'mp-1370987', 'mp-1920048']",0.000205,"{'La': 6.0, 'Co': 8.0, 'Sn': 26.0}",912.3664890991428,[],NM,False,155,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",4.49380818890913e-07,0.000205,0,0.00041,MP,data/source/MP/cleaned/cifs/MP-mp-672373.cif,False,,data/final/MP/graphs/Co4La3Sn13-MP-mp-672373.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
B2Ru3Tb1,1,0.0,1.0,True,B2Ru3Tb1,B2Ru3Tb1,0.0,Other,True,B33.333Ru50Tb16.667,B-Ru-Tb,3,Supercon,Tb1Ru3B2,MP-mp-3186,Tb1B2Ru3,B-Ru-Tb,B33.333Ru50Tb16.667,P 6/m m m,hexagonal,3.040492,5.515088000088087,5.515087729999999,data/final/MP/cifs/B2Ru3Tb1-MP-mp-3186.cif,data/source/MP/raw/cifs/mp-3186.cif,mp-3186,0.0,,2011-05-13 07:02:24,10.029916386695067,10.17188/1205945,"@misc{osti_1205945,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TbB2Ru3 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1205945"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695903'}},0.0,6.5332252,520.0,-48.62364523,-8.103940871666667,{'tags': ['Ruthenium terbium boride (3/1/2)']},-48.62364523,-8.103940871666667,-0.4678877705555552,"['xas', 'elasticity', 'bandstructure']",True,"[615370, 615376]",True,2021-05-12 10:56:20.740000,NM,6,8,mp-3186,,TbB2Ru3,"{'functional': 'PBE', 'labels': ['Tb_3', 'B', 'Ru_pv'], 'pot_type': 'paw'}","{'Tb': 1.0, 'B': 2.0, 'Ru': 3.0}",GGA,mp-3186,"['mp-1008241', 'mp-1001885', 'mp-3186', 'mp-1476091', 'mp-1695903', 'mp-1802148', 'mp-1012553', 'mp-1590689']",0.0050518,"{'Tb': 1.0, 'B': 2.0, 'Ru': 3.0}",80.09019691285602,[],NM,False,191,0,"[0, 0, 0, 0, 0, 0]",6.307638381132622e-05,0.0050518,0,0.0050518,MP,data/source/MP/cleaned/cifs/MP-mp-3186.cif,False,,data/final/MP/graphs/B2Ru3Tb1-MP-mp-3186.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Cu1Tl2O6.01,2,0.0008256956485839,1.9966680532445924,False,Ba3.993Cu1.997Tl3.993O12,Ba4Cu2Tl4O12,81.0,Cuprate,True,Ba18.165Cu9.083Tl18.165O54.58673932788375,Ba-Cu-Tl-O,4,Supercon,Tl2Ba2Cu1O6.01,MP-mp-6027,Ba4Tl4Cu2O12,Ba-Cu-Tl-O,Ba18.182Cu9.091Tl18.182O54.54545454545455,C m c a,orthorhombic,5.504110002693673,5.585743,12.28312762,data/final/MP/cifs/Ba2Cu1Tl2O6.01-MP-mp-6027-synth_doped.cif,data/source/MP/raw/cifs/mp-6027.cif,mp-6027,0.0,,2011-05-19 00:05:23,7.606665315628389,10.17188/1277350,"@misc{osti_1277350,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Tl2CuO6 (SG:64) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277350"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1673478'}},0.0059215576010052,4.10961464,520.0,-115.75418737,-5.261553971363636,"{'tags': ['Dithallium dibarium cuprate', 'Dithallium(III) dibarium copper oxide']}",-115.75418737,-5.261553971363636,-1.7862630028787878,"['xas', 'bandstructure']",True,"[202723, 202724, 202722]",True,2021-05-12 10:57:28.836000,NM,22,8,mp-6027,oxide,Ba2Tl2CuO6,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Tl_d', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Tl': 2.0, 'Cu': 1.0, 'O': 6.0}",GGA,mp-6027,"['mp-925246', 'mp-909581', 'mp-924678', 'mp-6027', 'mp-1504634', 'mp-1673478', 'mp-1837163', 'mp-1605186']",2.9e-05,"{'Ba': 4.0, 'Tl': 4.0, 'Cu': 2.0, 'O': 12.0}",368.0385386017736,[],NM,False,64,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.5759219189476614e-07,2.9e-05,0,5.8e-05,MP,data/source/MP/cleaned/cifs/MP-mp-6027.cif,True,,data/final/MP/graphs/Ba2Cu1Tl2O6.01-MP-mp-6027-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ba2Ca0.7Ce0.3Cu2Tl2O8,3,0.04,1.0,True,Ba2Ca0.7Ce0.3Cu2Tl2O8,Ba2Ca1Cu2Tl2O8,0.0,Cuprate,True,Ba13.333Ca4.667Ce2Cu13.333Tl13.333O53.333333333333336,Ba-Ca-Ce-Cu-Tl-O,6,Supercon,Tl2Ba2Ca0.7Ce0.3Cu2O8,MP-mp-6885,Ba2Ca1Tl2Cu2O8,Ba-Ca-Cu-Tl-O,Ba13.333Ca6.667Cu13.333Tl13.333O53.333333333333336,I 4/m m m,tetragonal,3.8887880015527454,3.8887880015527454,15.44888372,data/final/MP/cifs/Ba2Ca0.7Ce0.3Cu2Tl2O8-MP-mp-6885-synth_doped.cif,data/source/MP/raw/cifs/mp-6885.cif,mp-6885,0.0,,2011-05-16 00:12:29,7.06827160481344,10.17188/1284435,"@misc{osti_1284435,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2CaTl2(CuO4)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1284435"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1676611'}},0.0059098983148224,4.22920004,520.0,-81.10596699,-5.407064466,"{'tags': ['Dithallium(III) dibarium calcium dicopper oxide', 'Dithallium dibarium calcium dicopper oxide']}",-81.10596699,-5.407064466,-1.8834025184444445,"['xas', 'bandstructure']",True,"[78592, 78593, 65554]",True,2021-05-12 10:57:38.495000,NM,15,8,mp-6885,oxide,Ba2CaTl2(CuO4)2,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ca_sv', 'Tl_d', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Ca': 1.0, 'Tl': 2.0, 'Cu': 2.0, 'O': 8.0}",GGA,mp-6885,"['mp-6885', 'mp-556042', 'mvc-16338', 'mp-1423335', 'mp-1676611', 'mp-1777344', 'mp-1931767', 'mp-1607471']",0.0018692,"{'Ba': 2.0, 'Ca': 1.0, 'Tl': 2.0, 'Cu': 2.0, 'O': 8.0}",229.8977800758837,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",8.130570027179132e-06,0.0018692,0,0.0018692,MP,data/source/MP/cleaned/cifs/MP-mp-6885.cif,True,,data/final/MP/graphs/Ba2Ca0.7Ce0.3Cu2Tl2O8-MP-mp-6885-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B2Cu0.1Mg0.9,3,0.0666666666666666,1.0,True,B2Cu0.1Mg0.9,B2Mg1,38.6,Other,True,B66.667Cu3.333Mg30,B-Cu-Mg,3,Supercon,Mg0.9Cu0.1B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B2Cu0.1Mg0.9-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B2Cu0.1Mg0.9-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Hg5Tl2,3,0.0714285714285714,0.5,False,Hg2.5Tl1,Hg3Tl1,3.86,Other,True,Hg71.429Tl28.571,Hg-Tl,2,Supercon,Hg5Tl2,MP-mp-11474,Tl1Hg3,Hg-Tl,Hg75Tl25,P m -3 m,cubic,4.882347,4.882347,4.882347,data/final/MP/cifs/Hg5Tl2-MP-mp-11474-synth_doped.cif,data/source/MP/raw/cifs/mp-11474.cif,mp-11474,0.0,,2011-05-28 03:43:13,11.502197118273612,10.17188/1187866,"@misc{osti_1187866,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TlHg3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187866"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699447'}},0.0,3.01175198,520.0,-3.42042044,-0.85510511,{'tags': ['Mercury thallium (3/1)']},-3.42042044,-0.85510511,-0.0366840495833333,"['xas', 'bandstructure']",True,[104362],True,2021-05-12 10:56:51.169000,NM,4,8,mp-11474,,TlHg3,"{'functional': 'PBE', 'labels': ['Tl_d', 'Hg'], 'pot_type': 'paw'}","{'Tl': 1.0, 'Hg': 3.0}",GGA,mp-11474,"['mp-992171', 'mp-991934', 'mp-11474', 'mp-1440524', 'mp-1699447', 'mp-1785402', 'mp-993811', 'mp-1591331']",0.0003805,"{'Tl': 1.0, 'Hg': 3.0}",116.382029846436,[],NM,False,221,0,"[0, 0, 0, 0]",3.269405083431376e-06,0.0003805,0,0.0003805,MP,data/source/MP/cleaned/cifs/MP-mp-11474.cif,True,,data/final/MP/graphs/Hg5Tl2-MP-mp-11474-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Cd0.5Mg0.5,1,0.0,6.0,False,Cd3Mg3,Cd3Mg3,0.0,Other,True,Cd50Mg50,Cd-Mg,2,Supercon,Cd0.5Mg0.5,MP-mp-978274,Mg3Cd3,Cd-Mg,Cd50Mg50,A m m 2,orthorhombic,3.260389998980194,4.97684,8.19328629,data/final/MP/cifs/Cd0.5Mg0.5-MP-mp-978274.cif,data/source/MP/raw/cifs/mp-978274.cif,mp-978274,0.0,,2015-08-14 13:46:49,5.227325336375711,10.17188/1315889,"@misc{osti_1315889,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MgCd (SG:38) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1315889"",
    place = ""United States"",
    year = ""2016"",
    month = ""9"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1005672'}},0.0,3.44256769,520.0,-8.16309381,-1.3605156349999998,{'tags': []},-8.16309381,-1.3605156349999998,-0.0989307299999999,"['xas', 'elasticity']",False,[],True,2021-05-12 10:56:37.246000,NM,6,6,mp-978274,,MgCd,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Cd'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Cd': 1.0}",GGA,mp-978274,"['mp-1005672', 'mp-978274', 'mp-1005639', 'mp-978593', 'mp-1446157', 'mp-1779866']",1.3666666666666666e-06,"{'Mg': 3.0, 'Cd': 3.0}",130.28972433540252,[],NM,False,38,0,"[0, 0, 0, 0, 0, 0]",3.1468329685351414e-08,1.3666666666666666e-06,0,4.1e-06,MP,data/source/MP/cleaned/cifs/MP-mp-978274.cif,False,,data/final/MP/graphs/Cd0.5Mg0.5-MP-mp-978274.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
B2C1Mn0.2Ni1.8Y1,3,0.0666666666666666,1.0,True,B2C1Mn0.2Ni1.8Y1,B2C1Ni2Y1,8.7,Other,True,B33.333C16.667Mn3.333Ni30Y16.667,B-C-Mn-Ni-Y,5,Supercon,Y1Ni1.8Mn0.2B2C1,MP-mp-6576,Y1Ni2B2C1,B-C-Ni-Y,B33.333C16.667Ni33.333Y16.667,I 4/m m m,tetragonal,3.548790000501972,3.548790000501972,5.76144136,data/final/MP/cifs/B2C1Mn0.2Ni1.8Y1-MP-mp-6576-synth_doped.cif,data/source/MP/raw/cifs/mp-6576.cif,mp-6576,0.0,,2011-05-13 05:21:43,6.099730998852292,10.17188/1281366,"@misc{osti_1281366,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281366"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688230'}},0.0,6.81083016,520.0,-43.677878,-7.279646333333333,{'tags': []},-43.677878,-7.279646333333333,-0.5109282141666659,"['xas', 'bandstructure']",True,"[75816, 89142, 83231, 79574, 41549]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6576,,YNi2B2C,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6576,"['mp-6576', 'mp-1007054', 'mp-1000583', 'mp-1439516', 'mp-1688230', 'mp-1794280', 'mp-1011792', 'mp-1597064']",0.0006603,"{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.3152437079014,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",1.010943177297096e-05,0.0006603,0,0.0006603,MP,data/source/MP/cleaned/cifs/MP-mp-6576.cif,True,,data/final/MP/graphs/B2C1Mn0.2Ni1.8Y1-MP-mp-6576-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B0.09C0.91Cu1Sr2O5,2,0.0199999999999999,4.0,False,B0.36C3.64Cu4Sr8O20,C4Cu4Sr8O20,26.5,Cuprate,True,B1C10.111Cu11.111Sr22.222O55.55555555555556,B-C-Cu-Sr-O,5,Supercon,Sr2Cu1C0.91B0.09O5,MP-mp-1198030,Sr8Cu4C4O20,C-Cu-Sr-O,C11.111Cu11.111Sr22.222O55.55555555555556,I -4,tetragonal,7.877744002100394,7.877744002100395,9.46755054,data/final/MP/cifs/B0.09C0.91Cu1Sr2O5-MP-mp-1198030-synth_doped.cif,data/source/MP/raw/cifs/mp-1198030.cif,mp-1198030,0.0,,2019-01-12 02:53:33.853000,4.624821022244182,,,{'GGA': {'task_id': 'mp-1742814'}},0.0386187874999981,3.47889523,520.0,-237.90163358,-6.608378710555556,"{'tags': ['Distrontium copper dioxide carbonate - LT', 'Distrontium copper dioxide carbonate']}",-237.90163358,-6.608378710555556,-2.385069899259259,['bandstructure'],True,"[78650, 83095]",True,2021-05-12 10:58:37.524000,NM,36,6,mp-1198030,oxide,Sr2CuCO5,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Cu_pv', 'C', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Cu': 1.0, 'C': 1.0, 'O': 5.0}",GGA,mp-1198030,"['mp-1198030', 'mp-1200477', 'mp-1399692', 'mp-1742814', 'mp-1929945', 'mp-1655225']",0.000743875,"{'Sr': 8.0, 'Cu': 4.0, 'C': 4.0, 'O': 20.0}",475.08507610840775,[],NM,False,82,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.263088759540475e-06,0.000743875,0,0.0029755,MP,data/source/MP/cleaned/cifs/MP-mp-1198030.cif,True,,data/final/MP/graphs/B0.09C0.91Cu1Sr2O5-MP-mp-1198030-synth_doped.json,0,True,-4,0,0,0,0,2,0,0,0,0,1,0,1.0,False
Ga1Mo0.201V2.799,3,0.1005,2.0,False,Ga2Mo0.402V5.598,Ga2V6,11.7,Other,True,Ga25Mo5.025V69.975,Ga-Mo-V,3,Supercon,V2.799Mo0.201Ga1,MP-mp-22568,V6Ga2,Ga-V,Ga25V75,P m -3 n,cubic,4.789645,4.789645,4.789645,data/final/MP/cifs/Ga1Mo0.201V2.799-MP-mp-22568-synth_doped.cif,data/source/MP/raw/cifs/mp-22568.cif,mp-22568,0.0,,2014-02-22 11:36:40,6.726541666276222,10.17188/1198793,"@misc{osti_1198793,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Ga (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198793"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686867'}},0.0,5.67452231,520.0,-61.95244347,-7.74405543375,{'tags': ['Gallium vanadium (1/3)']},-61.95244347,-7.74405543375,-0.1741018756249994,"['xas', 'elasticity', 'bandstructure']",True,"[635643, 635628, 635619, 635634, 104021, 635646, 635604, 635610, 635617, 635624, 635626, 635605, 635631, 635625, 635636, 635603, 104020, 635616, 635607]",True,2021-05-12 10:56:16.728000,FM,8,9,mp-22568,,V3Ga,"{'functional': 'PBE', 'labels': ['V_pv', 'Ga_d'], 'pot_type': 'paw'}","{'V': 3.0, 'Ga': 1.0}",GGA,mp-22568,"['mp-941343', 'mp-941663', 'mp-934924', 'mp-22568', 'mp-1440749', 'mp-1686867', 'mp-1804076', 'mp-1593784', 'mp-1595713']",0.09063635,"{'V': 6.0, 'Ga': 2.0}",109.87780534443452,[],FM,True,131,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.0, -0.0, -0.0]",0.0016497662965852,0.09063635,2,0.1812727,MP,data/source/MP/cleaned/cifs/MP-mp-22568.cif,True,,data/final/MP/graphs/Ga1Mo0.201V2.799-MP-mp-22568-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Pt0.73W0.27,3,0.1266666666666666,3.0,False,Pt2.19W0.81,Pt2W1,0.213,Other,True,Pt73W27,Pt-W,2,Supercon,Pt0.73W0.27,MP-mp-1018129,Pt2W1,Pt-W,Pt66.667W33.333,I m m m,orthorhombic,2.806702001092154,3.968518001471925,4.83953462,data/final/MP/cifs/Pt0.73W0.27-MP-mp-1018129-synth_doped.cif,data/source/MP/raw/cifs/mp-1018129.cif,mp-1018129,0.0,,2017-04-07 02:55:47,20.44770330770152,10.17188/1350207,"@article{osti_1350207,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Pt2W (SG:71) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1350207"",
    place = ""United States"",
    year = ""2017"",
    month = ""4""
}
",{'GGA': {'task_id': 'mp-1667981'}},0.0,7.95916935,520.0,-26.10823111,-8.702743703333333,"{'tags': ['Tungsten platinum (1/2)', 'close-packed structure', 'MoPt2', 'WPt2 rt']}",-26.10823111,-8.702743703333333,-0.336096406666666,['bandstructure'],True,[649841],True,2021-05-12 10:58:09.072000,NM,3,12,mp-1018129,,Pt2W,"{'functional': 'PBE', 'labels': ['Pt', 'W_pv'], 'pot_type': 'paw'}","{'Pt': 2.0, 'W': 1.0}",GGA,mp-1018129,"['mp-1018605', 'mp-1018129', 'mp-1018497', 'mp-1018325', 'mp-1061916', 'mp-1061974', 'mp-1062045', 'mp-1438755', 'mp-1667981', 'mp-1793279', 'mp-1587339', 'mp-1061994']",0.000156,"{'Pt': 2.0, 'W': 1.0}",46.61465858524704,[],NM,False,71,0,"[0, 0, 0]",3.3465867762329177e-06,0.000156,0,0.000156,MP,data/source/MP/cleaned/cifs/MP-mp-1018129.cif,True,,data/final/MP/graphs/Pt0.73W0.27-MP-mp-1018129-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,0,1,0,1.0,False
Ce0.2Cu1Sm1.8O4,3,0.0571428571428571,1.0,True,Ce0.2Cu1Sm1.8O4,Cu1Sm2O4,14.7,Cuprate,True,Ce2.857Cu14.286Sm25.714O57.142857142857146,Ce-Cu-Sm-O,4,Supercon,Sm1.8Ce0.2Cu1O4,MP-mp-4210,Sm2Cu1O4,Cu-Sm-O,Cu14.286Sm28.571O57.142857142857146,I 4/m m m,tetragonal,3.936481999770292,3.936481999770292,6.66682973,data/final/MP/cifs/Ce0.2Cu1Sm1.8O4-MP-mp-4210-synth_doped.cif,data/source/MP/raw/cifs/mp-4210.cif,mp-4210,0.0,,2011-05-13 10:20:22,7.575626216473968,10.17188/1207966,"@misc{osti_1207966,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sm2CuO4 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207966"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-670158'}},0.0084157301785579,3.24265454,520.0,-51.71666507,-7.38809501,"{'tags': ['Samarium cuprate', 'Disamarium copper oxide', 'Disamarium copper tetraoxide']}",-51.71666507,-7.38809501,-3.0194917299999995,"['xas', 'elasticity', 'bandstructure']",True,"[261378, 72243, 71182, 95371, 261377]",True,2021-05-12 10:56:20.740000,NM,7,8,mp-4210,oxide,Sm2CuO4,"{'functional': 'PBE', 'labels': ['Sm_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sm': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-4210,"['mp-660482', 'mp-670158', 'mp-4210', 'mp-1412888', 'mp-1702500', 'mp-1798108', 'mp-1589420', 'mp-688388']",0.0004776,"{'Sm': 2.0, 'Cu': 1.0, 'O': 4.0}",93.8732216032902,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",5.087712894507291e-06,0.0004776,0,0.0004776,MP,data/source/MP/cleaned/cifs/MP-mp-4210.cif,True,,data/final/MP/graphs/Ce0.2Cu1Sm1.8O4-MP-mp-4210-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ir1Te2.67,2,0.0004954173891503,2.9961273408239704,False,Ir2.996Te8,Ir3Te8,0.0,Other,True,Ir27.248Te72.752,Ir-Te,2,Supercon,Ir1Te2.67,MP-mp-1217357,Te8Ir3,Ir-Te,Ir27.273Te72.727,R -3,trigonal,6.52222488,6.52222488,6.52222535,data/final/MP/cifs/Ir1Te2.67-MP-mp-1217357-synth_doped.cif,data/source/MP/raw/cifs/mp-1217357.cif,mp-1217357,0.0,,2019-01-12 18:42:25.881000,9.564033671940267,,,{'GGA': {'task_id': 'mp-1736922'}},0.0,8.17849821,520.0,-54.4671156,-4.951555963636364,{'tags': []},-54.4671156,-4.951555963636364,-0.5619469909090905,[],False,[],True,2021-05-12 11:00:40.103000,NM,11,4,mp-1217357,,Te8Ir3,"{'functional': 'PBE', 'labels': ['Te', 'Ir'], 'pot_type': 'paw'}","{'Te': 8.0, 'Ir': 3.0}",GGA,mp-1217357,"['mp-1217357', 'mp-1412611', 'mp-1736922', 'mp-1924368']",0.0009307,"{'Te': 8.0, 'Ir': 3.0}",277.3547107285637,[],NM,False,148,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.3556307645008416e-06,0.0009307,0,0.0009307,MP,data/source/MP/cleaned/cifs/MP-mp-1217357.cif,True,,data/final/MP/graphs/Ir1Te2.67-MP-mp-1217357-synth_doped.json,0,True,-3,0,0,0,0,0,0,2,1,0,0,0,1.0,False
Ni1Te1,1,0.0,2.0,False,Ni2Te2,Ni2Te2,0.0,Ferrite,True,Ni50Te50,Ni-Te,2,Supercon,Ni1Te1,MP-mp-10264,Ni2Te2,Ni-Te,Ni50Te50,R -3 m,trigonal,3.856730410614349,3.856730410614349,7.05811789,data/final/MP/cifs/Ni1Te1-MP-mp-10264.cif,data/source/MP/raw/cifs/mp-10264.cif,mp-10264,0.0,,2011-05-28 03:52:03,7.171055075228673,10.17188/1186862,"@misc{osti_1186862,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NiTe (SG:166) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1186862"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695641'}},0.0025339618749979,6.62515263,520.0,-18.60977163,-4.6524429075,{'tags': ['Nickel telluride - beta']},-18.60977163,-4.6524429075,-0.4017241025000002,"['xas', 'elasticity', 'bandstructure']",True,[76730],True,2021-05-12 10:56:10.715000,NM,4,8,mp-10264,,NiTe,"{'functional': 'PBE', 'labels': ['Ni_pv', 'Te'], 'pot_type': 'paw'}","{'Ni': 1.0, 'Te': 1.0}",GGA,mp-10264,"['mp-926299', 'mp-910528', 'mp-926835', 'mp-10264', 'mp-1438259', 'mp-1695641', 'mp-1798989', 'mp-1595268']",4.28e-05,"{'Ni': 2.0, 'Te': 2.0}",86.27669577335544,[],NM,False,166,0,"[0, 0, 0, 0]",9.921566795379706e-07,4.28e-05,0,8.56e-05,MP,data/source/MP/cleaned/cifs/MP-mp-10264.cif,False,,data/final/MP/graphs/Ni1Te1-MP-mp-10264.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Pd0.003Pt2.997U1,2,0.0015,2.0,False,Pd0.006Pt5.994U2,Pt6U2,0.4785,Heavy_fermion,True,Pd0.075Pt74.925U25,Pd-Pt-U,3,Supercon,U1Pt2.997Pd0.003,MP-mp-30855,U2Pt6,Pt-U,Pt75U25,P 63/m m c,hexagonal,4.997603,5.777009996166576,5.7770105,data/final/MP/cifs/Pd0.003Pt2.997U1-MP-mp-30855-synth_doped.cif,data/source/MP/raw/cifs/mp-30855.cif,mp-30855,0.0,,2014-02-19 21:36:23,18.929034548497903,10.17188/1205211,"@misc{osti_1205211,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UPt3 (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1205211"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687777'}},0.0,9.26919984,520.0,-64.84444661,-8.10555582625,"{'tags': ['Platinum uranium (3/1)', 'Uranium platinum boride (1/3/0.11)', 'Uranium platinum (1/3)']}",-64.84444661,-8.10555582625,-0.7295225412500006,"['xas', 'bandstructure']",True,"[615213, 649804, 105833, 191938]",True,2021-05-12 10:57:04.957000,FM,8,11,mp-30855,,UPt3,"{'functional': 'PBE', 'labels': ['U', 'Pt'], 'pot_type': 'paw'}","{'U': 1.0, 'Pt': 3.0}",GGA,mp-30855,"['mp-943077', 'mp-932790', 'mp-942062', 'mp-30855', 'mp-1078485', 'mp-1079639', 'mp-1092253', 'mp-1299942', 'mp-1687777', 'mp-1924669', 'mp-1595664']",0.6726182,"{'U': 2.0, 'Pt': 6.0}",144.44372324836635,[],FM,True,187,1,"[0.0, 1.4, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0093132215768691,0.6726182,1,1.3452364,MP,data/source/MP/cleaned/cifs/MP-mp-30855.cif,True,,data/final/MP/graphs/Pd0.003Pt2.997U1-MP-mp-30855-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ir0.1Os1.9Th1,3,0.0666666666666667,2.0,False,Ir0.2Os3.8Th2,Os4Th2,2.25,Other,True,Ir3.333Os63.333Th33.333,Ir-Os-Th,3,Supercon,Th1Ir0.1Os1.9,MP-mp-1828,Th2Os4,Os-Th,Os66.667Th33.333,F d -3 m,cubic,5.4667698,5.466769799999999,5.466769799999999,data/final/MP/cifs/Ir0.1Os1.9Th1-MP-mp-1828-synth_doped.cif,data/source/MP/raw/cifs/mp-1828.cif,mp-1828,0.0,,2011-05-13 23:04:00,17.607854773817674,10.17188/1193028,"@misc{osti_1193028,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ThOs2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1193028"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1674243'}},0.0,8.41198096,520.0,-61.27169294,-10.211948823333334,"{'tags': ['Osmium technetium (2/1)', 'Osmium thorium (2/1)', 'Thorium osmium (1/2)']}",-61.27169294,-10.211948823333334,-0.2557519033333335,"['xas', 'elasticity', 'bandstructure']",True,"[647835, 105570, 150741, 647836, 647839, 105571]",True,2021-05-12 10:56:14.760000,NM,6,8,mp-1828,,ThOs2,"{'functional': 'PBE', 'labels': ['Th', 'Os_pv'], 'pot_type': 'paw'}","{'Th': 1.0, 'Os': 2.0}",GGA,mp-1828,"['mp-912732', 'mp-929076', 'mp-929475', 'mp-1828', 'mp-1437688', 'mp-1674243', 'mp-1804824', 'mp-1588973']",4.25e-06,"{'Th': 2.0, 'Os': 4.0}",115.52536863934976,[],NM,False,74,0,"[0.0, 0.0, -0.0, 0.0, 0.0, -0.0]",7.357691302016556e-08,4.25e-06,0,8.5e-06,MP,data/source/MP/cleaned/cifs/MP-mp-1828.cif,True,,data/final/MP/graphs/Ir0.1Os1.9Th1-MP-mp-1828-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
As0.15Fe1La1P0.85O1,3,0.075,2.0,False,As0.3Fe2La2P1.7O2,Fe2La2P2O2,11.67,Ferrite,True,As3.75Fe25La25P21.25O25,As-Fe-La-P-O,5,Supercon,La1Fe1As0.15P0.85O1,MP-mp-510668,La2Fe2P2O2,Fe-La-P-O,Fe25La25P25O25,P 4/n m m,tetragonal,4.068879,4.068879,9.084981,data/final/MP/cifs/As0.15Fe1La1P0.85O1-MP-mp-510668-synth_doped.cif,data/source/MP/raw/cifs/mp-510668.cif,mp-510668,0.0,,2014-02-26 04:17:37,5.337337070142887,,,{'GGA+U': {'task_id': 'mp-1704083'}},0.3903949226041714,6.29241646,520.0,-55.52669053,-6.94083631625,{'tags': []},-55.52669053,-6.94083631625,-1.734766549583334,"['xas', 'bandstructure']",True,"[162724, 420381, 391428]",True,2021-05-12 10:57:15.388000,FM,8,7,mp-510668,oxide,LaFePO,"{'functional': 'PBE', 'labels': ['La', 'Fe_pv', 'P', 'O'], 'pot_type': 'paw'}","{'La': 1.0, 'Fe': 1.0, 'P': 1.0, 'O': 1.0}",GGA+U,mp-510668,"['mp-542977', 'mp-510668', 'mp-1422599', 'mp-1704083', 'mp-1768909', 'mp-1779846', 'mp-1595432']",3.95130975,"{'La': 2.0, 'Fe': 2.0, 'P': 2.0, 'O': 2.0}",150.40891327693348,[],FM,True,129,1,"[0.0, 0.0, 3.7, 3.7, 0.0, 0.0, 0.0, 0.0]",0.0525408988591631,3.95130975,2,7.9026195,MP,data/source/MP/cleaned/cifs/MP-mp-510668.cif,True,,data/final/MP/graphs/As0.15Fe1La1P0.85O1-MP-mp-510668-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
As1Fe1Sm1O0.8,3,0.0789473684210526,2.0,False,As2Fe2Sm2O1.6,As2Fe2Sm2O2,40.1,Ferrite,True,As26.316Fe26.316Sm26.316O21.05263157894737,As-Fe-Sm-O,4,Supercon,Sm1Fe1As1O0.8,MP-mp-20349,Sm2Fe2As2O2,As-Fe-Sm-O,As25Fe25Sm25O25,P 4/n m m,tetragonal,4.026492,4.026492,9.046755,data/final/MP/cifs/As1Fe1Sm1O0.8-MP-mp-20349-synth_doped.cif,data/source/MP/raw/cifs/mp-20349.cif,mp-20349,0.0,,2014-02-19 11:24:42,6.727802583283198,,,{'GGA+U': {'task_id': 'mp-1695938'}},0.3015723809374986,3.77685593,520.0,-52.73407138,-6.5917589225,{'tags': ['Samarium iron arsenic oxide (1/1/1/1)']},-52.73407138,-6.5917589225,-1.6285904237499995,"['xas', 'elasticity', 'bandstructure']",True,"[236652, 236653, 422002, 163457, 163458]",True,2021-05-12 10:56:16.728000,FM,8,10,mp-20349,oxide,SmFeAsO,"{'functional': 'PBE', 'labels': ['Sm_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Sm': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-20349,"['mp-24944', 'mp-1078897', 'mp-1079866', 'mp-1173321', 'mp-20349', 'mp-1425472', 'mp-1695938', 'mp-1772503', 'mp-1789694', 'mp-1588381']",3.75729895,"{'Sm': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",146.67176231613362,[],FM,True,129,1,"[0.0, 0.0, 3.5, 3.5, -0.0, -0.0, -0.0, -0.0]",0.0512341147425717,3.75729895,2,7.5145979,MP,data/source/MP/cleaned/cifs/MP-mp-20349.cif,True,,data/final/MP/graphs/As1Fe1Sm1O0.8-MP-mp-20349-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Co1.9Cu1Ir0.1S4,2,0.0285714285714285,2.0,False,Co3.8Cu2Ir0.2S8,Co4Cu2S8,0.0,Other,True,Co27.143Cu14.286Ir1.429S57.143,Co-Cu-Ir-S,4,Supercon,Cu1Co1.9Ir0.1S4,MP-mp-3925,Co4Cu2S8,Co-Cu-S,Co28.571Cu14.286S57.143,F d -3 m,cubic,6.69987918,6.699879179999999,6.699879179999999,data/final/MP/cifs/Co1.9Cu1Ir0.1S4-MP-mp-3925-synth_doped.cif,data/source/MP/raw/cifs/mp-3925.cif,mp-3925,0.0,,2011-05-15 03:07:38,4.836104359598833,10.17188/1207634,"@misc{osti_1207634,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Co2CuS4 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207634"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698326'}},0.0,5.68331854,520.0,-75.59837827,-5.399884162142857,"{'tags': ['Cobalt copper sulfide (2/1/4)', 'Carrollite', 'Dicobalt(III) copper sulfide']}",-75.59837827,-5.399884162142857,-0.7070782010714284,"['xas', 'bandstructure']",True,"[622571, 31107, 52943]",True,2021-05-12 10:57:08.928000,NM,14,8,mp-3925,,Co2CuS4,"{'functional': 'PBE', 'labels': ['Co', 'Cu_pv', 'S'], 'pot_type': 'paw'}","{'Co': 2.0, 'Cu': 1.0, 'S': 4.0}",GGA,mp-3925,"['mp-931396', 'mp-915858', 'mp-932359', 'mp-3925', 'mp-1425952', 'mp-1698326', 'mp-1833413', 'mp-1599756']",0.00593025,"{'Co': 4.0, 'Cu': 2.0, 'S': 8.0}",212.6600516474575,[],NM,False,227,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",5.5772110972972206e-05,0.00593025,0,0.0118605,MP,data/source/MP/cleaned/cifs/MP-mp-3925.cif,True,,data/final/MP/graphs/Co1.9Cu1Ir0.1S4-MP-mp-3925-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Be12Cr1,1,0.0,1.0,True,Be12Cr1,Be12Cr1,0.0,Other,True,Be92.308Cr7.692,Be-Cr,2,Supercon,Be12Cr1,MP-mp-1590,Be12Cr1,Be-Cr,Be92.308Cr7.692,I 4/m m m,tetragonal,4.122573997686816,5.488657609908502,5.48865761,data/final/MP/cifs/Be12Cr1-MP-mp-1590.cif,data/source/MP/raw/cifs/mp-1590.cif,mp-1590,0.0,,2011-05-13 08:23:50,2.4927677730586453,10.17188/1191437,"@misc{osti_1191437,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Be12Cr (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191437"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699787'}},0.0002578444230803,4.66657275,520.0,-55.1839951,-4.2449227,"{'tags': ['Beryllium chromium (12/1)', 'Chromium beryllium (1/12)']}",-55.1839951,-4.2449227,-0.0506148653846151,"['xas', 'elasticity', 'bandstructure']",True,"[58698, 616228, 616222, 150599, 616220]",True,2021-05-12 10:56:12.755000,NM,13,8,mp-1590,,Be12Cr,"{'functional': 'PBE', 'labels': ['Be_sv', 'Cr_pv'], 'pot_type': 'paw'}","{'Be': 12.0, 'Cr': 1.0}",GGA,mp-1590,"['mp-913650', 'mp-929992', 'mp-930505', 'mp-1590', 'mp-1418154', 'mp-1699787', 'mp-1934294', 'mp-1596442']",0.0023639,"{'Be': 12.0, 'Cr': 1.0}",106.67761420481744,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0]",2.215928822200121e-05,0.0023639,0,0.0023639,MP,data/source/MP/cleaned/cifs/MP-mp-1590.cif,False,,data/final/MP/graphs/Be12Cr1-MP-mp-1590.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B2C1Dy0.2Ni2Tb0.8,3,0.0666666666666666,1.0,True,B2C1Dy0.2Ni2Tb0.8,B2C1Ni2Tb1,0.0,Other,True,B33.333C16.667Dy3.333Ni33.333Tb13.333,B-C-Dy-Ni-Tb,5,Supercon,Dy0.2Tb0.8Ni2B2C1,MP-mp-6092,Tb1Ni2B2C1,B-C-Ni-Tb,B33.333C16.667Ni33.333Tb16.667,I 4/m m m,tetragonal,3.5665140003823987,3.5665140003823987,5.7333997100000005,data/final/MP/cifs/B2C1Dy0.2Ni2Tb0.8-MP-mp-6092-synth_doped.cif,data/source/MP/raw/cifs/mp-6092.cif,mp-6092,0.0,,2011-05-13 04:21:03,7.858244682564482,10.17188/1277657,"@misc{osti_1277657,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TbNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277657"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686417'}},0.0,6.76233636,520.0,-41.85355222,-6.975592036666666,{'tags': []},-41.85355222,-6.975592036666666,-0.5122247530555543,"['xas', 'elasticity', 'bandstructure']",True,"[89159, 89157, 79572, 56648, 89155, 89156, 89160, 89158]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-6092,,TbNi2B2C,"{'functional': 'PBE', 'labels': ['Tb_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Tb': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6092,"['mp-1007320', 'mp-1000865', 'mp-6092', 'mp-1440112', 'mp-1686417', 'mp-1793943', 'mp-1012059', 'mp-1590555']",0.0029604,"{'Tb': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.4949740949675,[],NM,False,139,0,"[-0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",4.520041485484718e-05,0.0029604,0,0.0029604,MP,data/source/MP/cleaned/cifs/MP-mp-6092.cif,True,,data/final/MP/graphs/B2C1Dy0.2Ni2Tb0.8-MP-mp-6092-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
S1Tl2,1,0.0,9.0,False,S9Tl18,S9Tl18,0.0,Other,True,S33.333Tl66.667,S-Tl,2,Supercon,S1Tl2,MP-mp-556516,Tl18S9,S-Tl,S33.333Tl66.667,R 3,trigonal,9.6759225,9.6759225,9.67592253,data/final/MP/cifs/S1Tl2-MP-mp-556516.cif,data/source/MP/raw/cifs/mp-556516.cif,mp-556516,0.899,,2013-12-30 21:06:37,7.504253966445805,10.17188/1269388,"@misc{osti_1269388,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Tl2S (SG:146) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1269388"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1742717'}},0.0,3.7069491,520.0,-89.03421956,-3.2975636874074072,"{'tags': ['Thallium sulfide', 'Thallium sulfide (2/1)', 'Carlinite']}",-89.03421956,-3.2975636874074072,-0.5113183006712964,"['xas', 'bandstructure']",True,"[651238, 42550, 651235, 651245]",True,2021-05-12 10:57:17.297000,NM,27,10,mp-556516,,Tl2S,"{'functional': 'PBE', 'labels': ['Tl_d', 'S'], 'pot_type': 'paw'}","{'Tl': 2.0, 'S': 1.0}",GGA,mp-556516,"['mp-687731', 'mp-708312', 'mp-714749', 'mp-556516', 'mp-1192868', 'mp-1194008', 'mp-1194074', 'mp-1392139', 'mp-1742717', 'mp-1872847']",0.0006016444444444,"{'Tl': 18.0, 'S': 9.0}",877.923757882407,[],NM,False,146,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.167733759775165e-06,0.0006016444444444,0,0.0054148,MP,data/source/MP/cleaned/cifs/MP-mp-556516.cif,False,,data/final/MP/graphs/S1Tl2-MP-mp-556516.json,0,True,3,0,0,0,0,0,0,1,1,0,0,0,1.0,False
Cr0.3Si1V2.7,3,0.1499999999999999,2.0,False,Cr0.6Si2V5.4,Si2V6,11.3,Other,True,Cr7.5Si25V67.5,Cr-Si-V,3,Supercon,V2.7Cr0.3Si1,MP-mp-2567,V6Si2,Si-V,Si25V75,P m -3 n,cubic,4.702381,4.702381,4.702381,data/final/MP/cifs/Cr0.3Si1V2.7-MP-mp-2567-synth_doped.cif,data/source/MP/raw/cifs/mp-2567.cif,mp-2567,0.0,,2011-05-13 19:15:43,5.778142190030859,10.17188/1200874,"@misc{osti_1200874,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Si (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1200874"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668672'}},0.0,7.30599425,520.0,-69.05773321,-8.63221665125,{'tags': ['Vanadium silicide (3/1)']},-69.05773321,-8.63221665125,-0.4452085937499994,"['xas', 'elasticity', 'bandstructure']",True,"[652491, 87328, 652522, 652502, 652510, 652520, 600518, 186003, 652507, 652513, 652497, 601150, 652514, 652487, 22412, 652509, 652529, 652532, 652499, 652539, 652537, 652533, 652512, 652538, 652490, 652493, 652494, 652511, 652519, 87329, 652526, 652500]",True,2021-05-12 10:56:18.721000,FM,8,13,mp-2567,,V3Si,"{'functional': 'PBE', 'labels': ['V_pv', 'Si'], 'pot_type': 'paw'}","{'V': 3.0, 'Si': 1.0}",GGA,mp-2567,"['mp-920081', 'mp-906309', 'mp-919083', 'mp-2567', 'mp-1078474', 'mp-1078852', 'mp-1138781', 'mp-1145907', 'mp-1440678', 'mp-1668672', 'mp-1795955', 'mp-1593554', 'mp-1596575']",0.8382519,"{'V': 6.0, 'Si': 2.0}",103.98086881866836,[],FM,True,131,1,"[0.2, 0.3, 0.3, 0.2, 0.3, 0.3, 0.0, 0.0]",0.0161231947669493,0.8382519,6,1.6765038,MP,data/source/MP/cleaned/cifs/MP-mp-2567.cif,True,,data/final/MP/graphs/Cr0.3Si1V2.7-MP-mp-2567-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Sn1Ti3,1,0.0,2.0,False,Sn2Ti6,Sn2Ti6,0.0,Other,True,Sn25Ti75,Sn-Ti,2,Supercon,Sn1Ti3,MP-mp-1079460,Ti6Sn2,Sn-Ti,Sn25Ti75,C m c m,orthorhombic,4.743724,5.763402000129643,6.00496081,data/final/MP/cifs/Sn1Ti3-MP-mp-1079460.cif,data/source/MP/raw/cifs/mp-1079460.cif,mp-1079460,0.0,,2018-04-15 04:45:44,6.048168578219389,,,{'GGA': {'task_id': 'mp-1697773'}},0.0,7.55803172,520.0,-57.7892079,-7.2236509875,{'tags': ['Titanium tin (3/1)']},-57.7892079,-7.2236509875,-0.29963901125,['bandstructure'],True,[189761],True,2021-05-12 10:58:16.596000,NM,8,6,mp-1079460,,Ti3Sn,"{'functional': 'PBE', 'labels': ['Ti_pv', 'Sn_d'], 'pot_type': 'paw'}","{'Ti': 3.0, 'Sn': 1.0}",GGA,mp-1079460,"['mp-1079460', 'mp-1431770', 'mp-1697773', 'mp-1785433', 'mp-1881916', 'mp-1589092']",0.0003377,"{'Ti': 6.0, 'Sn': 2.0}",144.0362177296152,[],NM,False,63,0,"[0, 0, 0, 0, 0, 0, 0, 0]",4.68909841320508e-06,0.0003377,0,0.0006754,MP,data/source/MP/cleaned/cifs/MP-mp-1079460.cif,False,,data/final/MP/graphs/Sn1Ti3-MP-mp-1079460.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Cu2In1Ti1,1,0.0,1.0,True,Cu2In1Ti1,Cu2In1Ti1,0.0,Other,True,Cu50In25Ti25,Cu-In-Ti,3,Supercon,Cu2In1Ti1,MP-mp-22725,Ti1In1Cu2,Cu-In-Ti,Cu50In25Ti25,F m -3 m,cubic,4.42808793,4.42808793,4.42808793,data/final/MP/cifs/Cu2In1Ti1-MP-mp-22725.cif,data/source/MP/raw/cifs/mp-22725.cif,mp-22725,0.0,,2014-02-21 09:12:19,7.837531509132825,10.17188/1198929,"@misc{osti_1198929,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TiInCu2 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198929"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678250'}},0.0,8.16651156,520.0,-19.2824355,-4.820608875,"{'tags': ['Copper indium titanium (2/1/1)', 'Titanium copper indium (1/2/1)']}",-19.2824355,-4.820608875,-0.1092116033333336,"['xas', 'elasticity', 'bandstructure']",True,"[103020, 54597]",True,2021-05-12 10:56:16.728000,NM,4,8,mp-22725,,TiInCu2,"{'functional': 'PBE', 'labels': ['Ti_pv', 'In_d', 'Cu_pv'], 'pot_type': 'paw'}","{'Ti': 1.0, 'In': 1.0, 'Cu': 2.0}",GGA,mp-22725,"['mp-992223', 'mp-991769', 'mp-22725', 'mp-1383001', 'mp-1678250', 'mp-1791189', 'mp-993859', 'mp-1592093']",0.0002017,"{'Ti': 1.0, 'In': 1.0, 'Cu': 2.0}",61.39509978893704,[],NM,False,225,0,"[0, 0, 0, 0]",3.285278478142402e-06,0.0002017,0,0.0002017,MP,data/source/MP/cleaned/cifs/MP-mp-22725.cif,False,,data/final/MP/graphs/Cu2In1Ti1-MP-mp-22725.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Cu1La1.862Sr0.138O4,2,0.0394285714285714,1.0,True,Cu1La1.862Sr0.138O4,Cu1La2O4,33.0,Cuprate,True,Cu14.286La26.6Sr1.971O57.142857142857146,Cu-La-Sr-O,4,Supercon,La1.862Sr0.138Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La1.862Sr0.138O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La1.862Sr0.138O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
P2Pd2Yb1,1,0.0,1.0,True,P2Pd2Yb1,P2Pd2Yb1,0.0,Heavy_fermion,True,P40Pd40Yb20,P-Pd-Yb,3,Supercon,Yb1Pd2P2,MP-mp-1206959,Yb1P2Pd2,P-Pd-Yb,P40Pd40Yb20,I 4/m m m,tetragonal,4.141718001852192,4.141718001852192,5.67532699,data/final/MP/cifs/P2Pd2Yb1-MP-mp-1206959.cif,data/source/MP/raw/cifs/mp-1206959.cif,mp-1206959,0.0,,2019-01-12 10:09:54.589000,8.917532656454876,,,{'GGA': {'task_id': 'mp-1757098'}},0.0,5.8773535,520.0,-27.32023676,-5.464047352,"{'tags': ['YbPd2P2', 'CeAl2Ga2']}",-27.32023676,-5.464047352,-0.9188519693333334,['bandstructure'],True,[],True,2021-05-12 10:58:39.488000,NM,5,5,mp-1206959,,Yb(PPd)2,"{'functional': 'PBE', 'labels': ['Yb_2', 'P', 'Pd'], 'pot_type': 'paw'}","{'Yb': 1.0, 'P': 2.0, 'Pd': 2.0}",GGA,mp-1206959,"['mp-1206959', 'mp-1394439', 'mp-1757098', 'mp-1799557', 'mp-1585345']",0.0008981,"{'Yb': 1.0, 'P': 2.0, 'Pd': 2.0}",83.39022993792746,[],NM,False,139,0,"[0, 0, 0, 0, 0]",1.0769846787429555e-05,0.0008981,0,0.0008981,MP,data/source/MP/cleaned/cifs/MP-mp-1206959.cif,False,,data/final/MP/graphs/P2Pd2Yb1-MP-mp-1206959.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
In1La3,1,0.0,1.0,True,In1La3,In1La3,9.61,Other,True,In25La75,In-La,2,Supercon,In1La3,MP-mp-20909,La3In1,In-La,In25La75,P m -3 m,cubic,5.076766,5.076766,5.076766,data/final/MP/cifs/In1La3-MP-mp-20909.cif,data/source/MP/raw/cifs/mp-20909.cif,mp-20909,0.0,,2014-02-21 06:52:52,6.7455760598452565,10.17188/1196104,"@misc{osti_1196104,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La3In (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196104"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671685'}},0.0,8.16935076,520.0,-18.73796121,-4.6844903025,"{'tags': ['Indium lanthanum (1/3)', 'Lanthanum indium (3/1)']}",-18.73796121,-4.6844903025,-0.2945640412500001,"['xas', 'bandstructure']",True,"[639844, 51950, 639851, 639840, 603208, 107019]",True,2021-05-12 10:56:57.051000,NM,4,8,mp-20909,,La3In,"{'functional': 'PBE', 'labels': ['La', 'In_d'], 'pot_type': 'paw'}","{'La': 3.0, 'In': 1.0}",GGA,mp-20909,"['mp-906743', 'mp-921394', 'mp-920373', 'mp-20909', 'mp-1476042', 'mp-1671685', 'mp-1778647', 'mp-1590323']",0.0489742,"{'La': 3.0, 'In': 1.0}",130.84629766481785,[],NM,False,221,0,"[0, 0, 0, 0]",0.0003742880071811,0.0489742,0,0.0489742,MP,data/source/MP/cleaned/cifs/MP-mp-20909.cif,False,,data/final/MP/graphs/In1La3-MP-mp-20909.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Cu1Hg1O4.22,2,0.0267639902676398,0.9479668246445496,True,Ba1.896Cu0.948Hg0.948O4,Ba2Cu1Hg1O4,97.0,Cuprate,True,Ba24.331Cu12.165Hg12.165O51.338199513382,Ba-Cu-Hg-O,4,Supercon,Hg1Ba2Cu1O4.22,MP-mp-6562,Ba2Cu1Hg1O4,Ba-Cu-Hg-O,Ba25Cu12.5Hg12.5O50,P 4/m m m,tetragonal,3.933714,3.933714,9.827602,data/final/MP/cifs/Ba2Cu1Hg1O4.22-MP-mp-6562-synth_doped.cif,data/source/MP/raw/cifs/mp-6562.cif,mp-6562,0.0,,2011-05-13 18:18:06,6.582036471328142,10.17188/1281336,"@misc{osti_1281336,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2CuHgO4 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281336"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697135'}},0.0234340381250053,2.58068675,520.0,-40.91481298,-5.1143516225,"{'tags': ['Mercury dibarium copper oxide', 'High pressure experimental phase']}",-40.91481298,-5.1143516225,-1.953767533125,"['xas', 'bandstructure']",True,"[75722, 75720, 75724, 75721, 75723]",True,2021-05-12 10:57:32.679000,NM,8,8,mp-6562,oxide,Ba2CuHgO4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Cu_pv', 'Hg', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",GGA,mp-6562,"['mp-6562', 'mp-990899', 'mp-992892', 'mp-1435690', 'mp-1697135', 'mp-1878488', 'mp-994198', 'mp-1592659']",0.0003984,"{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",152.07335344042525,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0, 0, 0]",2.619788352047311e-06,0.0003984,0,0.0003984,MP,data/source/MP/cleaned/cifs/MP-mp-6562.cif,True,,data/final/MP/graphs/Ba2Cu1Hg1O4.22-MP-mp-6562-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Co1Ga5Np1,1,0.0,1.0,True,Co1Ga5Np1,Co1Ga5Np1,0.0,Heavy_fermion,True,Co14.286Ga71.429Np14.286,Co-Ga-Np,3,Supercon,Np1Co1Ga5,MP-mp-1025325,Np1Ga5Co1,Co-Ga-Np,Co14.286Ga71.429Np14.286,P 4/m m m,tetragonal,4.218215,4.218215,6.690531,data/final/MP/cifs/Co1Ga5Np1-MP-mp-1025325.cif,data/source/MP/raw/cifs/mp-1025325.cif,mp-1025325,0.0,,2016-10-02 11:35:46,8.990554608535136,10.17188/1355555,"@article{osti_1355555,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NpGa5Co (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1355555"",
    place = ""United States"",
    year = ""2017"",
    month = ""5""
}
",{'GGA': {'task_id': 'mp-1723682'}},0.0079029249999997,6.05694091,520.0,-36.7413474,-5.248763914285715,"{'tags': ['NpCoGa5', 'HoCoGa5']}",-36.7413474,-5.248763914285715,-0.2206814016071437,"['bandstructure', 'elasticity']",True,[],True,2021-05-12 10:56:10.715000,FM,7,5,mp-1025325,,NpGa5Co,"{'functional': 'PBE', 'labels': ['Np', 'Ga_d', 'Co'], 'pot_type': 'paw'}","{'Np': 1.0, 'Ga': 5.0, 'Co': 1.0}",GGA,mp-1025325,"['mp-1025325', 'mp-1392704', 'mp-1723682', 'mp-1803025', 'mp-1624576']",8.42e-05,"{'Np': 1.0, 'Ga': 5.0, 'Co': 1.0}",119.04687805220972,[],FM,True,123,1,"[-0.0, -0.0, -0.0, -0.0, -0.0, -0.0, 0.1]",7.072844023937602e-07,8.42e-05,1,8.42e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1025325.cif,False,,data/final/MP/graphs/Co1Ga5Np1-MP-mp-1025325.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Co0.25Pd49.75Sb50,3,0.005,0.04,False,Co0.01Pd1.99Sb2,Pd2Sb2,1.57,Other,True,Co0.25Pd49.75Sb50,Co-Pd-Sb,3,Supercon,Pd49.75Co0.25Sb50,MP-mp-1769,Sb2Pd2,Pd-Sb,Pd50Sb50,P 63/m m c,hexagonal,4.14379200150878,4.14379188,5.681682,data/final/MP/cifs/Co0.25Pd49.75Sb50-MP-mp-1769-synth_doped.cif,data/source/MP/raw/cifs/mp-1769.cif,mp-1769,0.0,,2011-05-12 20:23:42,8.969190247481327,10.17188/1192632,"@misc{osti_1192632,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SbPd (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1192632"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672236'}},0.0,7.23050119,520.0,-20.38401466,-5.096003665,"{'tags': ['Palladium antimony (1/1)', 'Sudburyite', 'Palladium antimony', 'Palladium antimonide (1/1)']}",-20.38401466,-5.096003665,-0.5375621399999995,"['xas', 'elasticity', 'bandstructure']",True,"[648770, 42598, 648779, 42597]",True,2021-05-12 10:56:14.760000,NM,4,8,mp-1769,,SbPd,"{'functional': 'PBE', 'labels': ['Sb', 'Pd'], 'pot_type': 'paw'}","{'Sb': 1.0, 'Pd': 1.0}",GGA,mp-1769,"['mp-924880', 'mp-925511', 'mp-909858', 'mp-1769', 'mp-1439686', 'mp-1672236', 'mp-1802229', 'mp-1586197']",0.0044707,"{'Sb': 2.0, 'Pd': 2.0}",84.4896347968957,[],NM,False,194,0,"[0, 0, 0, 0]",0.0001058283660651,0.0044707,0,0.0089414,MP,data/source/MP/cleaned/cifs/MP-mp-1769.cif,True,,data/final/MP/graphs/Co0.25Pd49.75Sb50-MP-mp-1769-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Cu1La1.962Sr0.038O4,2,0.0108571428571428,1.0,True,Cu1La1.962Sr0.038O4,Cu1La2O4,0.0,Cuprate,True,Cu14.286La28.029Sr0.543O57.142857142857146,Cu-La-Sr-O,4,Supercon,La1.962Sr0.038Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La1.962Sr0.038O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La1.962Sr0.038O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Co0.8Ni0.2Zr2,3,0.1333333333333333,2.0,False,Co1.6Ni0.4Zr4,Co2Zr4,5.83,Other,True,Co26.667Ni6.667Zr66.667,Co-Ni-Zr,3,Supercon,Zr2Co0.8Ni0.2,MP-mp-628,Zr4Co2,Co-Zr,Co33.333Zr66.667,I 4/m c m,tetragonal,5.27792884001752,5.27792884,5.277928840000001,data/final/MP/cifs/Co0.8Ni0.2Zr2-MP-mp-628-synth_doped.cif,data/source/MP/raw/cifs/mp-628.cif,mp-628,0.0,,2011-05-13 12:16:44,7.17077101131263,10.17188/1278899,"@misc{osti_1278899,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Zr2Co (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278899"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677545'}},0.0,4.51380976,520.0,-49.95120762,-8.325201269999999,"{'tags': ['Cobalt zirconium (1/2)', 'Zirconium cobalt (2/1)']}",-49.95120762,-8.325201269999999,-0.2572949183333328,"['xas', 'elasticity', 'bandstructure']",True,"[625671, 191386, 625688, 102740, 625665]",True,2021-05-12 10:56:27.046000,NM,6,20,mp-628,,Zr2Co,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Co'], 'pot_type': 'paw'}","{'Zr': 2.0, 'Co': 1.0}",GGA,mp-628,"['mp-928347', 'mp-912327', 'mp-928866', 'mp-628', 'mp-1071352', 'mp-1071381', 'mp-1071431', 'mp-1071762', 'mp-1071803', 'mp-1071859', 'mp-1071883', 'mp-1071742', 'mp-1071925', 'mp-1441633', 'mp-1677545', 'mp-1802810', 'mp-1591799', 'mp-1071792', 'mp-1071416', 'mp-1071915']",0.0001226,"{'Zr': 4.0, 'Co': 2.0}",111.79353060019714,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0]",2.1933290654975308e-06,0.0001226,0,0.0002452,MP,data/source/MP/cleaned/cifs/MP-mp-628.cif,True,,data/final/MP/graphs/Co0.8Ni0.2Zr2-MP-mp-628-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ga0.48Si0.52V3,2,0.01,2.0,False,Ga0.96Si1.04V6,Ga1Si1V6,7.8,Other,True,Ga12Si13V75,Ga-Si-V,3,Supercon,V3Si0.52Ga0.48,MP-mp-1216440,V6Ga1Si1,Ga-Si-V,Ga12.5Si12.5V75,P m -3,cubic,4.747019,4.747019,4.747019,data/final/MP/cifs/Ga0.48Si0.52V3-MP-mp-1216440-synth_doped.cif,data/source/MP/raw/cifs/mp-1216440.cif,mp-1216440,0.0,,2019-01-12 17:56:57.356000,6.263022625398905,,,{'GGA': {'task_id': 'mp-1752355'}},0.0012115512499999,6.46444818,520.0,-65.49539593,-8.18692449125,{'tags': []},-65.49539593,-8.18692449125,-0.3084436834374999,['bandstructure'],True,[],True,2021-05-12 10:58:39.488000,FM,8,5,mp-1216440,,V6GaSi,"{'functional': 'PBE', 'labels': ['V_pv', 'Ga_d', 'Si'], 'pot_type': 'paw'}","{'V': 6.0, 'Ga': 1.0, 'Si': 1.0}",GGA,mp-1216440,"['mp-1216440', 'mp-1444194', 'mp-1752355', 'mp-1875781', 'mp-1620045']",2.0268443,"{'V': 6.0, 'Ga': 1.0, 'Si': 1.0}",106.970225166654,[],FM,True,47,1,"[0.2, 0.3, 0.3, 0.2, 0.3, 0.3, 0.0, 0.0]",0.0189477426717788,2.0268443,6,2.0268443,MP,data/source/MP/cleaned/cifs/MP-mp-1216440.cif,True,,data/final/MP/graphs/Ga0.48Si0.52V3-MP-mp-1216440-synth_doped.json,0,True,m-3,2,0,0,0,0,0,0,1,0,0,0,1.0,False
Cu0.05Ru0.95Sr2Y1O6,2,0.01,2.0,False,Cu0.1Ru1.9Sr4Y2O12,Ru2Sr4Y2O12,11.9,Cuprate,True,Cu0.5Ru9.5Sr20Y10O60,Cu-Ru-Sr-Y-O,5,Supercon,Sr2Y1Ru0.95Cu0.05O6,MP-mp-14430,Sr4Y2Ru2O12,Ru-Sr-Y-O,Ru10Sr20Y10O60,P 1 21/c 1,monoclinic,5.816658,5.885394,8.254861792272742,data/final/MP/cifs/Cu0.05Ru0.95Sr2Y1O6-MP-mp-14430-synth_doped.cif,data/source/MP/raw/cifs/mp-14430.cif,mp-14430,0.0,,2011-06-07 07:34:15,5.420400820723878,10.17188/1190674,"@misc{osti_1190674,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr2YRuO6 (SG:14) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1190674"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1669873'}},0.0,3.25749146,520.0,-146.31379286,-7.315689643000001,"{'tags': ['Distrontium yttrium ruthenium(V) oxide', 'Distrontium yttrium ruthenium hexaoxide']}",-146.31379286,-7.315689643000001,-2.847128272500001,"['xas', 'bandstructure']",True,"[192766, 49500]",True,2021-05-12 10:56:53.126000,FM,20,10,mp-14430,oxide,Sr2YRuO6,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Y_sv', 'Ru_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Y': 1.0, 'Ru': 1.0, 'O': 6.0}",GGA,mp-14430,"['mp-923119', 'mp-922143', 'mp-917338', 'mp-14430', 'mp-1106028', 'mp-1236895', 'mp-1431640', 'mp-1669873', 'mp-1931083', 'mp-1608013']",2.9996044,"{'Sr': 4.0, 'Y': 2.0, 'Ru': 2.0, 'O': 12.0}",282.584622226224,[],FM,True,14,1,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 2.0, 2.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0212297780138839,2.9996044,2,5.9992088,MP,data/source/MP/cleaned/cifs/MP-mp-14430.cif,True,,data/final/MP/graphs/Cu0.05Ru0.95Sr2Y1O6-MP-mp-14430-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,1,0,0,0,1.0,False
La3Ni4Si4,3,0.1212121212121212,0.5,False,La1.5Ni2Si2,La2Ni2Si2,0.48,Other,True,La27.273Ni36.364Si36.364,La-Ni-Si,3,Supercon,La3Ni4Si4,MP-mp-7030,La2Si2Ni2,La-Ni-Si,La33.333Ni33.333Si33.333,I 41 m d,tetragonal,4.181653997985801,4.181653997985801,7.60797294,data/final/MP/cifs/La3Ni4Si4-MP-mp-7030-synth_doped.cif,data/source/MP/raw/cifs/mp-7030.cif,mp-7030,0.0,,2011-05-28 11:56:29,6.11469839556342,10.17188/1285593,"@misc{osti_1285593,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaSiNi (SG:109) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1285593"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699194'}},0.0,8.03760791,520.0,-36.63393333,-6.105655554999999,{'tags': ['Lanthanum nickel silicide (1/1/1)']},-36.63393333,-6.105655554999999,-0.7015029533333319,['bandstructure'],True,[78264],True,2021-05-12 10:58:53.520000,NM,6,9,mp-7030,,LaSiNi,"{'functional': 'PBE', 'labels': ['La', 'Si', 'Ni_pv'], 'pot_type': 'paw'}","{'La': 1.0, 'Si': 1.0, 'Ni': 1.0}",GGA,mp-7030,"['mp-923783', 'mp-908804', 'mp-924370', 'mp-7030', 'mp-1156285', 'mp-1433627', 'mp-1699194', 'mp-1803860', 'mp-1586401']",4.03e-05,"{'La': 2.0, 'Si': 2.0, 'Ni': 2.0}",122.57602545954455,[],NM,False,109,0,"[0, 0, 0, 0, 0, 0]",6.575510969443329e-07,4.03e-05,0,8.06e-05,MP,data/source/MP/cleaned/cifs/MP-mp-7030.cif,True,,data/final/MP/graphs/La3Ni4Si4-MP-mp-7030-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,0,0,1,0,1.0,False
Pt1Sb1,1,0.0,2.0,False,Pt2Sb2,Pt2Sb2,2.1,Other,True,Pt50Sb50,Pt-Sb,2,Supercon,Pt1Sb1,MP-mp-2845,Sb2Pt2,Pt-Sb,Pt50Sb50,P 63/m m c,hexagonal,4.208133997890831,4.20813491,5.589409,data/final/MP/cifs/Pt1Sb1-MP-mp-2845.cif,data/source/MP/raw/cifs/mp-2845.cif,mp-2845,0.0,,2011-05-12 20:23:42,12.275771957890468,10.17188/1202554,"@misc{osti_1202554,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SbPt (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1202554"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688267'}},0.0,8.14326013,520.0,-22.06200421,-5.5155010525,"{'tags': ['Platinum(III) antimonide', 'Platinum antimonide (1/1)', 'Stumpflite']}",-22.06200421,-5.5155010525,-0.5115465774999999,"['xas', 'elasticity', 'bandstructure']",True,"[16969, 649552, 649561, 649556]",True,2021-05-12 10:56:18.721000,NM,4,8,mp-2845,,SbPt,"{'functional': 'PBE', 'labels': ['Sb', 'Pt'], 'pot_type': 'paw'}","{'Sb': 1.0, 'Pt': 1.0}",GGA,mp-2845,"['mp-925211', 'mp-924645', 'mp-909507', 'mp-2845', 'mp-1439801', 'mp-1688267', 'mp-1781514', 'mp-1594820']",0.0005052,"{'Sb': 2.0, 'Pt': 2.0}",85.71873798610766,[],NM,False,194,0,"[0, 0, 0, 0]",1.1787387725700703e-05,0.0005052,0,0.0010104,MP,data/source/MP/cleaned/cifs/MP-mp-2845.cif,False,,data/final/MP/graphs/Pt1Sb1-MP-mp-2845.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Mg2Pb1,1,0.0,1.0,True,Mg2Pb1,Mg2Pb1,5.6,Other,True,Mg66.667Pb33.333,Mg-Pb,2,Supercon,Mg2Pb1,MP-mp-20724,Mg2Pb1,Mg-Pb,Mg66.667Pb33.333,F m -3 m,cubic,4.891356,4.891356,4.891356,data/final/MP/cifs/Mg2Pb1-MP-mp-20724.cif,data/source/MP/raw/cifs/mp-20724.cif,mp-20724,0.0,,2014-02-21 06:07:04,5.133266291215764,10.17188/1195885,"@misc{osti_1195885,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Mg2Pb (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195885"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672201'}},0.0,4.47604269,520.0,-7.08248644,-2.3608288133333333,"{'tags': ['Magnesium plumbide (2/1)', 'Magnesium lead (2/1)', 'Lead magnesium (1/2)']}",-7.08248644,-2.3608288133333333,-0.0564264233333335,"['xas', 'elasticity', 'bandstructure']",True,"[166350, 151387, 642745, 104846, 151361, 150955, 409428]",True,2021-05-12 10:56:14.760000,NM,3,7,mp-20724,,Mg2Pb,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Pb_d'], 'pot_type': 'paw'}","{'Mg': 2.0, 'Pb': 1.0}",GGA,mp-20724,"['mp-905469', 'mp-918611', 'mp-919580', 'mp-20724', 'mp-1476206', 'mp-1672201', 'mp-1800038']",0.0013112,"{'Mg': 2.0, 'Pb': 1.0}",82.75091813449257,[],NM,False,225,0,"[0, 0, 0]",1.584514141424928e-05,0.0013112,0,0.0013112,MP,data/source/MP/cleaned/cifs/MP-mp-20724.cif,False,,data/final/MP/graphs/Mg2Pb1-MP-mp-20724.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ge19Rh6Sc4,1,0.0,1.0,True,Ge19Rh6Sc4,Ge19Rh6Sc4,1.9,Other,True,Ge65.517Rh20.69Sc13.793,Ge-Rh-Sc,3,Supercon,Sc4Rh6Ge19,MP-mp-1209440,Sc4Ge19Rh6,Ge-Rh-Sc,Ge65.517Rh20.69Sc13.793,I 2 3,cubic,8.839561131959593,8.83956113,8.83956113,data/final/MP/cifs/Ge19Rh6Sc4-MP-mp-1209440.cif,data/source/MP/raw/cifs/mp-1209440.cif,mp-1209440,0.0,,2019-01-12 12:10:04.355000,6.800180119512723,,,,0.3451203183990152,4.45325528,520.0,-161.78052866,-5.578638919310344,"{'tags': ['Sc4Rh6Ge19', 'La4Re6O19']}",-161.78052866,-5.578638919310344,-0.1526646818965507,[],False,[],True,2021-05-12 11:00:24.227000,NM,29,3,mp-1209440,,Sc4Ge19Rh6,"{'functional': 'PBE', 'labels': ['Sc_sv', 'Ge_d', 'Rh_pv'], 'pot_type': 'paw'}","{'Sc': 4.0, 'Ge': 19.0, 'Rh': 6.0}",GGA,mp-1209440,"['mp-1209440', 'mp-1237163', 'mp-1923527']",0.0039276,"{'Sc': 4.0, 'Ge': 19.0, 'Rh': 6.0}",531.7043585204781,[],NM,False,197,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",7.386811744272606e-06,0.0039276,0,0.0039276,MP,data/source/MP/cleaned/cifs/MP-mp-1209440.cif,False,,data/final/MP/graphs/Ge19Rh6Sc4-MP-mp-1209440.json,0,True,23,1,0,0,0,0,0,0,0,0,1,0,1.0,False
Br1N1Ti1,1,0.0,2.0,False,Br2N2Ti2,Br2N2Ti2,0.0,Other,True,Br33.333N33.333Ti33.333,Br-N-Ti,3,Supercon,Ti1N1Br1,MP-mp-27849,Ti2Br2N2,Br-N-Ti,Br33.333N33.333Ti33.333,P m m n,orthorhombic,3.377704,3.961391,8.932372,data/final/MP/cifs/Br1N1Ti1-MP-mp-27849.cif,data/source/MP/raw/cifs/mp-27849.cif,mp-27849,0.5551000000000001,,2013-09-21 23:16:28,3.93958903110144,10.17188/1202024,"@misc{osti_1202024,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TiBrN (SG:59) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1202024"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1670561'}},0.0,1.84903409,520.0,-44.01548501,-7.335914168333333,{'tags': []},-44.01548501,-7.335914168333333,-1.677940890277777,"['diel', 'xas', 'elasticity', 'bandstructure']",True,"[27395, 290036]",True,2021-05-12 10:56:18.721000,NM,6,13,mp-27849,,TiBrN,"{'functional': 'PBE', 'labels': ['Ti_pv', 'Br', 'N'], 'pot_type': 'paw'}","{'Ti': 1.0, 'Br': 1.0, 'N': 1.0}",GGA,mp-27849,"['mp-656952', 'mp-661504', 'mp-655351', 'mp-27849', 'mp-1072691', 'mp-1072705', 'mp-1072685', 'mp-1140151', 'mp-1300463', 'mp-1670561', 'mp-1803923', 'mp-1590084', 'mp-1072697']",4.1e-05,"{'Ti': 2.0, 'Br': 2.0, 'N': 2.0}",119.51876592410623,[],NM,False,59,0,"[0, 0, 0, 0, 0, 0]",6.860847279168658e-07,4.1e-05,0,8.2e-05,MP,data/source/MP/cleaned/cifs/MP-mp-27849.cif,False,,data/final/MP/graphs/Br1N1Ti1-MP-mp-27849.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ir1Si1Ti1,1,0.0,4.0,False,Ir4Si4Ti4,Ir4Si4Ti4,1.675,Other,True,Ir33.333Si33.333Ti33.333,Ir-Si-Ti,3,Supercon,Ti1Ir1Si1,MP-mp-1103248,Ti4Si4Ir4,Ir-Si-Ti,Ir33.333Si33.333Ti33.333,P n m a,orthorhombic,3.882031,6.276491,7.243883,data/final/MP/cifs/Ir1Si1Ti1-MP-mp-1103248.cif,data/source/MP/raw/cifs/mp-1103248.cif,mp-1103248,0.0,,2018-07-18 17:49:43,10.091858076684282,,,{'GGA': {'task_id': 'mp-1705090'}},0.0,8.76692668,520.0,-100.67334465,-8.3894453875,"{'tags': ['Iridium titanium silicide (1/1/1)', 'TiIrSi', 'AlB2 family', 'TiNiSi']}",-100.67334465,-8.3894453875,-1.003033235277777,['bandstructure'],True,[641017],True,2021-05-12 10:58:20.361000,NM,12,5,mp-1103248,,TiSiIr,"{'functional': 'PBE', 'labels': ['Ti_pv', 'Si', 'Ir'], 'pot_type': 'paw'}","{'Ti': 1.0, 'Si': 1.0, 'Ir': 1.0}",GGA,mp-1103248,"['mp-1103248', 'mp-1415000', 'mp-1705090', 'mp-1785670', 'mp-1601549']",8.2825e-05,"{'Ti': 4.0, 'Si': 4.0, 'Ir': 4.0}",176.50106762773484,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.877042470353536e-06,8.2825e-05,0,0.0003313,MP,data/source/MP/cleaned/cifs/MP-mp-1103248.cif,False,,data/final/MP/graphs/Ir1Si1Ti1-MP-mp-1103248.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Co1.98Cu1Rh0.02S4,2,0.0057142857142857,2.0,False,Co3.96Cu2Rh0.04S8,Co4Cu2S8,2.82,Other,True,Co28.286Cu14.286Rh0.286S57.143,Co-Cu-Rh-S,4,Supercon,Cu1Co1.98Rh0.02S4,MP-mp-3925,Co4Cu2S8,Co-Cu-S,Co28.571Cu14.286S57.143,F d -3 m,cubic,6.69987918,6.699879179999999,6.699879179999999,data/final/MP/cifs/Co1.98Cu1Rh0.02S4-MP-mp-3925-synth_doped.cif,data/source/MP/raw/cifs/mp-3925.cif,mp-3925,0.0,,2011-05-15 03:07:38,4.836104359598833,10.17188/1207634,"@misc{osti_1207634,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Co2CuS4 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207634"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698326'}},0.0,5.68331854,520.0,-75.59837827,-5.399884162142857,"{'tags': ['Cobalt copper sulfide (2/1/4)', 'Carrollite', 'Dicobalt(III) copper sulfide']}",-75.59837827,-5.399884162142857,-0.7070782010714284,"['xas', 'bandstructure']",True,"[622571, 31107, 52943]",True,2021-05-12 10:57:08.928000,NM,14,8,mp-3925,,Co2CuS4,"{'functional': 'PBE', 'labels': ['Co', 'Cu_pv', 'S'], 'pot_type': 'paw'}","{'Co': 2.0, 'Cu': 1.0, 'S': 4.0}",GGA,mp-3925,"['mp-931396', 'mp-915858', 'mp-932359', 'mp-3925', 'mp-1425952', 'mp-1698326', 'mp-1833413', 'mp-1599756']",0.00593025,"{'Co': 4.0, 'Cu': 2.0, 'S': 8.0}",212.6600516474575,[],NM,False,227,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",5.5772110972972206e-05,0.00593025,0,0.0118605,MP,data/source/MP/cleaned/cifs/MP-mp-3925.cif,True,,data/final/MP/graphs/Co1.98Cu1Rh0.02S4-MP-mp-3925-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Al1Ba1Sn1,1,0.0,1.0,True,Al1Ba1Sn1,Al1Ba1Sn1,2.9,Other,True,Al33.333Ba33.333Sn33.333,Al-Ba-Sn,3,Supercon,Ba1Al1Sn1,MP-mp-1227950,Ba1Al1Sn1,Al-Ba-Sn,Al33.333Ba33.333Sn33.333,P -6 m 2,hexagonal,4.696504003364247,4.696504199999999,5.177444,data/final/MP/cifs/Al1Ba1Sn1-MP-mp-1227950.cif,data/source/MP/raw/cifs/mp-1227950.cif,mp-1227950,0.0,,2019-01-13 03:43:21.444000,4.751913454208471,,,{'GGA': {'task_id': 'mp-1767803'}},0.0260858318749988,4.42389907,520.0,-11.05027045,-3.683423483333333,{'tags': []},-11.05027045,-3.683423483333333,-0.4587173116666664,['bandstructure'],True,[],True,2021-05-12 10:58:49.477000,NM,3,5,mp-1227950,,BaAlSn,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Al', 'Sn_d'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Al': 1.0, 'Sn': 1.0}",GGA,mp-1227950,"['mp-1227950', 'mp-1424976', 'mp-1767803', 'mp-1797175', 'mp-1616766']",0.0059166,"{'Ba': 1.0, 'Al': 1.0, 'Sn': 1.0}",98.89981045448609,[],NM,False,187,0,"[0, 0, 0]",5.9824179367086175e-05,0.0059166,0,0.0059166,MP,data/source/MP/cleaned/cifs/MP-mp-1227950.cif,False,,data/final/MP/graphs/Al1Ba1Sn1-MP-mp-1227950.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
B2Er1Os1,1,0.0,4.0,False,B8Er4Os4,B8Er4Os4,0.0,Other,True,B50Er25Os25,B-Er-Os,3,Supercon,Er1Os1B2,MP-mp-1189333,Er4B8Os4,B-Er-Os,B50Er25Os25,P n m a,orthorhombic,5.303624,5.875977,6.348147,data/final/MP/cifs/B2Er1Os1-MP-mp-1189333.cif,data/source/MP/raw/cifs/mp-1189333.cif,mp-1189333,0.0,,2019-01-11 20:06:54.836000,12.728454817693,,,{'GGA': {'task_id': 'mp-1705828'}},0.0,6.29010781,520.0,-126.32638483,-7.895399051875,"{'tags': ['Erbium osmium boride (1/1/2)', 'ErOsB2', 'LuRuB2']}",-126.32638483,-7.895399051875,-0.6069319002083331,['bandstructure'],True,[613789],True,2021-05-12 10:58:33.577000,NM,16,5,mp-1189333,,ErB2Os,"{'functional': 'PBE', 'labels': ['Er_3', 'B', 'Os_pv'], 'pot_type': 'paw'}","{'Er': 1.0, 'B': 2.0, 'Os': 1.0}",GGA,mp-1189333,"['mp-1189333', 'mp-1423529', 'mp-1705828', 'mp-1789521', 'mp-1602757']",1.04e-05,"{'Er': 4.0, 'B': 8.0, 'Os': 4.0}",197.8334794268117,[],NM,False,11,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, 0.0, -0.0, 0.0]",2.102778565110861e-07,1.04e-05,0,4.16e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1189333.cif,False,,data/final/MP/graphs/B2Er1Os1-MP-mp-1189333.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
C0.99Mg0.7Ni3Zn0.3,3,0.1226452905811623,1.0,True,C0.99Mg0.7Ni3Zn0.3,C1Mg1Ni3,2.5,Other,True,C19.84Mg14.028Ni60.12Zn6.012,C-Mg-Ni-Zn,4,Supercon,Mg0.7Zn0.3C0.99Ni3,MP-mp-10700,Mg1Ni3C1,C-Mg-Ni,C20Mg20Ni60,P m -3 m,cubic,3.810209,3.810209,3.810209,data/final/MP/cifs/C0.99Mg0.7Ni3Zn0.3-MP-mp-10700-synth_doped.cif,data/source/MP/raw/cifs/mp-10700.cif,mp-10700,0.0,,2011-05-28 10:04:44,6.376007671789427,10.17188/1187303,"@misc{osti_1187303,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MgNi3C (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187303"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678621'}},0.0,6.64260176,520.0,-28.85099542,-5.770199084,{'tags': ['Magnesium nickel carbide (1/3/1)']},-28.85099542,-5.770199084,-0.1367049259999994,"['xas', 'elasticity', 'bandstructure']",True,[77152],True,2021-05-12 10:56:10.715000,NM,5,8,mp-10700,,MgNi3C,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Ni_pv', 'C'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",GGA,mp-10700,"['mp-927245', 'mp-927653', 'mp-911184', 'mp-10700', 'mp-1438083', 'mp-1678621', 'mp-1791467', 'mp-1591421']",0.0387875,"{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",55.31544309398296,[],NM,False,221,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",0.0007012056277683,0.0387875,0,0.0387875,MP,data/source/MP/cleaned/cifs/MP-mp-10700.cif,True,,data/final/MP/graphs/C0.99Mg0.7Ni3Zn0.3-MP-mp-10700-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ce1Ge0.1Pt3Si0.9,2,0.0399999999999999,1.0,True,Ce1Ge0.1Pt3Si0.9,Ce1Pt3Si1,0.31,Heavy_fermion,True,Ce20Ge2Pt60Si18,Ce-Ge-Pt-Si,4,Supercon,Ce1Pt3Si0.9Ge0.1,MP-mp-1207119,Ce1Si1Pt3,Ce-Pt-Si,Ce20Pt60Si20,P 4 m m,tetragonal,4.067884,4.067884,5.552623,data/final/MP/cifs/Ce1Ge0.1Pt3Si0.9-MP-mp-1207119-synth_doped.cif,data/source/MP/raw/cifs/mp-1207119.cif,mp-1207119,0.0,,2019-01-12 10:17:34.047000,13.616649050512317,,,,0.0,7.99187805,520.0,-34.84666915,-6.969333829999999,"{'tags': ['CePt3Si', 'CePt3B']}",-34.84666915,-6.969333829999999,-1.0409085689999995,[],False,[],True,2021-05-12 11:00:19.396000,NM,5,2,mp-1207119,,CeSiPt3,"{'functional': 'PBE', 'labels': ['Ce', 'Si', 'Pt'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Si': 1.0, 'Pt': 3.0}",GGA,mp-1207119,"['mp-1207119', 'mp-1923489']",0.0099182,"{'Ce': 1.0, 'Si': 1.0, 'Pt': 3.0}",91.88302988314366,[],NM,False,99,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",0.0001079437629844,0.0099182,0,0.0099182,MP,data/source/MP/cleaned/cifs/MP-mp-1207119.cif,True,,data/final/MP/graphs/Ce1Ge0.1Pt3Si0.9-MP-mp-1207119-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
Cu6Th1,1,0.0,4.0,False,Cu24Th4,Cu24Th4,0.2,Other,True,Cu85.714Th14.286,Cu-Th,2,Supercon,Cu6Th1,MP-mp-12834,Th4Cu24,Cu-Th,Cu85.714Th14.286,P n m a,orthorhombic,5.078406,8.105913,10.11906,data/final/MP/cifs/Cu6Th1-MP-mp-12834.cif,data/source/MP/raw/cifs/mp-12834.cif,mp-12834,0.0,,2011-08-12 21:05:02,9.779631308946875,10.17188/1189219,"@misc{osti_1189219,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ThCu6 (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189219"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1667854'}},0.0,7.12155136,520.0,-131.98068904,-4.713596037142857,"{'tags': ['Thorium copper (1/6)', 'Copper thorium (6/1)']}",-131.98068904,-4.713596037142857,-0.140867712857143,"['xas', 'bandstructure']",True,"[629361, 629375, 152505, 103125]",True,2021-05-12 10:56:53.126000,NM,28,11,mp-12834,,ThCu6,"{'functional': 'PBE', 'labels': ['Th', 'Cu_pv'], 'pot_type': 'paw'}","{'Th': 1.0, 'Cu': 6.0}",GGA,mp-12834,"['mp-918698', 'mp-919899', 'mp-905682', 'mp-680600', 'mp-12834', 'mp-1194775', 'mp-1237462', 'mp-1395856', 'mp-1667854', 'mp-1822502', 'mp-1586043']",0.0004754,"{'Th': 4.0, 'Cu': 24.0}",416.55229100235954,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.565093125341204e-06,0.0004754,0,0.0019016,MP,data/source/MP/cleaned/cifs/MP-mp-12834.cif,False,,data/final/MP/graphs/Cu6Th1-MP-mp-12834.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Al2Yb1,1,0.0,2.0,False,Al4Yb2,Al4Yb2,0.0,Heavy_fermion,True,Al66.667Yb33.333,Al-Yb,2,Supercon,Al2Yb1,MP-mp-969,Yb2Al4,Al-Yb,Al66.667Yb33.333,F d -3 m,cubic,5.63779914,5.63779914,5.63779914,data/final/MP/cifs/Al2Yb1-MP-mp-969.cif,data/source/MP/raw/cifs/mp-969.cif,mp-969,0.0,,2011-05-12 20:03:50,5.949727005353145,10.17188/1313517,"@misc{osti_1313517,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YbAl2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1313517"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668214'}},0.0,4.7656732,520.0,-20.1228524,-3.353808733333333,"{'tags': ['Aluminum ytterbium (2/1)', 'Aluminium ytterbium (2/1)', 'High pressure experimental phase']}",-20.1228524,-3.353808733333333,-0.3435554200000001,"['xas', 'elasticity', 'bandstructure']",True,"[609677, 609673, 609685, 58223, 58222, 609682, 609683, 609675, 609674]",True,2021-05-12 10:56:35.166000,NM,6,9,mp-969,,YbAl2,"{'functional': 'PBE', 'labels': ['Yb_2', 'Al'], 'pot_type': 'paw'}","{'Yb': 1.0, 'Al': 2.0}",GGA,mp-969,"['mp-912017', 'mp-928139', 'mp-928647', 'mp-969', 'mp-1258634', 'mp-1439950', 'mp-1668214', 'mp-1878422', 'mp-1595759']",0.00203045,"{'Yb': 2.0, 'Al': 4.0}",126.71084827585028,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",3.204855823519859e-05,0.00203045,0,0.0040609,MP,data/source/MP/cleaned/cifs/MP-mp-969.cif,False,,data/final/MP/graphs/Al2Yb1-MP-mp-969.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
As1Fe1.03Li0.97,2,0.02,2.0,False,As2Fe2.06Li1.94,As2Fe2Li2,0.0,Ferrite,True,As33.333Fe34.333Li32.333,As-Fe-Li,3,Supercon,Li0.97Fe1.03As1,MP-mp-21471,Li2Fe2As2,As-Fe-Li,As33.333Fe33.333Li33.333,P 4/n m m,tetragonal,3.790629,3.790629,6.107451,data/final/MP/cifs/As1Fe1.03Li0.97-MP-mp-21471-synth_doped.cif,data/source/MP/raw/cifs/mp-21471.cif,mp-21471,0.0,,2013-10-29 11:57:13,5.21140049061562,10.17188/1196927,"@misc{osti_1196927,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LiFeAs (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196927"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686578'}},0.0,4.20304559,520.0,-32.72438031,-5.454063385,"{'tags': ['Lithium iron arsenide', 'Iron lithium arsenide']}",-32.72438031,-5.454063385,-0.4413801444444445,"['xas', 'elasticity']",False,"[290700, 168206, 610480, 169175, 162250, 162056, 166457, 163870]",True,2021-05-12 10:56:16.728000,FM,6,18,mp-21471,,LiFeAs,"{'functional': 'PBE', 'labels': ['Li_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Li': 1.0, 'Fe': 1.0, 'As': 1.0}",GGA,mp-21471,"['mp-917215', 'mp-674647', 'mp-919059', 'mp-920059', 'mp-1071407', 'mp-21471', 'mp-1071451', 'mp-38403', 'mp-33848', 'mp-37001', 'mp-34336', 'mp-36599', 'mp-36822', 'mp-36276', 'mp-1439936', 'mp-1686578', 'mp-1784376', 'mp-1071444']",0.2682074,"{'Li': 2.0, 'Fe': 2.0, 'As': 2.0}",87.75715855248485,[],FM,True,129,1,"[-0.0, -0.0, 0.3, 0.3, -0.0, -0.0]",0.0061124905232567,0.2682074,2,0.5364148,MP,data/source/MP/cleaned/cifs/MP-mp-21471.cif,True,,data/final/MP/graphs/As1Fe1.03Li0.97-MP-mp-21471-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Au0.85Ga2Pd0.15,3,0.1,1.0,True,Au0.85Ga2Pd0.15,Au1Ga2,1.79,Other,True,Au28.333Ga66.667Pd5,Au-Ga-Pd,3,Supercon,Au0.85Pd0.15Ga2,MP-mp-2776,Ga2Au1,Au-Ga,Au33.333Ga66.667,F m -3 m,cubic,4.40327555,4.40327555,4.40327555,data/final/MP/cifs/Au0.85Ga2Pd0.15-MP-mp-2776-synth_doped.cif,data/source/MP/raw/cifs/mp-2776.cif,mp-2776,0.0,,2011-05-12 21:57:19,9.253557284351938,10.17188/1201942,"@misc{osti_1201942,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ga2Au (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201942"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687524'}},0.0,3.58527429,520.0,-10.04441228,-3.3481374266666664,"{'tags': ['Gold gallium (1/2)', 'Gallium gold (2/1)']}",-10.04441228,-3.3481374266666664,-0.2381128983333328,"['xas', 'elasticity', 'bandstructure']",True,"[611874, 611864, 150958, 58458]",True,2021-05-12 10:56:18.721000,NM,3,8,mp-2776,,Ga2Au,"{'functional': 'PBE', 'labels': ['Ga_d', 'Au'], 'pot_type': 'paw'}","{'Ga': 2.0, 'Au': 1.0}",GGA,mp-2776,"['mp-991379', 'mp-2776', 'mp-993315', 'mp-1439079', 'mp-1687524', 'mp-1795480', 'mp-994626', 'mp-1589089']",0.000866,"{'Ga': 2.0, 'Au': 1.0}",60.36880695215696,[],NM,False,225,0,"[0, 0, 0]",1.4345156774198237e-05,0.000866,0,0.000866,MP,data/source/MP/cleaned/cifs/MP-mp-2776.cif,True,,data/final/MP/graphs/Au0.85Ga2Pd0.15-MP-mp-2776-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
B2C1Gd0.14Ni2Y0.86,2,0.0466666666666668,1.0,True,B2C1Gd0.14Ni2Y0.86,B2C1Ni2Y1,10.475,Other,True,B33.333C16.667Gd2.333Ni33.333Y14.333,B-C-Gd-Ni-Y,5,Supercon,Y0.86Gd0.14Ni2B2C1,MP-mp-6576,Y1Ni2B2C1,B-C-Ni-Y,B33.333C16.667Ni33.333Y16.667,I 4/m m m,tetragonal,3.548790000501972,3.548790000501972,5.76144136,data/final/MP/cifs/B2C1Gd0.14Ni2Y0.86-MP-mp-6576-synth_doped.cif,data/source/MP/raw/cifs/mp-6576.cif,mp-6576,0.0,,2011-05-13 05:21:43,6.099730998852292,10.17188/1281366,"@misc{osti_1281366,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281366"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688230'}},0.0,6.81083016,520.0,-43.677878,-7.279646333333333,{'tags': []},-43.677878,-7.279646333333333,-0.5109282141666659,"['xas', 'bandstructure']",True,"[75816, 89142, 83231, 79574, 41549]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6576,,YNi2B2C,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6576,"['mp-6576', 'mp-1007054', 'mp-1000583', 'mp-1439516', 'mp-1688230', 'mp-1794280', 'mp-1011792', 'mp-1597064']",0.0006603,"{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.3152437079014,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",1.010943177297096e-05,0.0006603,0,0.0006603,MP,data/source/MP/cleaned/cifs/MP-mp-6576.cif,True,,data/final/MP/graphs/B2C1Gd0.14Ni2Y0.86-MP-mp-6576-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As1Hf1Os1,1,0.0,3.0,False,As3Hf3Os3,As3Hf3Os3,3.2,Other,True,As33.333Hf33.333Os33.333,As-Hf-Os,3,Supercon,Hf1Os1As1,MP-mp-1079823,Hf3As3Os3,As-Hf-Os,As33.333Hf33.333Os33.333,P -6 2 m,hexagonal,3.982102,6.591745999616777,6.59174644,data/final/MP/cifs/As1Hf1Os1-MP-mp-1079823.cif,data/source/MP/raw/cifs/mp-1079823.cif,mp-1079823,0.0,,2018-04-16 11:25:11,14.748866205422528,,,{'GGA': {'task_id': 'mp-1702307'}},0.1064960241666668,7.73415324,520.0,-82.55781099,-9.17309011,"{'tags': ['Hafnium osmium arsenide (1/1/1)', 'ZrNiAl', 'HfOsAs']}",-82.55781099,-9.17309011,-0.5585322733333319,['bandstructure'],True,"[604607, 610652]",True,2021-05-12 10:58:16.596000,NM,9,6,mp-1079823,,HfAsOs,"{'functional': 'PBE', 'labels': ['Hf_pv', 'As', 'Os_pv'], 'pot_type': 'paw'}","{'Hf': 1.0, 'As': 1.0, 'Os': 1.0}",GGA,mp-1079823,"['mp-1079823', 'mp-1087237', 'mp-1433459', 'mp-1702307', 'mp-1788392', 'mp-1593861']",0.0005100666666666,"{'Hf': 3.0, 'As': 3.0, 'Os': 3.0}",149.84559452402175,[],NM,False,189,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0]",1.0211845098687191e-05,0.0005100666666666,0,0.0015302,MP,data/source/MP/cleaned/cifs/MP-mp-1079823.cif,False,,data/final/MP/graphs/As1Hf1Os1-MP-mp-1079823.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
P12Pr1Ru4,1,0.0,1.0,True,P12Pr1Ru4,P12Pr1Ru4,1.8,Heavy_fermion,True,P70.588Pr5.882Ru23.529,P-Pr-Ru,3,Supercon,Pr1Ru4P12,MP-mp-4341,Pr1P12Ru4,P-Pr-Ru,P70.588Pr5.882Ru23.529,I m -3,cubic,7.020182061556264,7.02018206,7.02018206,data/final/MP/cifs/P12Pr1Ru4-MP-mp-4341.cif,data/source/MP/raw/cifs/mp-4341.cif,mp-4341,0.0,,2011-05-21 01:25:02,5.716562415249147,10.17188/1208083,"@misc{osti_1208083,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Pr(P3Ru)4 (SG:204) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208083"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1670647'}},0.0,7.84336946,520.0,-117.99166559,-6.94068621117647,"{'tags': ['Praseodymium ruthenium phosphide (1/4/12) - LT', 'Praseodymium ruthenium phosphide (1/4/12)', 'High pressure experimental phase']}",-117.99166559,-6.94068621117647,-0.6560928085294113,"['xas', 'bandstructure']",True,"[155822, 55834, 155823, 647956]",True,2021-05-12 10:57:08.928000,NM,17,7,mp-4341,,Pr(P3Ru)4,"{'functional': 'PBE', 'labels': ['Pr_3', 'P', 'Ru_pv'], 'pot_type': 'paw'}","{'Pr': 1.0, 'P': 12.0, 'Ru': 4.0}",GGA,mp-4341,"['mp-991782', 'mp-992446', 'mp-4341', 'mp-1431080', 'mp-1670647', 'mp-994041', 'mp-1609105']",0.026838,"{'Pr': 1.0, 'P': 12.0, 'Ru': 4.0}",266.3319286916835,[],NM,False,204,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0, -0.0, -0.0]",0.0001007689920312,0.026838,0,0.026838,MP,data/source/MP/cleaned/cifs/MP-mp-4341.cif,False,,data/final/MP/graphs/P12Pr1Ru4-MP-mp-4341.json,0,True,m-3,2,0,0,0,0,0,0,0,0,1,0,1.0,False
Bi14Rh3,3,0.0470588235294117,3.428619047619048,False,Bi48Rh10.286,Bi48Rh12,2.895,Other,True,Bi82.353Rh17.647,Bi-Rh,2,Supercon,Bi14Rh3,MP-mp-30467,Bi48Rh12,Bi-Rh,Bi80Rh20,I a -3 d,cubic,13.157196602916748,13.157196600000002,13.1571966,data/final/MP/cifs/Bi14Rh3-MP-mp-30467-synth_doped.cif,data/source/MP/raw/cifs/mp-30467.cif,mp-30467,0.0,,2014-02-18 02:19:11,10.669590685107751,10.17188/1204874,"@misc{osti_1204874,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Bi4Rh (SG:230) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1204874"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-941121'}},0.0,6.1029162,520.0,-283.61817085,-4.726969514166667,{'tags': ['Bismuth rhodium (4/1)']},-283.61817085,-4.726969514166667,-0.1420804921666672,"['xas', 'bandstructure']",True,[58854],True,2021-05-12 10:57:04.957000,NM,60,5,mp-30467,,Bi4Rh,"{'functional': 'PBE', 'labels': ['Bi', 'Rh_pv'], 'pot_type': 'paw'}","{'Bi': 4.0, 'Rh': 1.0}",GGA,mp-30467,"['mp-934600', 'mp-941121', 'mp-941501', 'mp-30467', 'mp-1325245']",0.0046802166666666,"{'Bi': 48.0, 'Rh': 12.0}",1753.348321234545,[],NM,False,230,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.20316273268825e-05,0.0046802166666666,0,0.0561626,MP,data/source/MP/cleaned/cifs/MP-mp-30467.cif,True,,data/final/MP/graphs/Bi14Rh3-MP-mp-30467-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,1,0,1.0,False
B1.98C0.02Mg1,2,0.0133333333333333,1.0,True,B1.98C0.02Mg1,B2Mg1,37.53333333,Other,True,B66C0.667Mg33.333,B-C-Mg,3,Supercon,Mg1B1.98C0.02,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B1.98C0.02Mg1-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B1.98C0.02Mg1-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Ca0.03Cu4Y0.97O8,2,0.004,1.0,True,Ba2Ca0.03Cu4Y0.97O8,Ba2Cu4Y1O8,81.9,Cuprate,True,Ba13.333Ca0.2Cu26.667Y6.467O53.333333333333336,Ba-Ca-Cu-Y-O,5,Supercon,Y0.97Ca0.03Ba2Cu4O8,MP-mp-6790,Ba2Y1Cu4O8,Ba-Cu-Y-O,Ba13.333Cu26.667Y6.667O53.333333333333336,C m m m,orthorhombic,3.889922,3.899603999537882,13.88942687,data/final/MP/cifs/Ba2Ca0.03Cu4Y0.97O8-MP-mp-6790-synth_doped.cif,data/source/MP/raw/cifs/mp-6790.cif,mp-6790,0.0,,2011-05-16 03:21:24,5.936250568336678,10.17188/1283441,"@misc{osti_1283441,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Y(CuO2)4 (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1283441"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686864'}},0.0,3.31391536,520.0,-91.58381472,-6.105587648,"{'tags': ['Yttrium barium copper oxide (1/2/4/8)', 'High pressure experimental phase']}",-91.58381472,-6.105587648,-2.0529924817777783,"['xas', 'bandstructure']",True,"[72261, 85273, 74251, 400273, 85277, 85275, 400280, 67632, 85272, 67631, 83920, 66613, 85279, 400277, 75689, 74259, 85278, 85280, 66603, 94265, 400276, 88873, 71417, 75712, 97052, 66605, 72258, 85281, 85274, 400279, 66604, 69698]",True,2021-05-12 10:57:34.594000,NM,15,10,mp-6790,oxide,Ba2Y(CuO2)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-6790,"['mp-1000664', 'mp-6790', 'mp-1007136', 'mp-1237713', 'mp-1440937', 'mp-1686864', 'mp-1834179', 'mp-1011883', 'mp-1590064', 'mp-1590433']",0.0004643,"{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",208.60454115924333,[],NM,False,65,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.225742533790601e-06,0.0004643,0,0.0004643,MP,data/source/MP/cleaned/cifs/MP-mp-6790.cif,True,,data/final/MP/graphs/Ba2Ca0.03Cu4Y0.97O8-MP-mp-6790-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
B1Ti1,1,0.0,4.0,False,B4Ti4,B4Ti4,0.0,Other,True,B50Ti50,B-Ti,2,Supercon,B1Ti1,MP-mp-7857,Ti4B4,B-Ti,B50Ti50,P n m a,orthorhombic,3.05165,4.560171,6.120598,data/final/MP/cifs/B1Ti1-MP-mp-7857.cif,data/source/MP/raw/cifs/mp-7857.cif,mp-7857,0.0,,2011-05-28 05:47:07,4.575880614642107,10.17188/1307753,"@misc{osti_1307753,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TiB (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1307753"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700571'}},0.0,6.75042341,520.0,-64.95595423,-8.11949427875,{'tags': ['Titanium boride (1/1)']},-64.95595423,-8.11949427875,-0.8320523850000008,"['xas', 'elasticity', 'bandstructure']",True,"[24701, 191494, 615596, 189386]",True,2021-05-12 10:56:31.128000,NM,8,10,mp-7857,,TiB,"{'functional': 'PBE', 'labels': ['Ti_pv', 'B'], 'pot_type': 'paw'}","{'Ti': 1.0, 'B': 1.0}",GGA,mp-7857,"['mp-944359', 'mp-7857', 'mp-933494', 'mp-943716', 'mp-1080025', 'mp-1101062', 'mp-1431082', 'mp-1700571', 'mp-1798427', 'mp-1591911']",0.0023259,"{'Ti': 4.0, 'B': 4.0}",85.17452228816563,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0001092298465558,0.0023259,0,0.0093036,MP,data/source/MP/cleaned/cifs/MP-mp-7857.cif,False,,data/final/MP/graphs/B1Ti1-MP-mp-7857.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ba2Ca0.07Cu4Y0.93O8,2,0.0093333333333333,1.0,True,Ba2Ca0.07Cu4Y0.93O8,Ba2Cu4Y1O8,86.25,Cuprate,True,Ba13.333Ca0.467Cu26.667Y6.2O53.333333333333336,Ba-Ca-Cu-Y-O,5,Supercon,Y0.93Ca0.07Ba2Cu4O8,MP-mp-6790,Ba2Y1Cu4O8,Ba-Cu-Y-O,Ba13.333Cu26.667Y6.667O53.333333333333336,C m m m,orthorhombic,3.889922,3.899603999537882,13.88942687,data/final/MP/cifs/Ba2Ca0.07Cu4Y0.93O8-MP-mp-6790-synth_doped.cif,data/source/MP/raw/cifs/mp-6790.cif,mp-6790,0.0,,2011-05-16 03:21:24,5.936250568336678,10.17188/1283441,"@misc{osti_1283441,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Y(CuO2)4 (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1283441"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686864'}},0.0,3.31391536,520.0,-91.58381472,-6.105587648,"{'tags': ['Yttrium barium copper oxide (1/2/4/8)', 'High pressure experimental phase']}",-91.58381472,-6.105587648,-2.0529924817777783,"['xas', 'bandstructure']",True,"[72261, 85273, 74251, 400273, 85277, 85275, 400280, 67632, 85272, 67631, 83920, 66613, 85279, 400277, 75689, 74259, 85278, 85280, 66603, 94265, 400276, 88873, 71417, 75712, 97052, 66605, 72258, 85281, 85274, 400279, 66604, 69698]",True,2021-05-12 10:57:34.594000,NM,15,10,mp-6790,oxide,Ba2Y(CuO2)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-6790,"['mp-1000664', 'mp-6790', 'mp-1007136', 'mp-1237713', 'mp-1440937', 'mp-1686864', 'mp-1834179', 'mp-1011883', 'mp-1590064', 'mp-1590433']",0.0004643,"{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",208.60454115924333,[],NM,False,65,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.225742533790601e-06,0.0004643,0,0.0004643,MP,data/source/MP/cleaned/cifs/MP-mp-6790.cif,True,,data/final/MP/graphs/Ba2Ca0.07Cu4Y0.93O8-MP-mp-6790-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ce0.95Co1In5La0.05,2,0.0142857142857142,1.0,True,Ce0.95Co1In5La0.05,Ce1Co1In5,1.68,Heavy_fermion,True,Ce13.571Co14.286In71.429La0.714,Ce-Co-In-La,4,Supercon,Ce0.95La0.05Co1In5,MP-mp-19961,Ce1In5Co1,Ce-Co-In,Ce14.286Co14.286In71.429,P 4/m m m,tetragonal,4.635989,4.635989,7.564124,data/final/MP/cifs/Ce0.95Co1In5La0.05-MP-mp-19961-synth_doped.cif,data/source/MP/raw/cifs/mp-19961.cif,mp-19961,0.0,,2014-02-21 14:08:25,7.897022127398995,10.17188/1195145,"@misc{osti_1195145,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeIn5Co (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195145"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701944'}},0.0,7.80626318,520.0,-28.52795357,-4.075421938571429,{'tags': ['Cerium cobalt indium (1/1/5)']},-28.52795357,-4.075421938571429,-0.2468754242857146,"['xas', 'bandstructure']",True,[102108],True,2021-05-12 10:56:57.051000,FM,7,8,mp-19961,,CeIn5Co,"{'functional': 'PBE', 'labels': ['Ce', 'In_d', 'Co'], 'pot_type': 'paw'}","{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",GGA,mp-19961,"['mp-928775', 'mp-912209', 'mp-928270', 'mp-19961', 'mp-1504062', 'mp-1701944', 'mp-1785253', 'mp-1593180']",0.9310323,"{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",162.57113333428427,[],FM,True,123,1,"[0.7, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0057269226147644,0.9310323,1,0.9310323,MP,data/source/MP/cleaned/cifs/MP-mp-19961.cif,True,,data/final/MP/graphs/Ce0.95Co1In5La0.05-MP-mp-19961-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ba0.63Bi1K0.37O3,2,0.0146666666666666,3.0,False,Ba1.89Bi3K1.11O9,Ba2Bi3K1O9,29.58571429,Oxide,True,Ba12.6Bi20K7.4O60,Ba-Bi-K-O,4,Supercon,Ba0.63K0.37Bi1O3,MP-mp-1223518,K1Ba2Bi3O9,Ba-Bi-K-O,Ba13.333Bi20K6.667O60,P -3 m 1,trigonal,6.18756400330999,6.187564340000001,7.581401,data/final/MP/cifs/Ba0.63Bi1K0.37O3-MP-mp-1223518-synth_doped.cif,data/source/MP/raw/cifs/mp-1223518.cif,mp-1223518,0.0,,2019-01-12 23:54:06.965000,7.16530091201999,,,{'GGA': {'task_id': 'mp-1729135'}},0.001551682833333,3.46143017,520.0,-85.22271396,-5.681514264,{'tags': []},-85.22271396,-5.681514264,-2.0170414252000004,[],False,[],True,2021-05-12 11:00:52.054000,NM,15,4,mp-1223518,oxide,KBa2(BiO3)3,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Bi', 'O'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 2.0, 'Bi': 3.0, 'O': 9.0}",GGA,mp-1223518,"['mp-1223518', 'mp-1391182', 'mp-1729135', 'mp-1775199']",4.99e-05,"{'K': 1.0, 'Ba': 2.0, 'Bi': 3.0, 'O': 9.0}",251.37352739849624,[],NM,False,164,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.9850936777799505e-07,4.99e-05,0,4.99e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1223518.cif,True,,data/final/MP/graphs/Ba0.63Bi1K0.37O3-MP-mp-1223518-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Pb0.5Tl0.5,1,0.0,2.0,False,Pb1Tl1,Pb1Tl1,0.0,Other,True,Pb50Tl50,Pb-Tl,2,Supercon,Pb0.5Tl0.5,MP-mp-1216530,Tl1Pb1,Pb-Tl,Pb50Tl50,R -3 m,trigonal,3.560648563792106,3.560648563792106,6.14393349,data/final/MP/cifs/Pb0.5Tl0.5-MP-mp-1216530.cif,data/source/MP/raw/cifs/mp-1216530.cif,mp-1216530,0.0,,2019-01-12 18:01:25.944000,10.751129096830253,,,{'GGA': {'task_id': 'mp-1765292'}},0.0,6.16444718,520.0,-6.08289193,-3.041445965,{'tags': []},-6.08289193,-3.041445965,-0.0038008566666665,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,2,5,mp-1216530,,TlPb,"{'functional': 'PBE', 'labels': ['Tl_d', 'Pb_d'], 'pot_type': 'paw'}","{'Tl': 1.0, 'Pb': 1.0}",GGA,mp-1216530,"['mp-1216530', 'mp-1413086', 'mp-1765292', 'mp-1782536', 'mp-1609976']",0.0032192,"{'Tl': 1.0, 'Pb': 1.0}",63.57008111935415,[],NM,False,166,0,"[0, 0]",5.064017448642051e-05,0.0032192,0,0.0032192,MP,data/source/MP/cleaned/cifs/MP-mp-1216530.cif,False,,data/final/MP/graphs/Pb0.5Tl0.5-MP-mp-1216530.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Fe1La1P1O1,1,0.0,2.0,False,Fe2La2P2O2,Fe2La2P2O2,5.458571429,Ferrite,True,Fe25La25P25O25,Fe-La-P-O,4,Supercon,La1Fe1P1O1,MP-mp-510668,La2Fe2P2O2,Fe-La-P-O,Fe25La25P25O25,P 4/n m m,tetragonal,4.068879,4.068879,9.084981,data/final/MP/cifs/Fe1La1P1O1-MP-mp-510668.cif,data/source/MP/raw/cifs/mp-510668.cif,mp-510668,0.0,,2014-02-26 04:17:37,5.337337070142887,,,{'GGA+U': {'task_id': 'mp-1704083'}},0.3903949226041714,6.29241646,520.0,-55.52669053,-6.94083631625,{'tags': []},-55.52669053,-6.94083631625,-1.734766549583334,"['xas', 'bandstructure']",True,"[162724, 420381, 391428]",True,2021-05-12 10:57:15.388000,FM,8,7,mp-510668,oxide,LaFePO,"{'functional': 'PBE', 'labels': ['La', 'Fe_pv', 'P', 'O'], 'pot_type': 'paw'}","{'La': 1.0, 'Fe': 1.0, 'P': 1.0, 'O': 1.0}",GGA+U,mp-510668,"['mp-542977', 'mp-510668', 'mp-1422599', 'mp-1704083', 'mp-1768909', 'mp-1779846', 'mp-1595432']",3.95130975,"{'La': 2.0, 'Fe': 2.0, 'P': 2.0, 'O': 2.0}",150.40891327693348,[],FM,True,129,1,"[0.0, 0.0, 3.7, 3.7, 0.0, 0.0, 0.0, 0.0]",0.0525408988591631,3.95130975,2,7.9026195,MP,data/source/MP/cleaned/cifs/MP-mp-510668.cif,False,,data/final/MP/graphs/Fe1La1P1O1-MP-mp-510668.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Rh1Zr1,1,0.0,4.0,False,Rh4Zr4,Rh4Zr4,1.35,Other,True,Rh50Zr50,Rh-Zr,2,Supercon,Rh1Zr1,MP-mp-669917,Zr4Rh4,Rh-Zr,Rh50Zr50,P n m a,orthorhombic,4.492176,5.359641,6.154265,data/final/MP/cifs/Rh1Zr1-MP-mp-669917.cif,data/source/MP/raw/cifs/mp-669917.cif,mp-669917,0.0,,2013-10-10 08:44:23,8.702258262059981,10.17188/1281732,"@misc{osti_1281732,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrRh (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281732"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696038'}},0.0,5.42824024,520.0,-70.02420398,-8.7530254975,{'tags': ['Rhodium zirconium (1/1)']},-70.02420398,-8.7530254975,-0.7970212475,"['xas', 'elasticity', 'bandstructure']",True,[105979],True,2021-05-12 10:56:27.046000,NM,8,8,mp-669917,,ZrRh,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Rh_pv'], 'pot_type': 'paw'}","{'Zr': 1.0, 'Rh': 1.0}",GGA,mp-669917,"['mp-943104', 'mp-942084', 'mp-932818', 'mp-669917', 'mp-1432823', 'mp-1696038', 'mp-1924542', 'mp-1588225']",6.2e-06,"{'Zr': 4.0, 'Rh': 4.0}",148.17285767532087,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.6737208412584057e-07,6.2e-06,0,2.48e-05,MP,data/source/MP/cleaned/cifs/MP-mp-669917.cif,False,,data/final/MP/graphs/Rh1Zr1-MP-mp-669917.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ba1Ge12Pt4,1,0.0,1.0,True,Ba1Ge12Pt4,Ba1Ge12Pt4,5.17,Other,True,Ba5.882Ge70.588Pt23.529,Ba-Ge-Pt,3,Supercon,Ba1Pt4Ge12,MP-mp-642304,Ba1Ge12Pt4,Ba-Ge-Pt,Ba5.882Ge70.588Pt23.529,I m -3,cubic,7.645083471694796,7.645083469999999,7.64508347,data/final/MP/cifs/Ba1Ge12Pt4-MP-mp-642304.cif,data/source/MP/raw/cifs/mp-642304.cif,mp-642304,0.0,,2013-06-27 03:14:07,8.63809333529259,10.17188/1280105,"@misc{osti_1280105,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba(Ge3Pt)4 (SG:204) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1280105"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668080'}},0.0,3.85683615,520.0,-87.95775196,-5.173985409411764,{'tags': ['Barium platinum germanide (1/4/12)']},-87.95775196,-5.173985409411764,-0.3693421194117648,"['xas', 'bandstructure']",True,"[174551, 160797, 160798]",True,2021-05-12 10:57:30.779000,NM,17,6,mp-642304,,Ba(Ge3Pt)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ge_d', 'Pt'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Ge': 12.0, 'Pt': 4.0}",GGA,mp-642304,"['mp-642304', 'mp-914966', 'mp-1429457', 'mp-1668080', 'mp-1841530', 'mp-1604761']",0.0003968,"{'Ba': 1.0, 'Ge': 12.0, 'Pt': 4.0}",343.9733561233396,[],NM,False,204,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.1535777202979588e-06,0.0003968,0,0.0003968,MP,data/source/MP/cleaned/cifs/MP-mp-642304.cif,False,,data/final/MP/graphs/Ba1Ge12Pt4-MP-mp-642304.json,0,True,m-3,2,0,0,0,0,0,0,0,0,1,0,1.0,False
Ba1P2Rh2,1,0.0,1.0,True,Ba1P2Rh2,Ba1P2Rh2,1.0,Other,True,Ba20P40Rh40,Ba-P-Rh,3,Supercon,Ba1Rh2P2,MP-mp-8583,Ba1P2Rh2,Ba-P-Rh,Ba20P40Rh40,I 4/m m m,tetragonal,3.985858000974845,3.985858000974845,6.974618519999999,data/final/MP/cifs/Ba1P2Rh2-MP-mp-8583.cif,data/source/MP/raw/cifs/mp-8583.cif,mp-8583,0.0,,2011-05-28 04:41:50,6.636598129964919,10.17188/1309166,"@misc{osti_1309166,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba(PRh)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1309166"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687533'}},0.0,6.06737061,520.0,-32.2451456,-6.4490291200000005,{'tags': ['Barium rhodium phosphide (1/2/2)']},-32.2451456,-6.4490291200000005,-0.9541908033333336,"['bandstructure', 'elasticity']",True,[50188],True,2021-05-12 10:56:31.128000,NM,5,5,mp-8583,,Ba(PRh)2,"{'functional': 'PBE', 'labels': ['Ba_sv', 'P', 'Rh_pv'], 'pot_type': 'paw'}","{'Ba': 1.0, 'P': 2.0, 'Rh': 2.0}",GGA,mp-8583,"['mp-8583', 'mp-1300547', 'mp-1687533', 'mp-1782610', 'mp-1593017']",0.0005345,"{'Ba': 1.0, 'P': 2.0, 'Rh': 2.0}",101.35619556034312,[],NM,False,139,0,"[0, 0, 0, 0, 0]",5.273481280991667e-06,0.0005345,0,0.0005345,MP,data/source/MP/cleaned/cifs/MP-mp-8583.cif,False,,data/final/MP/graphs/Ba1P2Rh2-MP-mp-8583.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Pd0.006Pt2.994U1,2,0.0029999999999999,2.0,False,Pd0.012Pt5.988U2,Pt6U2,0.41,Heavy_fermion,True,Pd0.15Pt74.85U25,Pd-Pt-U,3,Supercon,U1Pt2.994Pd0.006,MP-mp-30855,U2Pt6,Pt-U,Pt75U25,P 63/m m c,hexagonal,4.997603,5.777009996166576,5.7770105,data/final/MP/cifs/Pd0.006Pt2.994U1-MP-mp-30855-synth_doped.cif,data/source/MP/raw/cifs/mp-30855.cif,mp-30855,0.0,,2014-02-19 21:36:23,18.929034548497903,10.17188/1205211,"@misc{osti_1205211,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UPt3 (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1205211"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687777'}},0.0,9.26919984,520.0,-64.84444661,-8.10555582625,"{'tags': ['Platinum uranium (3/1)', 'Uranium platinum boride (1/3/0.11)', 'Uranium platinum (1/3)']}",-64.84444661,-8.10555582625,-0.7295225412500006,"['xas', 'bandstructure']",True,"[615213, 649804, 105833, 191938]",True,2021-05-12 10:57:04.957000,FM,8,11,mp-30855,,UPt3,"{'functional': 'PBE', 'labels': ['U', 'Pt'], 'pot_type': 'paw'}","{'U': 1.0, 'Pt': 3.0}",GGA,mp-30855,"['mp-943077', 'mp-932790', 'mp-942062', 'mp-30855', 'mp-1078485', 'mp-1079639', 'mp-1092253', 'mp-1299942', 'mp-1687777', 'mp-1924669', 'mp-1595664']",0.6726182,"{'U': 2.0, 'Pt': 6.0}",144.44372324836635,[],FM,True,187,1,"[0.0, 1.4, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0093132215768691,0.6726182,1,1.3452364,MP,data/source/MP/cleaned/cifs/MP-mp-30855.cif,True,,data/final/MP/graphs/Pd0.006Pt2.994U1-MP-mp-30855-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Mn3Si1,1,0.0,1.0,True,Mn3Si1,Mn3Si1,0.0,Other,True,Mn75Si25,Mn-Si,2,Supercon,Mn3Si1,MP-mp-20211,Mn3Si1,Mn-Si,Mn75Si25,F m -3 m,cubic,3.99986972,3.999869719999999,3.999869719999999,data/final/MP/cifs/Mn3Si1-MP-mp-20211.cif,data/source/MP/raw/cifs/mp-20211.cif,mp-20211,0.0,,2014-02-21 08:00:22,7.078772647934179,10.17188/1195350,"@misc{osti_1195350,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Mn3Si (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195350"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687898'}},0.0,7.84621646,520.0,-34.10966498,-8.527416245,"{'tags': ['Manganese silicide (3/1)', 'Manganese silicon (3/1)']}",-34.10966498,-8.527416245,-0.2818262709482759,"['xas', 'elasticity', 'bandstructure']",True,"[643621, 643647, 76227, 643616]",True,2021-05-12 10:56:14.760000,FM,4,11,mp-20211,,Mn3Si,"{'functional': 'PBE', 'labels': ['Mn_pv', 'Si'], 'pot_type': 'paw'}","{'Mn': 3.0, 'Si': 1.0}",GGA,mp-20211,"['mp-990982', 'mp-992964', 'mp-20211', 'mp-1138674', 'mp-1146154', 'mp-1439083', 'mp-1655637', 'mp-1687898', 'mp-1793651', 'mp-994313', 'mp-1589612']",2.8462284,"{'Mn': 3.0, 'Si': 1.0}",45.250412152149,[],FM,True,225,2,"[0.5, 0.5, 1.8, 0.0]",0.0628995022283974,2.8462284,3,2.8462284,MP,data/source/MP/cleaned/cifs/MP-mp-20211.cif,False,,data/final/MP/graphs/Mn3Si1-MP-mp-20211.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Cu1La2O4.32,2,0.0374707259953161,0.9259753086419752,True,Cu0.926La1.852O4,Cu1La2O4,37.5,Cuprate,True,Cu13.661La27.322O59.016393442622956,Cu-La-O,3,Supercon,La2Cu1O4.32,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La2O4.32-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La2O4.32-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Mo1Se2,1,0.0,4.0,False,Mo4Se8,Mo4Se8,0.0,Chevrel,True,Mo33.333Se66.667,Mo-Se,2,Supercon,Mo1Se2,MP-mp-1027692,Mo4Se8,Mo-Se,Mo33.333Se66.667,P -3 m 1,trigonal,3.326948003956001,3.32694845,40.902846,data/final/MP/cifs/Mo1Se2-MP-mp-1027692.cif,data/source/MP/raw/cifs/mp-1027692.cif,mp-1027692,1.5906000000000002,,2017-05-17 11:58:51,4.300580707076999,,,{'GGA': {'task_id': 'mp-1027703'}},0.0,1.51317613,700.0,-79.42653316,-6.618877763333334,{'tags': []},-79.42653316,-6.618877763333334,-0.987722434895834,"['diel', 'bandstructure']",True,[],True,2021-05-12 10:56:43.348000,NM,12,8,mp-1027692,,MoSe2,"{'functional': 'PBE', 'labels': ['Mo_pv', 'Se'], 'pot_type': 'paw'}","{'Mo': 1.0, 'Se': 2.0}",GGA,mp-1027692,"['mp-1027692', 'mp-1027701', 'mp-1027703', 'mp-1027732', 'mp-1379497', 'mp-1539022', 'mp-1541461', 'mp-1837775']",3.975e-05,"{'Mo': 4.0, 'Se': 8.0}",392.08141984489305,[],NM,False,164,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.055280152344383e-07,3.975e-05,0,0.000159,MP,data/source/MP/cleaned/cifs/MP-mp-1027692.cif,False,,data/final/MP/graphs/Mo1Se2-MP-mp-1027692.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ce0.98Pt3Si1Th0.02,2,0.008,1.0,True,Ce0.98Pt3Si1Th0.02,Ce1Pt3Si1,0.4,Heavy_fermion,True,Ce19.6Pt60Si20Th0.4,Ce-Pt-Si-Th,4,Supercon,Ce0.98Th0.02Pt3Si1,MP-mp-1207119,Ce1Si1Pt3,Ce-Pt-Si,Ce20Pt60Si20,P 4 m m,tetragonal,4.067884,4.067884,5.552623,data/final/MP/cifs/Ce0.98Pt3Si1Th0.02-MP-mp-1207119-synth_doped.cif,data/source/MP/raw/cifs/mp-1207119.cif,mp-1207119,0.0,,2019-01-12 10:17:34.047000,13.616649050512317,,,,0.0,7.99187805,520.0,-34.84666915,-6.969333829999999,"{'tags': ['CePt3Si', 'CePt3B']}",-34.84666915,-6.969333829999999,-1.0409085689999995,[],False,[],True,2021-05-12 11:00:19.396000,NM,5,2,mp-1207119,,CeSiPt3,"{'functional': 'PBE', 'labels': ['Ce', 'Si', 'Pt'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Si': 1.0, 'Pt': 3.0}",GGA,mp-1207119,"['mp-1207119', 'mp-1923489']",0.0099182,"{'Ce': 1.0, 'Si': 1.0, 'Pt': 3.0}",91.88302988314366,[],NM,False,99,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",0.0001079437629844,0.0099182,0,0.0099182,MP,data/source/MP/cleaned/cifs/MP-mp-1207119.cif,True,,data/final/MP/graphs/Ce0.98Pt3Si1Th0.02-MP-mp-1207119-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
La0.94Mo6Se8,2,0.0074966532797858,1.0,True,La0.94Mo6Se8,La1Mo6Se8,11.0,Chevrel,True,La6.292Mo40.161Se53.548,La-Mo-Se,3,Supercon,La0.94Mo6Se8,MP-mp-37784,La1Mo6Se8,La-Mo-Se,La6.667Mo40Se53.333,R -3,trigonal,6.84882661,6.84882661,6.84882641,data/final/MP/cifs/La0.94Mo6Se8-MP-mp-37784-synth_doped.cif,data/source/MP/raw/cifs/mp-37784.cif,mp-37784,0.0,,2013-11-13 11:12:22,6.964358050864285,,,{'GGA': {'task_id': 'mp-1669492'}},0.0265230636249986,5.68236385,520.0,-109.21685909,-7.281123939333333,"{'tags': ['Lanthanum molybdenum(II/III) selenide (1/6/8)', 'Lanthanum molybdenum selenide (1/6/8)', 'Lanthanum molybdenum(II/III) selenide  (1/6/8)']}",-109.21685909,-7.281123939333333,-1.001046798916666,"['xas', 'bandstructure']",True,"[641459, 641461, 600706, 600656]",True,2021-05-12 10:57:34.594000,FM,15,11,mp-37784,,La(Mo3Se4)2,"{'functional': 'PBE', 'labels': ['La', 'Mo_pv', 'Se'], 'pot_type': 'paw'}","{'La': 1.0, 'Mo': 6.0, 'Se': 8.0}",GGA,mp-37784,"['mp-948248', 'mp-676259', 'mp-949023', 'mp-937946', 'mp-1104045', 'mp-1104421', 'mp-37784', 'mp-1413507', 'mp-1669492', 'mp-1810114', 'mp-1598006']",0.6990221,"{'La': 1.0, 'Mo': 6.0, 'Se': 8.0}",320.98579209458114,[],FM,True,148,1,"[0.0, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0021777353303975,0.6990221,6,0.6990221,MP,data/source/MP/cleaned/cifs/MP-mp-37784.cif,True,,data/final/MP/graphs/La0.94Mo6Se8-MP-mp-37784-synth_doped.json,0,True,-3,0,0,0,0,0,0,2,1,0,0,0,1.0,False
Ge2U1,1,0.0,2.0,False,Ge4U2,Ge4U2,0.55,Heavy_fermion,True,Ge66.667U33.333,Ge-U,2,Supercon,Ge2U1,MP-mp-1237,U2Ge4,Ge-U,Ge66.667U33.333,C m m m,orthorhombic,4.066626001349465,4.212351,7.40537732,data/final/MP/cifs/Ge2U1-MP-mp-1237.cif,data/source/MP/raw/cifs/mp-1237.cif,mp-1237,0.0,,2011-05-14 03:13:15,10.436208619246951,10.17188/1188735,"@misc{osti_1188735,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UGe2 (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188735"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698463'}},0.030721759166667,7.44154485,520.0,-42.66522616,-7.110871026666668,"{'tags': ['Uranium digermanide', 'Uranium germanide (1/2)']}",-42.66522616,-7.110871026666668,-0.2650491200000004,"['xas', 'bandstructure']",True,"[83885, 236995, 82702]",True,2021-05-12 10:56:51.169000,FM,6,9,mp-1237,,UGe2,"{'functional': 'PBE', 'labels': ['U', 'Ge_d'], 'pot_type': 'paw'}","{'U': 1.0, 'Ge': 2.0}",GGA,mp-1237,"['mp-924938', 'mp-909104', 'mp-924140', 'mp-1237', 'mp-1077474', 'mp-1423000', 'mp-1698463', 'mp-1804356', 'mp-1587622']",1.9235989,"{'U': 2.0, 'Ge': 4.0}",121.9790525185556,[],FM,True,65,1,"[1.8, 1.8, 0.0, 0.0, 0.0, 0.0]",0.0315398236054896,1.9235989,2,3.8471978,MP,data/source/MP/cleaned/cifs/MP-mp-1237.cif,False,,data/final/MP/graphs/Ge2U1-MP-mp-1237.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Pd35Zr65,2,0.0333333333333333,0.0285703296703296,False,Pd1Zr1.857,Pd1Zr2,1.98,Other,True,Pd35Zr65,Pd-Zr,2,Supercon,Pd35Zr65,MP-mp-266,Zr2Pd1,Pd-Zr,Pd33.333Zr66.667,I 4/m m m,tetragonal,3.3580019980484703,3.3580019980484703,5.91909309,data/final/MP/cifs/Pd35Zr65-MP-mp-266-synth_doped.cif,data/source/MP/raw/cifs/mp-266.cif,mp-266,0.0,,2011-05-12 21:30:36,7.845685271874635,10.17188/1201202,"@misc{osti_1201202,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Zr2Pd (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201202"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688097'}},0.0,4.68790204,520.0,-23.73938079,-7.91312693,"{'tags': ['Palladium zirconium (1/2)', 'Palladium zironium hydride (1/2/2)']}",-23.73938079,-7.91312693,-0.4880325733333326,"['xas', 'elasticity', 'bandstructure']",True,"[601954, 649146, 105758, 186412, 649158, 109133]",True,2021-05-12 10:56:18.721000,NM,3,12,mp-266,,Zr2Pd,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Pd'], 'pot_type': 'paw'}","{'Zr': 2.0, 'Pd': 1.0}",GGA,mp-266,"['mp-914366', 'mp-977842', 'mp-266', 'mp-1062819', 'mp-1062894', 'mp-1062980', 'mp-1442272', 'mp-1688097', 'mp-1784401', 'mp-992491', 'mp-1591765', 'mp-1062949']",0.0017364,"{'Zr': 2.0, 'Pd': 1.0}",61.13890405598638,[],NM,False,139,0,"[0, 0, 0]",2.8400901632288605e-05,0.0017364,0,0.0017364,MP,data/source/MP/cleaned/cifs/MP-mp-266.cif,True,,data/final/MP/graphs/Pd35Zr65-MP-mp-266-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As2Ba0.5Fe1.9K0.5Mn0.1,2,0.04,2.0,False,As4Ba1Fe3.8K1Mn0.2,As4Ba1Fe4K1,9.53,Ferrite,True,As40Ba10Fe38K10Mn2,As-Ba-Fe-K-Mn,5,Supercon,Ba0.5K0.5Fe1.9Mn0.1As2,MP-mp-1223517,K1Ba1Fe4As4,As-Ba-Fe-K,As40Ba10Fe40K10,C m m m,orthorhombic,5.479027,5.480024002658328,7.13170472,data/final/MP/cifs/As2Ba0.5Fe1.9K0.5Mn0.1-MP-mp-1223517-synth_doped.cif,data/source/MP/raw/cifs/mp-1223517.cif,mp-1223517,0.0,,2019-01-12 23:54:03.876000,5.87534599912672,,,{'GGA': {'task_id': 'mp-1743010'}},0.0132513644999994,4.21185628,520.0,-59.66633886,-5.966633886,{'tags': []},-59.66633886,-5.966633886,-0.4120461663000007,[],False,[],True,2021-05-12 11:00:52.054000,FM,10,4,mp-1223517,,KBa(FeAs)4,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",GGA,mp-1223517,"['mp-1223517', 'mp-1396881', 'mp-1743010', 'mp-1827585']",0.9947188,"{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",197.6961518155852,[],FM,True,65,1,"[0.0, 0.0, 0.3, 0.3, 0.3, 0.3, 0.0, 0.0, 0.0, 0.0]",0.0050315536790412,0.9947188,4,0.9947188,MP,data/source/MP/cleaned/cifs/MP-mp-1223517.cif,True,,data/final/MP/graphs/As2Ba0.5Fe1.9K0.5Mn0.1-MP-mp-1223517-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Pd1Th1,1,0.0,4.0,False,Pd4Th4,Pd4Th4,0.0,Other,True,Pd50Th50,Pd-Th,2,Supercon,Pd1Th1,MP-mp-30838,Th4Pd4,Pd-Th,Pd50Th50,P n m a,orthorhombic,4.589621,5.897895,7.289618,data/final/MP/cifs/Pd1Th1-MP-mp-30838.cif,data/source/MP/raw/cifs/mp-30838.cif,mp-30838,0.0,,2014-02-19 21:36:07,11.392927102638508,10.17188/1205194,"@misc{osti_1205194,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ThPd (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1205194"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687475'}},0.0,6.8787792,520.0,-56.51197188,-7.063996485,{'tags': ['Palladium thorium (1/1)']},-56.51197188,-7.063996485,-0.7671264549999997,"['xas', 'bandstructure']",True,"[105716, 649026]",True,2021-05-12 10:57:04.957000,NM,8,8,mp-30838,,ThPd,"{'functional': 'PBE', 'labels': ['Th', 'Pd'], 'pot_type': 'paw'}","{'Th': 1.0, 'Pd': 1.0}",GGA,mp-30838,"['mp-942044', 'mp-943042', 'mp-30838', 'mp-935251', 'mp-1300060', 'mp-1687475', 'mp-1834248', 'mp-1595798']",5e-07,"{'Th': 4.0, 'Pd': 4.0}",197.32341863417588,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.0135644384450197e-08,5e-07,0,2e-06,MP,data/source/MP/cleaned/cifs/MP-mp-30838.cif,False,,data/final/MP/graphs/Pd1Th1-MP-mp-30838.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Cd2Re2O7.1,2,0.0065520065520065,1.971943661971831,False,Cd3.944Re3.944O14,Cd4Re4O14,1.0,Oxide,True,Cd18.018Re18.018O63.96396396396396,Cd-Re-O,3,Supercon,Cd2Re2O7.1,MP-mp-16783,Cd4Re4O14,Cd-Re-O,Cd18.182Re18.182O63.63636363636364,F d -3 m,cubic,7.34230549,7.342305489999999,7.342305489999999,data/final/MP/cifs/Cd2Re2O7.1-MP-mp-16783-synth_doped.cif,data/source/MP/raw/cifs/mp-16783.cif,mp-16783,0.0,,2014-02-16 11:20:58,8.415597206873366,10.17188/1192162,"@misc{osti_1192162,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Cd2Re2O7 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1192162"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1707971'}},0.0442170945454556,3.654358,520.0,-151.77536418,-6.89888019,{'tags': ['Dicadmium dirhenate(V)']},-151.77536418,-6.89888019,-1.75692010590909,"['xas', 'bandstructure']",True,[28445],True,2021-05-12 10:56:55.092000,FM,22,8,mp-16783,oxide,Cd2Re2O7,"{'functional': 'PBE', 'labels': ['Cd', 'Re_pv', 'O'], 'pot_type': 'paw'}","{'Cd': 2.0, 'Re': 2.0, 'O': 7.0}",GGA,mp-16783,"['mp-914760', 'mp-1001440', 'mp-16783', 'mp-1435795', 'mp-1707971', 'mp-1925291', 'mp-1007953', 'mp-1606557']",1.17431205,"{'Cd': 4.0, 'Re': 4.0, 'O': 14.0}",279.8867584140448,[],FM,True,166,1,"[-0.0, -0.0, -0.0, -0.0, 0.5, 0.5, 0.3, 0.5, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0083913369582336,1.17431205,4,2.3486241,MP,data/source/MP/cleaned/cifs/MP-mp-16783.cif,True,,data/final/MP/graphs/Cd2Re2O7.1-MP-mp-16783-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
B2Mg0.7,3,0.1481481481481481,1.0,True,B2Mg0.7,B2Mg1,37.2,Other,True,B74.074Mg25.926,B-Mg,2,Supercon,B2Mg0.7,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B2Mg0.7-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B2Mg0.7-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Cu0.98La2Zn0.02O4,2,0.0057142857142857,1.0,True,Cu0.98La2Zn0.02O4,Cu1La2O4,0.0,Cuprate,True,Cu14La28.571Zn0.286O57.142857142857146,Cu-La-Zn-O,4,Supercon,La2Cu0.98Zn0.02O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu0.98La2Zn0.02O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu0.98La2Zn0.02O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Nb1S3,1,0.0,6.0,False,Nb6S18,Nb6S18,0.0,Other,True,Nb25S75,Nb-S,2,Supercon,Nb1S3,MP-mp-1190583,Nb6S18,Nb-S,Nb25S75,P 1 21/m 1,monoclinic,3.380758,9.818801,14.99522483,data/final/MP/cifs/Nb1S3-MP-mp-1190583.cif,data/source/MP/raw/cifs/mp-1190583.cif,mp-1190583,0.0,,2019-01-11 21:03:27.510000,3.992007840960719,,,{'GGA': {'task_id': 'mp-1765002'}},0.0,5.1244462,520.0,-153.61398458,-6.400582690833333,{'tags': ['Niobium sulfide (1/3)']},-153.61398458,-6.400582690833333,-1.150169030677084,['bandstructure'],True,[645316],True,2021-05-12 10:58:33.577000,NM,24,5,mp-1190583,,NbS3,"{'functional': 'PBE', 'labels': ['Nb_pv', 'S'], 'pot_type': 'paw'}","{'Nb': 1.0, 'S': 3.0}",GGA,mp-1190583,"['mp-1190583', 'mp-1437209', 'mp-1765002', 'mp-1814972', 'mp-1609601']",0.0003810666666666,"{'Nb': 6.0, 'S': 18.0}",471.958335075417,[],NM,False,11,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.844495435459664e-06,0.0003810666666666,0,0.0022864,MP,data/source/MP/cleaned/cifs/MP-mp-1190583.cif,False,,data/final/MP/graphs/Nb1S3-MP-mp-1190583.json,0,True,2/m,0,0,3,0,0,0,0,1,0,0,0,1.0,False
Cu50Zr50,1,0.0,0.08,False,Cu4Zr4,Cu4Zr4,0.543333333,Other,True,Cu50Zr50,Cu-Zr,2,Supercon,Cu50Zr50,MP-mp-1080022,Zr4Cu4,Cu-Zr,Cu50Zr50,C 1 m 1,monoclinic,5.2821301,5.32613812,5.32613812,data/final/MP/cifs/Cu50Zr50-MP-mp-1080022.cif,data/source/MP/raw/cifs/mp-1080022.cif,mp-1080022,0.0,,2018-04-17 05:48:45,7.22875126367436,,,{'GGA': {'task_id': 'mp-1697447'}},0.0219039710576929,5.11251272,520.0,-51.60710673,-6.45088834125,{'tags': ['Zirconium copper (1/1) - Cm']},-51.60710673,-6.45088834125,-0.1274346912500004,['bandstructure'],True,"[167597, 167598]",True,2021-05-12 10:58:16.596000,NM,8,5,mp-1080022,,ZrCu,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Cu_pv'], 'pot_type': 'paw'}","{'Zr': 1.0, 'Cu': 1.0}",GGA,mp-1080022,"['mp-1080022', 'mp-1428332', 'mp-1697447', 'mp-1867001', 'mp-1597149']",0.0024924,"{'Zr': 4.0, 'Cu': 4.0}",142.21080347813688,[],NM,False,8,0,"[0, 0, 0, 0, 0, 0, 0, 0]",7.010437854345363e-05,0.0024924,0,0.0099696,MP,data/source/MP/cleaned/cifs/MP-mp-1080022.cif,False,,data/final/MP/graphs/Cu50Zr50-MP-mp-1080022.json,0,True,m,0,0,5,0,0,0,0,0,1,0,0,1.0,False
Bi1Nb3,1,0.0,2.0,False,Bi2Nb6,Bi2Nb6,2.516666667,Other,True,Bi25Nb75,Bi-Nb,2,Supercon,Bi1Nb3,MP-mp-568014,Nb6Bi2,Bi-Nb,Bi25Nb75,P m -3 n,cubic,5.387786,5.387786,5.387786,data/final/MP/cifs/Bi1Nb3-MP-mp-568014.cif,data/source/MP/raw/cifs/mp-568014.cif,mp-568014,0.0,,2014-02-16 09:18:45,10.35619994675573,10.17188/1274179,"@misc{osti_1274179,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Bi (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1274179"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695405'}},0.0325123537499987,6.61714745,520.0,-68.12780003,-8.51597500375,{'tags': ['Bismuth niobium (1/3) - HT']},-68.12780003,-8.51597500375,0.0325123537499987,"['xas', 'elasticity', 'bandstructure']",True,[58817],True,2021-05-12 10:56:22.739000,NM,8,8,mp-568014,,Nb3Bi,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Bi'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Bi': 1.0}",GGA,mp-568014,"['mp-912130', 'mp-928730', 'mp-928264', 'mp-568014', 'mp-1431340', 'mp-1695405', 'mp-1786992', 'mp-1596634']",0.00272985,"{'Nb': 6.0, 'Bi': 2.0}",156.39793420298878,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",3.4909028868078644e-05,0.00272985,0,0.0054597,MP,data/source/MP/cleaned/cifs/MP-mp-568014.cif,False,,data/final/MP/graphs/Bi1Nb3-MP-mp-568014.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Cu2.05Gd1Ru0.95Sr2O8,2,0.0071428571428571,2.0,False,Cu4.1Gd2Ru1.9Sr4O16,Cu4Gd2Ru2Sr4O16,26.05,Cuprate,True,Cu14.643Gd7.143Ru6.786Sr14.286O57.142857142857146,Cu-Gd-Ru-Sr-O,5,Supercon,Gd1Sr2Ru0.95Cu2.05O8,MP-mp-1194240,Sr4Gd2Cu4Ru2O16,Cu-Gd-Ru-Sr-O,Cu14.286Gd7.143Ru7.143Sr14.286O57.142857142857146,P 4/m b m,tetragonal,5.472451,5.472451,11.740702,data/final/MP/cifs/Cu2.05Gd1Ru0.95Sr2O8-MP-mp-1194240-synth_doped.cif,data/source/MP/raw/cifs/mp-1194240.cif,mp-1194240,0.0,,2019-01-11 23:51:58.932000,6.504561898971391,,,{'GGA': {'task_id': 'mp-1765260'}},0.0213449239285443,3.93502801,520.0,-201.55352223,-7.198340079642857,"{'tags': ['Sr2Cu2GdRuO8 orth', 'Sr2Cu2GdRuO8', 'Ruthenium distrontium gadolinium dicopper octaoxide']}",-201.55352223,-7.198340079642857,-2.268654352380952,['bandstructure'],True,[245741],True,2021-05-12 10:58:35.561000,FiM,28,6,mp-1194240,oxide,Sr2GdCu2RuO8,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Gd', 'Cu_pv', 'Ru_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Gd': 1.0, 'Cu': 2.0, 'Ru': 1.0, 'O': 8.0}",GGA,mp-1194240,"['mp-1194240', 'mp-1396976', 'mp-1659973', 'mp-1765260', 'mp-1841948', 'mp-1638264']",4.23696715,"{'Sr': 4.0, 'Gd': 2.0, 'Cu': 4.0, 'Ru': 2.0, 'O': 16.0}",351.6072554818909,[],FiM,True,127,2,"[-0.0, -0.0, -0.0, -0.0, 6.9, 6.9, 0.0, 0.0, 0.0, 0.0, -1.8, -1.8, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0241005672319991,4.23696715,4,8.4739343,MP,data/source/MP/cleaned/cifs/MP-mp-1194240.cif,True,,data/final/MP/graphs/Cu2.05Gd1Ru0.95Sr2O8-MP-mp-1194240-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ba0.14W1O3,2,0.0123671497584539,12.0,False,Ba1.68W12O36,Ba2W12O36,1.725,Oxide,True,Ba3.382W24.155O72.46376811594202,Ba-W-O,3,Supercon,Ba0.14O3W1,MP-mp-867545,Ba2W12O36,Ba-W-O,Ba4W24O72,C 1 2/m 1,monoclinic,7.761157999215288,8.98804026,10.933428409999998,data/final/MP/cifs/Ba0.14W1O3-MP-mp-867545-synth_doped.cif,data/source/MP/raw/cifs/mp-867545.cif,mp-867545,0.0,,2014-10-22 22:17:03,7.118583285305415,,,{'GGA+U': {'task_id': 'mp-898260'}},0.0,3.14034167,520.0,-374.54002185,-7.490800437000001,{'tags': []},-374.54002185,-7.490800437000001,-2.3013193274000003,"['xas', 'bandstructure']",True,[],True,2021-05-12 10:57:55.580000,FM,50,8,mp-867545,oxide,Ba(WO3)6,"{'functional': 'PBE', 'labels': ['Ba_sv', 'W_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 1.0, 'W': 6.0, 'O': 18.0}",GGA+U,mp-867545,"['mp-868170', 'mp-898260', 'mp-883072', 'mp-867545', 'mp-883069', 'mp-1349860', 'mp-1892225', 'mp-898939']",1.9999925,"{'Ba': 2.0, 'W': 12.0, 'O': 36.0}",713.033781038761,[],FM,True,12,3,"[0.0, 0.0, 0.4, 0.4, 0.4, 0.4, 0.4, 0.4, 0.4, 0.4, 0.4, 0.4, 0.4, 0.4, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0056098113530788,1.9999925,12,3.999985,MP,data/source/MP/cleaned/cifs/MP-mp-867545.cif,True,,data/final/MP/graphs/Ba0.14W1O3-MP-mp-867545-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
B2C1Ho0.85Ni2Y0.15,2,0.05,1.0,True,B2C1Ho0.85Ni2Y0.15,B2C1Ho1Ni2,9.3,Other,True,B33.333C16.667Ho14.167Ni33.333Y2.5,B-C-Ho-Ni-Y,5,Supercon,Ho0.85Y0.15Ni2B2C1,MP-mp-6646,Ho1Ni2B2C1,B-C-Ho-Ni,B33.333C16.667Ho16.667Ni33.333,I 4/m m m,tetragonal,3.529863997734658,3.529863997734658,5.76032203,data/final/MP/cifs/B2C1Ho0.85Ni2Y0.15-MP-mp-6646-synth_doped.cif,data/source/MP/raw/cifs/mp-6646.cif,mp-6646,0.0,,2011-05-13 04:24:09,8.11075125231065,10.17188/1281460,"@misc{osti_1281460,
    author = ""Persson, Kristin"",
    title = ""Materials Data on HoNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281460"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1670774'}},0.0,6.70981387,520.0,-41.84364575,-6.973940958333333,{'tags': ['Holmium dinickel diboride carbide']},-41.84364575,-6.973940958333333,-0.5192332130555558,"['xas', 'elasticity', 'bandstructure']",True,"[79064, 56650, 79065, 79062, 79063, 79575]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-6646,,HoNi2B2C,"{'functional': 'PBE', 'labels': ['Ho_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Ho': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6646,"['mp-1007146', 'mp-6646', 'mp-1000682', 'mp-1439301', 'mp-1670774', 'mp-1782657', 'mp-1011887', 'mp-1589032']",0.0032459,"{'Ho': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",64.68537905730652,[],NM,False,139,0,"[0.0, -0.0, -0.0, 0.0, 0.0, 0.0]",5.017980952271099e-05,0.0032459,0,0.0032459,MP,data/source/MP/cleaned/cifs/MP-mp-6646.cif,True,,data/final/MP/graphs/B2C1Ho0.85Ni2Y0.15-MP-mp-6646-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Al0.9Be0.1Nb3,2,0.0499999999999999,2.0,False,Al1.8Be0.2Nb6,Al2Nb6,19.8,Other,True,Al22.5Be2.5Nb75,Al-Be-Nb,3,Supercon,Nb3Al0.9Be0.1,MP-mp-796,Nb6Al2,Al-Nb,Al25Nb75,P m -3 n,cubic,5.215254,5.215254,5.215254,data/final/MP/cifs/Al0.9Be0.1Nb3-MP-mp-796-synth_doped.cif,data/source/MP/raw/cifs/mp-796.cif,mp-796,0.0,,2011-05-13 16:07:37,7.157298025966356,,,{'GGA': {'task_id': 'mp-1686893'}},0.0460773865000003,5.52947534,520.0,-69.48918494,-8.6861481175,"{'tags': ['Aluminium niobium (1/3)', 'Niobium aluminide (3/1)', 'Aluminum niobium (1/3)']}",-69.48918494,-8.6861481175,-0.1737753800000003,"['bandstructure', 'elasticity']",True,"[608675, 608654, 608688, 608668, 608669, 608685, 608676, 608683, 58014, 608657, 107856, 608655, 608666, 608691, 608656, 608665, 608673, 608653, 608661]",True,2021-05-12 10:56:31.128000,NM,8,10,mp-796,,Nb3Al,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Al': 1.0}",GGA,mp-796,"['mp-911586', 'mp-927906', 'mp-796', 'mp-927472', 'mp-1260512', 'mp-1440919', 'mp-1686893', 'mp-1927652', 'mp-1591599', 'mp-1587739']",0.16323955,"{'Nb': 6.0, 'Al': 2.0}",141.8490379078192,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0023015954483396,0.16323955,0,0.3264791,MP,data/source/MP/cleaned/cifs/MP-mp-796.cif,True,,data/final/MP/graphs/Al0.9Be0.1Nb3-MP-mp-796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Cu1Nd1.8O4,2,0.042016806722689,1.0,True,Cu1Nd1.8O4,Cu1Nd2O4,31.3,Cuprate,True,Cu14.706Nd26.471O58.82352941176471,Cu-Nd-O,3,Supercon,Nd1.8Cu1O4,MP-mp-4158,Nd2Cu1O4,Cu-Nd-O,Cu14.286Nd28.571O57.142857142857146,I 4/m m m,tetragonal,3.973854000245551,3.973854000245551,6.78296857,data/final/MP/cifs/Cu1Nd1.8O4-MP-mp-4158-synth_doped.cif,data/source/MP/raw/cifs/mp-4158.cif,mp-4158,0.0,,2011-05-13 10:19:33,7.086167303782593,10.17188/1207899,"@misc{osti_1207899,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nd2CuO4 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207899"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-670050'}},0.0009497997619085,3.16510927,520.0,-51.48091453,-7.354416361428571,"{'tags': ['Dineodymium copper tetraoxide', 'Dineodymium copper oxide', 'Dineodymium cuprate', 'High pressure experimental phase']}",-51.48091453,-7.354416361428571,-2.971653917142857,"['xas', 'elasticity', 'bandstructure']",True,"[261376, 203228, 160629, 261375, 69479, 186590, 4203, 75830, 75825, 202885, 203229, 71181, 82067, 75828, 69886, 75826, 75829, 75824, 75827, 69482, 86752]",True,2021-05-12 10:56:20.740000,NM,7,11,mp-4158,oxide,Nd2CuO4,"{'functional': 'PBE', 'labels': ['Nd_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Nd': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-4158,"['mp-670050', 'mp-660368', 'mp-4158', 'mp-1078016', 'mp-1173374', 'mp-1440751', 'mp-1668619', 'mp-1797319', 'mp-1588086', 'mp-1590518', 'mp-688505']",0.0084899,"{'Nd': 2.0, 'Cu': 1.0, 'O': 4.0}",97.4899480873212,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",8.708487558528232e-05,0.0084899,0,0.0084899,MP,data/source/MP/cleaned/cifs/MP-mp-4158.cif,True,,data/final/MP/graphs/Cu1Nd1.8O4-MP-mp-4158-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Hf0.8Ti0.2V2,3,0.1333333333333333,2.0,False,Hf1.6Ti0.4V4,Hf2V4,8.8,Other,True,Hf26.667Ti6.667V66.667,Hf-Ti-V,3,Supercon,V2Hf0.8Ti0.2,MP-mp-1077017,Hf2V4,Hf-V,Hf33.333V66.667,I 41/a m d,tetragonal,5.147745850539648,5.14774585,5.14774585,data/final/MP/cifs/Hf0.8Ti0.2V2-MP-mp-1077017-synth_doped.cif,data/source/MP/raw/cifs/mp-1077017.cif,mp-1077017,0.0,,2018-04-07 18:44:03,9.47163160017764,,,{'GGA': {'task_id': 'mp-1759109'}},0.0337706083333326,5.06389256,520.0,-56.04737833,-9.341229721666666,{'tags': ['Hafnium vanadium (1/2)']},-56.04737833,-9.341229721666666,0.033770608333332,['bandstructure'],True,[187951],True,2021-05-12 10:58:14.654000,NM,6,5,mp-1077017,,HfV2,"{'functional': 'PBE', 'labels': ['Hf_pv', 'V_pv'], 'pot_type': 'paw'}","{'Hf': 1.0, 'V': 2.0}",GGA,mp-1077017,"['mp-1077017', 'mp-1391381', 'mp-1759109', 'mp-1796366', 'mp-1627385']",0.03458425,"{'Hf': 2.0, 'V': 4.0}",98.30836742237948,[],NM,False,141,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0007035871087434,0.03458425,0,0.0691685,MP,data/source/MP/cleaned/cifs/MP-mp-1077017.cif,True,,data/final/MP/graphs/Hf0.8Ti0.2V2-MP-mp-1077017-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Be13Th0.038U0.962,2,0.0054285714285714,2.0,False,Be26Th0.076U1.924,Be26U2,0.5515000000000001,Heavy_fermion,True,Be92.857Th0.271U6.871,Be-Th-U,3,Supercon,U0.9622Th0.0378Be13,MP-mp-1163,U2Be26,Be-U,Be92.857U7.143,F m -3 c,cubic,7.174675929999999,7.174675929999999,7.174675929999999,data/final/MP/cifs/Be13Th0.038U0.962-MP-mp-1163-synth_doped.cif,data/source/MP/raw/cifs/mp-1163.cif,mp-1163,0.0,,2011-05-15 13:39:09,4.516943134220159,10.17188/1188115,"@misc{osti_1188115,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UBe13 (SG:226) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188115"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1676276'}},0.0,5.60901004,520.0,-121.44122023,-4.337186436785714,"{'tags': ['Uranium beryllium (1/13)', 'Beryllium uranium (13/1)']}",-121.44122023,-4.337186436785714,-0.0583452042857146,"['xas', 'bandstructure']",True,"[616470, 58748, 616481, 58747, 58749, 659562, 107528, 600563, 58750, 616488, 58751]",True,2021-05-12 10:56:51.169000,NM,28,8,mp-1163,,UBe13,"{'functional': 'PBE', 'labels': ['U', 'Be_sv'], 'pot_type': 'paw'}","{'U': 1.0, 'Be': 13.0}",GGA,mp-1163,"['mp-1163', 'mp-906858', 'mp-920459', 'mp-921486', 'mp-1381018', 'mp-1676276', 'mp-1775695', 'mp-1603627']",0.0460573,"{'U': 2.0, 'Be': 26.0}",261.15110606061,[],NM,False,226,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0003527252914587,0.0460573,0,0.0921146,MP,data/source/MP/cleaned/cifs/MP-mp-1163.cif,True,,data/final/MP/graphs/Be13Th0.038U0.962-MP-mp-1163-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
B6Sm1,1,0.0,1.0,True,B6Sm1,B6Sm1,0.0,Other,True,B85.714Sm14.286,B-Sm,2,Supercon,B6Sm1,MP-mp-6996,Sm1B6,B-Sm,B85.714Sm14.286,P m -3 m,cubic,4.119695,4.119695,4.119695,data/final/MP/cifs/B6Sm1-MP-mp-6996.cif,data/source/MP/raw/cifs/mp-6996.cif,mp-6996,0.0,,2011-05-27 16:34:59,5.1115032187214045,10.17188/1285548,"@misc{osti_1285548,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SmB6 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1285548"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686761'}},0.0,6.46728412,520.0,-47.97992603,-6.854275147142857,"{'tags': ['Samarium octahedro-hexaboride', 'Samarium boride (1/6)']}",-47.97992603,-6.854275147142857,-0.4549984671428565,"['bandstructure', 'elasticity']",True,"[194323, 194328, 194198, 194330, 194199, 194324, 194326, 194325, 194327, 194196, 194197, 194329, 615441, 248243, 602748, 615476, 615466, 615449, 615446, 615478, 615453, 615461, 248240, 615444, 615473, 615462, 248241, 615469, 248242, 615471]",True,2021-05-12 10:56:29.056000,NM,7,21,mp-6996,,SmB6,"{'functional': 'PBE', 'labels': ['Sm_3', 'B'], 'pot_type': 'paw'}","{'Sm': 1.0, 'B': 6.0}",GGA,mp-6996,"['mp-1001097', 'mp-1007470', 'mp-6996', 'mp-1077841', 'mp-1077842', 'mp-1077846', 'mp-1077850', 'mp-1077863', 'mp-1077865', 'mp-1077870', 'mp-1077873', 'mp-1077876', 'mp-1077877', 'mp-1077880', 'mp-1077895', 'mp-1440561', 'mp-1686761', 'mp-1782950', 'mp-1012237', 'mp-1588285', 'mp-1591085']",0.0004451,"{'Sm': 1.0, 'B': 6.0}",69.91899757376063,[],NM,False,221,0,"[0, 0, 0, 0, 0, 0, 0]",6.365937948844938e-06,0.0004451,0,0.0004451,MP,data/source/MP/cleaned/cifs/MP-mp-6996.cif,False,,data/final/MP/graphs/B6Sm1-MP-mp-6996.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
B12Y1,1,0.0,1.0,True,B12Y1,B12Y1,4.7,Other,True,B92.308Y7.692,B-Y,2,Supercon,B12Y1,MP-mp-7817,Y1B12,B-Y,B92.308Y7.692,F m -3 m,cubic,5.30370674,5.303706739999999,5.303706739999999,data/final/MP/cifs/B12Y1-MP-mp-7817.cif,data/source/MP/raw/cifs/mp-7817.cif,mp-7817,0.0,,2011-05-28 02:49:48,3.441525061250557,10.17188/1307548,"@misc{osti_1307548,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YB12 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1307548"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700450'}},0.0,6.16148046,520.0,-89.79011,-6.906931538461539,"{'tags': ['Yttrium dodecaboride', 'Yttrium boride (1/12)']}",-89.79011,-6.906931538461539,-0.2439182797435896,['bandstructure'],True,"[23860, 615707, 615716]",True,2021-05-12 10:59:07.834000,NM,13,9,mp-7817,,YB12,"{'functional': 'PBE', 'labels': ['Y_sv', 'B'], 'pot_type': 'paw'}","{'Y': 1.0, 'B': 12.0}",GGA,mp-7817,"['mp-990143', 'mp-990164', 'mp-7817', 'mp-1141382', 'mp-1435658', 'mp-1700450', 'mp-1797455', 'mp-990185', 'mp-1601984']",0.0008807,"{'Y': 1.0, 'B': 12.0}",105.4929674783498,[],NM,False,225,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",8.348423795934501e-06,0.0008807,0,0.0008807,MP,data/source/MP/cleaned/cifs/MP-mp-7817.cif,False,,data/final/MP/graphs/B12Y1-MP-mp-7817.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Bi0.56Pb0.44,3,0.12,2.0,False,Bi1.12Pb0.88,Bi1Pb1,8.8,Other,True,Bi56Pb44,Bi-Pb,2,Supercon,Bi0.56Pb0.44,MP-mp-1227326,Bi1Pb1,Bi-Pb,Bi50Pb50,P -6 m 2,hexagonal,3.516368000693316,3.5163671200000004,5.970432,data/final/MP/cifs/Bi0.56Pb0.44-MP-mp-1227326-synth_doped.cif,data/source/MP/raw/cifs/mp-1227326.cif,mp-1227326,0.0,,2019-01-13 03:10:32.704000,10.809505812237871,,,{'GGA': {'task_id': 'mp-1734205'}},0.051447295,6.6014312,520.0,-7.49978679,-3.749893395,{'tags': []},-7.49978679,-3.749893395,0.051447295,['bandstructure'],True,[],True,2021-05-12 10:58:49.477000,NM,2,5,mp-1227326,,BiPb,"{'functional': 'PBE', 'labels': ['Bi', 'Pb_d'], 'pot_type': 'paw'}","{'Bi': 1.0, 'Pb': 1.0}",GGA,mp-1227326,"['mp-1227326', 'mp-1415472', 'mp-1734205', 'mp-1793117', 'mp-1609931']",0.0053651,"{'Bi': 1.0, 'Pb': 1.0}",63.93297019839806,[],NM,False,187,0,"[0, 0]",8.391757779047205e-05,0.0053651,0,0.0053651,MP,data/source/MP/cleaned/cifs/MP-mp-1227326.cif,True,,data/final/MP/graphs/Bi0.56Pb0.44-MP-mp-1227326-synth_doped.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
B2C1Ho1Ni2,1,0.0,1.0,True,B2C1Ho1Ni2,B2C1Ho1Ni2,8.0661764705,Other,True,B33.333C16.667Ho16.667Ni33.333,B-C-Ho-Ni,4,Supercon,Ho1Ni2B2C,MP-mp-6646,Ho1Ni2B2C1,B-C-Ho-Ni,B33.333C16.667Ho16.667Ni33.333,I 4/m m m,tetragonal,3.529863997734658,3.529863997734658,5.76032203,data/final/MP/cifs/B2C1Ho1Ni2-MP-mp-6646.cif,data/source/MP/raw/cifs/mp-6646.cif,mp-6646,0.0,,2011-05-13 04:24:09,8.11075125231065,10.17188/1281460,"@misc{osti_1281460,
    author = ""Persson, Kristin"",
    title = ""Materials Data on HoNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281460"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1670774'}},0.0,6.70981387,520.0,-41.84364575,-6.973940958333333,{'tags': ['Holmium dinickel diboride carbide']},-41.84364575,-6.973940958333333,-0.5192332130555558,"['xas', 'elasticity', 'bandstructure']",True,"[79064, 56650, 79065, 79062, 79063, 79575]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-6646,,HoNi2B2C,"{'functional': 'PBE', 'labels': ['Ho_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Ho': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6646,"['mp-1007146', 'mp-6646', 'mp-1000682', 'mp-1439301', 'mp-1670774', 'mp-1782657', 'mp-1011887', 'mp-1589032']",0.0032459,"{'Ho': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",64.68537905730652,[],NM,False,139,0,"[0.0, -0.0, -0.0, 0.0, 0.0, 0.0]",5.017980952271099e-05,0.0032459,0,0.0032459,MP,data/source/MP/cleaned/cifs/MP-mp-6646.cif,False,,data/final/MP/graphs/B2C1Ho1Ni2-MP-mp-6646.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Au0.75Hg0.25,1,0.0,8.0,False,Au6Hg2,Au6Hg2,0.0,Other,True,Au75Hg25,Au-Hg,2,Supercon,Au0.75Hg0.25,MP-mp-1184705,Hg2Au6,Au-Hg,Au75Hg25,P 63/m m c,hexagonal,4.863671,6.028145996578853,6.0281455,data/final/MP/cifs/Au0.75Hg0.25-MP-mp-1184705.cif,data/source/MP/raw/cifs/mp-1184705.cif,mp-1184705,0.0,,2019-01-11 12:59:50.882000,17.173628593754863,,,{'GGA': {'task_id': 'mp-1753429'}},0.0537466150000001,4.52262427,520.0,-19.82067705,-2.47758463125,{'tags': []},-19.82067705,-2.47758463125,0.0537466150000001,['bandstructure'],True,[],True,2021-05-12 10:58:27.755000,NM,8,5,mp-1184705,,HgAu3,"{'functional': 'PBE', 'labels': ['Hg', 'Au'], 'pot_type': 'paw'}","{'Hg': 1.0, 'Au': 3.0}",GGA,mp-1184705,"['mp-1184705', 'mp-1399591', 'mp-1753429', 'mp-1930583', 'mp-1620130']",0.0005818,"{'Hg': 2.0, 'Au': 6.0}",153.06020764455434,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",7.602237171284795e-06,0.0005818,0,0.0011636,MP,data/source/MP/cleaned/cifs/MP-mp-1184705.cif,False,,data/final/MP/graphs/Au0.75Hg0.25-MP-mp-1184705.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ga0.65Nb3Sn0.35,3,0.075,2.0,False,Ga1.3Nb6Sn0.7,Ga1Nb6Sn1,16.3,Other,True,Ga16.25Nb75Sn8.75,Ga-Nb-Sn,3,Supercon,Nb3Ga0.65Sn0.35,MP-mp-1220342,Nb6Ga1Sn1,Ga-Nb-Sn,Ga12.5Nb75Sn12.5,P m -3,cubic,5.267319,5.267319,5.267319,data/final/MP/cifs/Ga0.65Nb3Sn0.35-MP-mp-1220342-synth_doped.cif,data/source/MP/raw/cifs/mp-1220342.cif,mp-1220342,0.0,,2019-01-12 21:12:16.669000,8.475086109299342,,,{'GGA': {'task_id': 'mp-1733533'}},0.0480318309375,5.78514107,520.0,-68.8247362,-8.603092025,{'tags': []},-68.8247362,-8.603092025,-0.1474047603125008,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,8,5,mp-1220342,,Nb6GaSn,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Ga_d', 'Sn_d'], 'pot_type': 'paw'}","{'Nb': 6.0, 'Ga': 1.0, 'Sn': 1.0}",GGA,mp-1220342,"['mp-1220342', 'mp-1392260', 'mp-1733533', 'mp-1929075', 'mp-1619541']",0.5383733,"{'Nb': 6.0, 'Ga': 1.0, 'Sn': 1.0}",146.13991918453098,[],NM,False,200,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0036839578330421,0.5383733,0,0.5383733,MP,data/source/MP/cleaned/cifs/MP-mp-1220342.cif,True,,data/final/MP/graphs/Ga0.65Nb3Sn0.35-MP-mp-1220342-synth_doped.json,0,True,m-3,2,0,0,0,0,0,0,1,0,0,0,1.0,False
C1Mg0.9Ni3Zn0.1,2,0.0399999999999999,1.0,True,C1Mg0.9Ni3Zn0.1,C1Mg1Ni3,4.5,Other,True,C20Mg18Ni60Zn2,C-Mg-Ni-Zn,4,Supercon,Mg0.9Zn0.1C1Ni3,MP-mp-10700,Mg1Ni3C1,C-Mg-Ni,C20Mg20Ni60,P m -3 m,cubic,3.810209,3.810209,3.810209,data/final/MP/cifs/C1Mg0.9Ni3Zn0.1-MP-mp-10700-synth_doped.cif,data/source/MP/raw/cifs/mp-10700.cif,mp-10700,0.0,,2011-05-28 10:04:44,6.376007671789427,10.17188/1187303,"@misc{osti_1187303,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MgNi3C (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187303"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678621'}},0.0,6.64260176,520.0,-28.85099542,-5.770199084,{'tags': ['Magnesium nickel carbide (1/3/1)']},-28.85099542,-5.770199084,-0.1367049259999994,"['xas', 'elasticity', 'bandstructure']",True,[77152],True,2021-05-12 10:56:10.715000,NM,5,8,mp-10700,,MgNi3C,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Ni_pv', 'C'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",GGA,mp-10700,"['mp-927245', 'mp-927653', 'mp-911184', 'mp-10700', 'mp-1438083', 'mp-1678621', 'mp-1791467', 'mp-1591421']",0.0387875,"{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",55.31544309398296,[],NM,False,221,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",0.0007012056277683,0.0387875,0,0.0387875,MP,data/source/MP/cleaned/cifs/MP-mp-10700.cif,True,,data/final/MP/graphs/C1Mg0.9Ni3Zn0.1-MP-mp-10700-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
La1Pb3,1,0.0,1.0,True,La1Pb3,La1Pb3,4.086666667,Other,True,La25Pb75,La-Pb,2,Supercon,La1Pb3,MP-mp-21432,La1Pb3,La-Pb,La25Pb75,P m -3 m,cubic,4.968277,4.968277,4.968277,data/final/MP/cifs/La1Pb3-MP-mp-21432.cif,data/source/MP/raw/cifs/mp-21432.cif,mp-21432,0.0,,2014-02-21 08:53:02,10.297552988886016,10.17188/1196890,"@misc{osti_1196890,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaPb3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196890"",
    place = ""United States"",
    year = ""2016"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687535'}},0.0,7.94036935,520.0,-17.86283558,-4.465708895,{'tags': ['Lanthanum lead (1/3)']},-17.86283558,-4.465708895,-0.447221816249999,"['xas', 'elasticity', 'bandstructure']",True,"[641644, 104691, 641647, 641640, 104692, 151360]",True,2021-05-12 10:56:16.728000,NM,4,8,mp-21432,,LaPb3,"{'functional': 'PBE', 'labels': ['La', 'Pb_d'], 'pot_type': 'paw'}","{'La': 1.0, 'Pb': 3.0}",GGA,mp-21432,"['mp-993074', 'mp-991107', 'mp-21432', 'mp-1439281', 'mp-1687535', 'mp-1784789', 'mp-994394', 'mp-1589043']",0.0017048,"{'La': 1.0, 'Pb': 3.0}",122.63583830653424,[],NM,False,221,0,"[0, 0, 0, 0]",1.3901319740961604e-05,0.0017048,0,0.0017048,MP,data/source/MP/cleaned/cifs/MP-mp-21432.cif,False,,data/final/MP/graphs/La1Pb3-MP-mp-21432.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
As1F0.11Fe1Pr1O0.89,3,0.0549999999999999,2.0,False,As2F0.22Fe2Pr2O1.78,As2Fe2Pr2O2,45.0,Ferrite,True,As25F2.75Fe25Pr25O22.25,As-F-Fe-Pr-O,5,Supercon,Pr1Fe1As1F0.11O0.89,MP-mp-22491,Pr2Fe2As2O2,As-Fe-Pr-O,As25Fe25Pr25O25,P 4/n m m,tetragonal,4.094889,4.094889,9.258722,data/final/MP/cifs/As1F0.11Fe1Pr1O0.89-MP-mp-22491-synth_doped.cif,data/source/MP/raw/cifs/mp-22491.cif,mp-22491,0.0,,2014-02-25 19:17:30,6.153806906111091,,,{'GGA+U': {'task_id': 'mp-1695715'}},0.3808778432291664,4.12348168,520.0,-51.7633941,-6.4704242625,{'tags': ['Praseodymium iron arsenic oxide (1/1/1/1)']},-51.7633941,-6.4704242625,-1.491677511249999,"['xas', 'bandstructure']",True,"[162830, 162833, 246832, 90316, 422000, 236649, 236648, 602491]",True,2021-05-12 10:57:10.838000,FM,8,8,mp-22491,oxide,PrFeAsO,"{'functional': 'PBE', 'labels': ['Pr_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Pr': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-22491,"['mp-510622', 'mp-1079608', 'mp-1079857', 'mp-22491', 'mp-1476145', 'mp-1695715', 'mp-1778524', 'mp-1596397']",3.7947681,"{'Pr': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",155.25132378854377,[],FM,True,129,1,"[0.0, 0.0, 3.5, 3.5, 0.0, 0.0, 0.0, 0.0]",0.0488854846116297,3.7947681,2,7.5895362,MP,data/source/MP/cleaned/cifs/MP-mp-22491.cif,True,,data/final/MP/graphs/As1F0.11Fe1Pr1O0.89-MP-mp-22491-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Bi1Ce1,1,0.0,1.0,True,Bi1Ce1,Bi1Ce1,0.0,Heavy_fermion,True,Bi50Ce50,Bi-Ce,2,Supercon,Bi1Ce1,MP-mp-23285,Ce1Bi1,Bi-Ce,Bi50Ce50,F m -3 m,cubic,4.61158638,4.61158638,4.61158638,data/final/MP/cifs/Bi1Ce1-MP-mp-23285.cif,data/source/MP/raw/cifs/mp-23285.cif,mp-23285,0.0,,2014-02-21 07:24:24,8.359078861896002,10.17188/1199393,"@misc{osti_1199393,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeBi (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199393"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686806'}},0.0,6.26532134,520.0,-11.44913797,-5.724568985,"{'tags': ['Bismuth cerium (1/1)', 'Cerium bismuthide (1/1)']}",-11.44913797,-5.724568985,-0.8130072525000003,"['xas', 'elasticity', 'bandstructure']",True,"[616560, 616547, 616556, 616548, 58765, 187506, 603016]",True,2021-05-12 10:56:16.728000,FM,2,13,mp-23285,,CeBi,"{'functional': 'PBE', 'labels': ['Ce', 'Bi'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Bi': 1.0}",GGA,mp-23285,"['mp-991395', 'mp-993343', 'mp-23285', 'mp-1060171', 'mp-1060152', 'mp-1060228', 'mp-1442149', 'mp-1686806', 'mp-1798864', 'mp-994660', 'mp-1592704', 'mp-1593424', 'mp-1060245']",0.9316841,"{'Ce': 1.0, 'Bi': 1.0}",69.34833607706096,[],FM,True,225,1,"[0.9, 0.0]",0.0134348443337515,0.9316841,1,0.9316841,MP,data/source/MP/cleaned/cifs/MP-mp-23285.cif,False,,data/final/MP/graphs/Bi1Ce1-MP-mp-23285.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
C1Mo0.95Ti0.05,2,0.05,1.0,True,C1Mo0.95Ti0.05,C1Mo1,13.5,Other,True,C50Mo47.5Ti2.5,C-Mo-Ti,3,Supercon,Mo0.95Ti0.05C1,MP-mp-2305,Mo1C1,C-Mo,C50Mo50,P -6 m 2,hexagonal,2.835086,2.92410600478411,2.92410507,data/final/MP/cifs/C1Mo0.95Ti0.05-MP-mp-2305-synth_doped.cif,data/source/MP/raw/cifs/mp-2305.cif,mp-2305,0.0,,2011-05-12 17:49:42,8.538697979393088,10.17188/1199194,"@misc{osti_1199194,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MoC (SG:187) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199194"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668222'}},0.0010243049999996,8.62658168,520.0,-20.24014809,-10.120074045,{'tags': ['Molybdenum carbide (1/1)']},-20.24014809,-10.120074045,-0.0838621800000005,"['xas', 'elasticity', 'bandstructure']",True,"[77156, 618300]",True,2021-05-12 10:56:16.728000,NM,2,9,mp-2305,,MoC,"{'functional': 'PBE', 'labels': ['Mo_pv', 'C'], 'pot_type': 'paw'}","{'Mo': 1.0, 'C': 1.0}",GGA,mp-2305,"['mp-927633', 'mp-927239', 'mp-911174', 'mp-2305', 'mp-1116092', 'mp-1440368', 'mp-1668222', 'mp-1791400', 'mp-1638434']",0.0001977,"{'Mo': 1.0, 'C': 1.0}",20.99340614335182,[],NM,False,187,0,"[0, 0]",9.417242664197564e-06,0.0001977,0,0.0001977,MP,data/source/MP/cleaned/cifs/MP-mp-2305.cif,True,,data/final/MP/graphs/C1Mo0.95Ti0.05-MP-mp-2305-synth_doped.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Re24Zr5,1,0.0,1.0,True,Re24Zr5,Re24Zr5,3.875,Other,True,Re82.759Zr17.241,Re-Zr,2,Supercon,Re24Zr5,MP-mp-1374,Zr5Re24,Re-Zr,Re82.759Zr17.241,I -4 3 m,cubic,8.493821281882948,8.49382128,8.493821279999999,data/final/MP/cifs/Re24Zr5-MP-mp-1374.cif,data/source/MP/raw/cifs/mp-1374.cif,mp-1374,0.0,,2011-05-25 11:20:13,17.337067000886975,10.17188/1189736,"@misc{osti_1189736,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Zr5Re24 (SG:217) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189736"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1760030'}},0.0,6.86218921,520.0,-347.78422294,-11.992559411724136,"{'tags': ['Rhenium zirconium (24/5)', 'Rhenium zirconium (0.83/0.17)', 'Zirconium rhenium (5/24)']}",-347.78422294,-11.992559411724136,-0.2198988741379312,"['xas', 'bandstructure']",True,"[650205, 109271, 650213]",True,2021-05-12 10:56:53.126000,NM,29,9,mp-1374,,Zr5Re24,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Re_pv'], 'pot_type': 'paw'}","{'Zr': 5.0, 'Re': 24.0}",GGA,mp-1374,"['mp-913156', 'mp-929684', 'mp-930269', 'mp-1374', 'mp-1193933', 'mp-1444013', 'mp-1760030', 'mp-1819902', 'mp-1624071']",0.0068061,"{'Zr': 5.0, 'Re': 24.0}",471.7234483793858,[],NM,False,217,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.4428157055542768e-05,0.0068061,0,0.0068061,MP,data/source/MP/cleaned/cifs/MP-mp-1374.cif,False,,data/final/MP/graphs/Re24Zr5-MP-mp-1374.json,0,True,-43m,5,0,0,0,0,0,0,0,0,1,0,1.0,False
Dy2Rh3Si5,1,0.0,2.0,False,Dy4Rh6Si10,Dy4Rh6Si10,0.0,Other,True,Dy20Rh30Si50,Dy-Rh-Si,3,Supercon,Dy2Rh3Si5,MP-mp-1188825,Dy4Si10Rh6,Dy-Rh-Si,Dy20Rh30Si50,C 1 2/c 1,monoclinic,5.69306856,8.11737574,8.11737574,data/final/MP/cifs/Dy2Rh3Si5-MP-mp-1188825.cif,data/source/MP/raw/cifs/mp-1188825.cif,mp-1188825,0.0,,2019-01-11 19:44:05.150000,7.788700461184011,,,{'GGA': {'task_id': 'mp-1675920'}},0.0,7.4762305,520.0,-136.32857673,-6.8164288365,{'tags': ['Dysprosium rhodium silicide (2/3/5)']},-136.32857673,-6.8164288365,-0.9731220975,['bandstructure'],True,[600471],True,2021-05-12 10:58:33.577000,NM,20,5,mp-1188825,,Dy2Si5Rh3,"{'functional': 'PBE', 'labels': ['Dy_3', 'Si', 'Rh_pv'], 'pot_type': 'paw'}","{'Dy': 2.0, 'Si': 5.0, 'Rh': 3.0}",GGA,mp-1188825,"['mp-1188825', 'mp-1431863', 'mp-1675920', 'mp-1811216', 'mp-1607166']",0.00030205,"{'Dy': 4.0, 'Si': 10.0, 'Rh': 6.0}",330.0926416622199,[],NM,False,15,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.8300922945691367e-06,0.00030205,0,0.0006041,MP,data/source/MP/cleaned/cifs/MP-mp-1188825.cif,False,,data/final/MP/graphs/Dy2Rh3Si5-MP-mp-1188825.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
Ir3Th7,1,0.0,2.0,False,Ir6Th14,Ir6Th14,1.52,Other,True,Ir30Th70,Ir-Th,2,Supercon,Ir3Th7,MP-mp-571094,Th14Ir6,Ir-Th,Ir30Th70,P 63 m c,hexagonal,6.312111,10.088429994874314,10.08842942,data/final/MP/cifs/Ir3Th7-MP-mp-571094.cif,data/source/MP/raw/cifs/mp-571094.cif,mp-571094,0.0,,2014-02-27 03:03:49,13.138035921714694,10.17188/1276086,"@misc{osti_1276086,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Th7Ir3 (SG:186) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1276086"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1674621'}},0.0,7.71791838,520.0,-170.09070832,-8.504535416,{'tags': ['Thorium iridium (7/3)']},-170.09070832,-8.504535416,-0.6633055150000005,"['xas', 'bandstructure']",True,"[150670, 641096]",True,2021-05-12 10:57:24.969000,NM,20,9,mp-571094,,Th7Ir3,"{'functional': 'PBE', 'labels': ['Th', 'Ir'], 'pot_type': 'paw'}","{'Th': 7.0, 'Ir': 3.0}",GGA,mp-571094,"['mp-977918', 'mp-914531', 'mp-571094', 'mp-1190068', 'mp-1475715', 'mp-1674621', 'mp-1883843', 'mp-1005336', 'mp-1610448']",6.53e-05,"{'Th': 14.0, 'Ir': 6.0}",556.355513114397,[],NM,False,186,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.3474198946806565e-07,6.53e-05,0,0.0001306,MP,data/source/MP/cleaned/cifs/MP-mp-571094.cif,False,,data/final/MP/graphs/Ir3Th7-MP-mp-571094.json,0,True,6mm,0,5,0,0,0,0,0,1,0,0,0,1.0,False
Bi1In5,3,0.0666666666666667,0.8,True,Bi0.8In4,Bi1In4,4.1,Other,True,Bi16.667In83.333,Bi-In,2,Supercon,Bi1In5,MP-mp-1223990,In4Bi1,Bi-In,Bi20In80,C 1 2/m 1,monoclinic,3.25486886,3.25486886,14.89369783,data/final/MP/cifs/Bi1In5-MP-mp-1223990-synth_doped.cif,data/source/MP/raw/cifs/mp-1223990.cif,mp-1223990,0.0,,2019-01-13 00:18:19.201000,7.685874047774097,,,{'GGA': {'task_id': 'mp-1733441'}},0.0690024430000004,6.71300678,520.0,-14.55408646,-2.910817292,{'tags': []},-14.55408646,-2.910817292,0.0685365539999999,['bandstructure'],True,[],True,2021-05-12 10:58:45.495000,NM,5,5,mp-1223990,,In4Bi,"{'functional': 'PBE', 'labels': ['In_d', 'Bi'], 'pot_type': 'paw'}","{'In': 4.0, 'Bi': 1.0}",GGA,mp-1223990,"['mp-1223990', 'mp-1401175', 'mp-1733441', 'mp-1780941', 'mp-1627245']",0.001303,"{'In': 4.0, 'Bi': 1.0}",144.37645083067392,[],NM,False,12,0,"[0, 0, 0, 0, 0]",9.025017532313293e-06,0.001303,0,0.001303,MP,data/source/MP/cleaned/cifs/MP-mp-1223990.cif,True,,data/final/MP/graphs/Bi1In5-MP-mp-1223990-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
Hf1Ni2Sn1,1,0.0,1.0,True,Hf1Ni2Sn1,Hf1Ni2Sn1,0.0,Other,True,Hf25Ni50Sn25,Hf-Ni-Sn,3,Supercon,Ni2Hf1Sn1,MP-mp-4828,Hf1Ni2Sn1,Hf-Ni-Sn,Hf25Ni50Sn25,F m -3 m,cubic,4.43521698,4.43521698,4.43521698,data/final/MP/cifs/Hf1Ni2Sn1-MP-mp-4828.cif,data/source/MP/raw/cifs/mp-4828.cif,mp-4828,0.0,,2011-05-13 07:01:09,11.15924860982762,10.17188/1208430,"@misc{osti_1208430,
    author = ""Persson, Kristin"",
    title = ""Materials Data on HfNi2Sn (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208430"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678395'}},0.0473172654107125,8.71317457,520.0,-27.49058801,-6.8726470025,{'tags': ['Hafnium nickel tin (1/2/1)']},-27.49058801,-6.8726470025,-0.4908884862500002,"['xas', 'elasticity', 'bandstructure']",True,"[104251, 104250]",True,2021-05-12 10:56:20.740000,NM,4,8,mp-4828,,HfNi2Sn,"{'functional': 'PBE', 'labels': ['Hf_pv', 'Ni_pv', 'Sn_d'], 'pot_type': 'paw'}","{'Hf': 1.0, 'Ni': 2.0, 'Sn': 1.0}",GGA,mp-4828,"['mp-929347', 'mp-929003', 'mp-912551', 'mp-4828', 'mp-1437672', 'mp-1678395', 'mp-1793099', 'mp-1588582']",0.0012263,"{'Hf': 1.0, 'Ni': 2.0, 'Sn': 1.0}",61.692108668534736,[],NM,False,225,0,"[0, 0, 0, 0]",1.987774492502408e-05,0.0012263,0,0.0012263,MP,data/source/MP/cleaned/cifs/MP-mp-4828.cif,False,,data/final/MP/graphs/Hf1Ni2Sn1-MP-mp-4828.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ce1Ru4Sb12,1,0.0,1.0,True,Ce1Ru4Sb12,Ce1Ru4Sb12,0.0,Heavy_fermion,True,Ce5.882Ru23.529Sb70.588,Ce-Ru-Sb,3,Supercon,Ce1Ru4Sb12,MP-mp-1189811,Ce1Sb12Ru4,Ce-Ru-Sb,Ce5.882Ru23.529Sb70.588,I m -3,cubic,8.120976551800293,8.12097655,8.12097655,data/final/MP/cifs/Ce1Ru4Sb12-MP-mp-1189811.cif,data/source/MP/raw/cifs/mp-1189811.cif,mp-1189811,0.1053000000000006,,2019-01-11 20:28:36.875000,8.077414120756778,,,{'GGA': {'task_id': 'mp-1671572'}},0.0,7.73986205,520.0,-98.37253123,-5.786619484117647,"{'tags': ['Cerium ruthenium antimonide (1/4/12)', 'LaFe4P12', 'CeRu4Sb12']}",-98.37253123,-5.786619484117647,-0.4763452102941188,['bandstructure'],True,[621988],True,2021-05-12 10:58:33.577000,NM,17,5,mp-1189811,,Ce(Sb3Ru)4,"{'functional': 'PBE', 'labels': ['Ce', 'Sb', 'Ru_pv'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Sb': 12.0, 'Ru': 4.0}",GGA,mp-1189811,"['mp-1189811', 'mp-1426674', 'mp-1671572', 'mp-1821637', 'mp-1606340']",6.5e-05,"{'Ce': 1.0, 'Sb': 12.0, 'Ru': 4.0}",412.2900741381517,[],NM,False,204,0,"[-0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",1.576559904719403e-07,6.5e-05,0,6.5e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1189811.cif,False,,data/final/MP/graphs/Ce1Ru4Sb12-MP-mp-1189811.json,0,True,m-3,2,0,0,0,0,0,0,0,0,1,0,1.0,False
P1Ru2,1,0.0,4.0,False,P4Ru8,P4Ru8,0.0,Other,True,P33.333Ru66.667,P-Ru,2,Supercon,P1Ru2,MP-mp-21911,P4Ru8,P-Ru,P33.333Ru66.667,P n m a,orthorhombic,3.893935,5.905941,7.015288,data/final/MP/cifs/P1Ru2-MP-mp-21911.cif,data/source/MP/raw/cifs/mp-21911.cif,mp-21911,0.0,,2014-02-22 19:24:57,9.597402198560095,10.17188/1197248,"@misc{osti_1197248,
    author = ""Persson, Kristin"",
    title = ""Materials Data on PRu2 (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197248"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678613'}},0.0,9.41610337,520.0,-100.76359766,-8.396966471666667,{'tags': ['Ruthenium phosphide (2/1)']},-100.76359766,-8.396966471666667,-0.4096058661111108,"['xas', 'bandstructure']",True,"[648021, 43686]",True,2021-05-12 10:56:59.077000,NM,12,9,mp-21911,,PRu2,"{'functional': 'PBE', 'labels': ['P', 'Ru_pv'], 'pot_type': 'paw'}","{'P': 1.0, 'Ru': 2.0}",GGA,mp-21911,"['mp-921063', 'mp-942883', 'mp-942489', 'mp-21911', 'mp-1101784', 'mp-1442665', 'mp-1678613', 'mp-1784641', 'mp-1602117']",4.25e-06,"{'P': 4.0, 'Ru': 8.0}",161.33303606726847,[],NM,False,11,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0]",1.0537209498066957e-07,4.25e-06,0,1.7e-05,MP,data/source/MP/cleaned/cifs/MP-mp-21911.cif,False,,data/final/MP/graphs/P1Ru2-MP-mp-21911.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Al1.2Ca1Si0.8,3,0.1333333333333333,1.0,True,Al1.2Ca1Si0.8,Al1Ca1Si1,5.21,Other,True,Al40Ca33.333Si26.667,Al-Ca-Si,3,Supercon,Ca1Al1.2Si0.8,MP-mp-3173,Ca1Al1Si1,Al-Ca-Si,Al33.333Ca33.333Si33.333,P -6 m 2,hexagonal,4.204102004380959,4.20410189,4.381114,data/final/MP/cifs/Al1.2Ca1Si0.8-MP-mp-3173-synth_doped.cif,data/source/MP/raw/cifs/mp-3173.cif,mp-3173,0.0,,2011-05-12 18:07:21,2.3559907742364445,10.17188/1205871,"@misc{osti_1205871,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CaAlSi (SG:187) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1205871"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688380'}},0.0042011372222221,5.20030027,520.0,-12.33105355,-4.110351183333333,"{'tags': ['Calcium aluminium silicide (1/1/1) - 1H', 'Calcium aluminium silicide (1/1/1) - (SrPtSb)-type']}",-12.33105355,-4.110351183333333,-0.36118794,"['xas', 'elasticity', 'bandstructure']",True,"[162864, 155853]",True,2021-05-12 10:56:20.740000,NM,3,12,mp-3173,,CaAlSi,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Al', 'Si'], 'pot_type': 'paw'}","{'Ca': 1.0, 'Al': 1.0, 'Si': 1.0}",GGA,mp-3173,"['mp-3173', 'mp-1000446', 'mp-1006914', 'mp-1170858', 'mp-1252945', 'mp-1258722', 'mp-1259938', 'mp-1439603', 'mp-1688380', 'mp-1781727', 'mp-1011629', 'mp-1597142']",0.0033294,"{'Ca': 1.0, 'Al': 1.0, 'Si': 1.0}",67.05970809230726,[],NM,False,187,0,"[0, 0, 0]",4.964829246523266e-05,0.0033294,0,0.0033294,MP,data/source/MP/cleaned/cifs/MP-mp-3173.cif,True,,data/final/MP/graphs/Al1.2Ca1Si0.8-MP-mp-3173-synth_doped.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
In3Mo15Se19,1,0.0,2.0,False,In6Mo30Se38,In6Mo30Se38,3.32,Chevrel,True,In8.108Mo40.541Se51.351,In-Mo-Se,3,Supercon,In3Mo15Se19,MP-mp-1228853,In6Mo30Se38,In-Mo-Se,In8.108Mo40.541Se51.351,P 1 21/m 1,monoclinic,9.916273,9.98722598,19.687538,data/final/MP/cifs/In3Mo15Se19-MP-mp-1228853.cif,data/source/MP/raw/cifs/mp-1228853.cif,mp-1228853,0.0,,2019-01-13 04:31:01.826000,6.426205760231487,,,,0.0248989120270293,4.4349991,520.0,-511.30741352,-6.909559642162162,{'tags': []},-511.30741352,-6.909559642162162,-0.7367484336359797,[],False,[],True,2021-05-12 11:01:01.648000,NM,74,2,mp-1228853,,In3Mo15Se19,"{'functional': 'PBE', 'labels': ['In_d', 'Mo_pv', 'Se'], 'pot_type': 'paw'}","{'In': 3.0, 'Mo': 15.0, 'Se': 19.0}",GGA,mp-1228853,"['mp-1228853', 'mp-1334755']",0.01766935,"{'In': 6.0, 'Mo': 30.0, 'Se': 38.0}",1697.0724023222856,[],NM,False,11,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",2.082333078520532e-05,0.01766935,0,0.0353387,MP,data/source/MP/cleaned/cifs/MP-mp-1228853.cif,False,,data/final/MP/graphs/In3Mo15Se19-MP-mp-1228853.json,0,True,2/m,0,0,3,0,0,0,0,1,0,0,0,1.0,False
Ni24Zr76,2,0.02,0.0789528508771929,False,Ni1.895Zr6,Ni2Zr6,3.115,Other,True,Ni24Zr76,Ni-Zr,2,Supercon,Ni24Zr76,MP-mp-1188073,Zr6Ni2,Ni-Zr,Ni25Zr75,P 63/m m c,hexagonal,4.896295,6.064418005027057,6.06441883,data/final/MP/cifs/Ni24Zr76-MP-mp-1188073-synth_doped.cif,data/source/MP/raw/cifs/mp-1188073.cif,mp-1188073,0.0,,2019-01-11 15:34:08.753000,7.07812709883652,,,{'GGA': {'task_id': 'mp-1730307'}},0.2678923887499991,4.81016384,520.0,-62.64172784,-7.83021598,{'tags': []},-62.64172784,-7.83021598,0.0255936624999986,['bandstructure'],True,[],True,2021-05-12 10:58:31.620000,NM,8,5,mp-1188073,,Zr3Ni,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Ni_pv'], 'pot_type': 'paw'}","{'Zr': 3.0, 'Ni': 1.0}",GGA,mp-1188073,"['mp-1188073', 'mp-1399727', 'mp-1730307', 'mp-1929912', 'mp-1619498']",0.00082625,"{'Zr': 6.0, 'Ni': 2.0}",155.94682700084778,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.0596560582736426e-05,0.00082625,0,0.0016525,MP,data/source/MP/cleaned/cifs/MP-mp-1188073.cif,True,,data/final/MP/graphs/Ni24Zr76-MP-mp-1188073-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
As1Ca1F1Fe0.85Ni0.15,3,0.075,2.0,False,As2Ca2F2Fe1.7Ni0.3,As2Ca2F2Fe2,8.72,Ferrite,True,As25Ca25F25Fe21.25Ni3.75,As-Ca-F-Fe-Ni,5,Supercon,Ca1Fe0.85Ni0.15As1F1,MP-mp-1079859,Ca2Fe2As2F2,As-Ca-F-Fe,As25Ca25F25Fe25,P m m n,orthorhombic,3.933336,3.981276,9.018918,data/final/MP/cifs/As1Ca1F1Fe0.85Ni0.15-MP-mp-1079859-synth_doped.cif,data/source/MP/raw/cifs/mp-1079859.cif,mp-1079859,0.0,,2018-04-16 14:43:21,4.464120586611354,,,{'GGA+U': {'task_id': 'mp-1695365'}},0.2859614887499973,4.27317878,520.0,-41.71531675,-5.21441459375,"{'tags': ['Calcium iron arsenide fluoride', 'High pressure experimental phase']}",-41.71531675,-5.21441459375,-1.632363168125,['bandstructure'],True,[186505],True,2021-05-12 10:58:16.596000,FM,8,6,mp-1079859,,CaFeAsF,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Fe_pv', 'As', 'F'], 'pot_type': 'paw'}","{'Ca': 1.0, 'Fe': 1.0, 'As': 1.0, 'F': 1.0}",GGA+U,mp-1079859,"['mp-1079859', 'mp-1475687', 'mp-1695365', 'mp-1785040', 'mp-1938652', 'mp-1594699']",3.7150606,"{'Ca': 2.0, 'Fe': 2.0, 'As': 2.0, 'F': 2.0}",141.2335160836522,[],FM,True,59,1,"[0.0, 0.0, 3.6, 3.6, 0.0, 0.0, 0.0, 0.0]",0.0526087674231601,3.7150606,2,7.4301212,MP,data/source/MP/cleaned/cifs/MP-mp-1079859.cif,True,,data/final/MP/graphs/As1Ca1F1Fe0.85Ni0.15-MP-mp-1079859-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ca3Ge4Ir4,1,0.0,1.0,True,Ca3Ge4Ir4,Ca3Ge4Ir4,1.7,Other,True,Ca27.273Ge36.364Ir36.364,Ca-Ge-Ir,3,Supercon,Ca3Ir4Ge4,MP-mp-1095240,Ca3Ge4Ir4,Ca-Ge-Ir,Ca27.273Ge36.364Ir36.364,I -4 3 m,cubic,6.628868481469517,6.62886848,6.62886848,data/final/MP/cifs/Ca3Ge4Ir4-MP-mp-1095240.cif,data/source/MP/raw/cifs/mp-1095240.cif,mp-1095240,0.0,,2018-04-27 09:34:00,8.735954654672522,,,{'GGA': {'task_id': 'mp-1705086'}},0.0,4.95563581,520.0,-67.25917816,-6.114470741818182,"{'tags': ['Calcium iridium germanide (3/4/4)', 'Tricalcium tetrairidium tetragermanide']}",-67.25917816,-6.114470741818182,-0.6724132200000003,['bandstructure'],True,"[195500, 429727]",True,2021-05-12 10:58:18.470000,NM,11,6,mp-1095240,,Ca3(GeIr)4,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Ge_d', 'Ir'], 'pot_type': 'paw'}","{'Ca': 3.0, 'Ge': 4.0, 'Ir': 4.0}",GGA,mp-1095240,"['mp-1095240', 'mp-1095341', 'mp-1421208', 'mp-1705086', 'mp-1930019', 'mp-1598161']",0.0099573,"{'Ca': 3.0, 'Ge': 4.0, 'Ir': 4.0}",224.23134205896585,[],NM,False,217,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.440637026282232e-05,0.0099573,0,0.0099573,MP,data/source/MP/cleaned/cifs/MP-mp-1095240.cif,False,,data/final/MP/graphs/Ca3Ge4Ir4-MP-mp-1095240.json,0,True,-43m,5,0,0,0,0,0,0,0,0,1,0,1.0,False
In0.75Sn0.25,1,0.0,4.0,False,In3Sn1,In3Sn1,5.725,Other,True,In75Sn25,In-Sn,2,Supercon,In0.75Sn0.25,MP-mp-1184894,In3Sn1,In-Sn,In75Sn25,P m -3 m,cubic,4.799954,4.799954,4.799954,data/final/MP/cifs/In0.75Sn0.25-MP-mp-1184894.cif,data/source/MP/raw/cifs/mp-1184894.cif,mp-1184894,0.0,,2019-01-11 13:08:33.613000,6.954608184557911,,,{'GGA': {'task_id': 'mp-1731706'}},0.0332779312500002,7.18042608,520.0,-12.13151132,-3.03287783,{'tags': []},-12.13151132,-3.03287783,0.0332779312500002,['bandstructure'],True,[],True,2021-05-12 10:58:27.755000,NM,4,5,mp-1184894,,In3Sn,"{'functional': 'PBE', 'labels': ['In_d', 'Sn_d'], 'pot_type': 'paw'}","{'In': 3.0, 'Sn': 1.0}",GGA,mp-1184894,"['mp-1184894', 'mp-1405576', 'mp-1731706', 'mp-1785591', 'mp-1638095']",0.0021229,"{'In': 3.0, 'Sn': 1.0}",110.58882051047028,[],NM,False,221,0,"[0, 0, 0, 0]",1.919633458608964e-05,0.0021229,0,0.0021229,MP,data/source/MP/cleaned/cifs/MP-mp-1184894.cif,False,,data/final/MP/graphs/In0.75Sn0.25-MP-mp-1184894.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
B2Ho1Ru3,1,0.0,1.0,True,B2Ho1Ru3,B2Ho1Ru3,0.0,Other,True,B33.333Ho16.667Ru50,B-Ho-Ru,3,Supercon,Ho1Ru3B2,MP-mp-2985,Ho1B2Ru3,B-Ho-Ru,B33.333Ho16.667Ru50,P 6/m m m,hexagonal,3.035891,5.500655996163669,5.500656139999999,data/final/MP/cifs/B2Ho1Ru3-MP-mp-2985.cif,data/source/MP/raw/cifs/mp-2985.cif,mp-2985,0.0,,2011-05-13 06:56:32,10.223242759983878,10.17188/1204298,"@misc{osti_1204298,
    author = ""Persson, Kristin"",
    title = ""Materials Data on HoB2Ru3 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1204298"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695077'}},0.0,6.45335057,520.0,-48.63085466,-8.105142443333333,{'tags': ['Holmium ruthenium boride (1/3/2)']},-48.63085466,-8.105142443333333,-0.4777488805555545,"['xas', 'bandstructure']",True,"[614506, 44419]",True,2021-05-12 10:57:04.957000,NM,6,8,mp-2985,,HoB2Ru3,"{'functional': 'PBE', 'labels': ['Ho_3', 'B', 'Ru_pv'], 'pot_type': 'paw'}","{'Ho': 1.0, 'B': 2.0, 'Ru': 3.0}",GGA,mp-2985,"['mp-1000813', 'mp-1007267', 'mp-2985', 'mp-1441945', 'mp-1695077', 'mp-1801173', 'mp-1012007', 'mp-1594644']",0.0102681,"{'Ho': 1.0, 'B': 2.0, 'Ru': 3.0}",79.55102747750196,[],NM,False,191,0,"[0.0, 0.0, 0.0, -0.0, -0.0, -0.0]",0.0001290756427112,0.0102681,0,0.0102681,MP,data/source/MP/cleaned/cifs/MP-mp-2985.cif,False,,data/final/MP/graphs/B2Ho1Ru3-MP-mp-2985.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Br2Ca1.825Cu1Na0.175O2,3,0.05,1.0,True,Br2Ca1.825Cu1Na0.175O2,Br2Ca2Cu1O2,10.5,Cuprate,True,Br28.571Ca26.071Cu14.286Na2.5O28.571428571428573,Br-Ca-Cu-Na-O,5,Supercon,Ca1.825Na0.175Cu1Br2O2,MP-mp-545481,Ca2Cu1Br2O2,Br-Ca-Cu-O,Br28.571Ca28.571Cu14.286O28.571428571428573,I 4/m m m,tetragonal,3.8848960001664095,3.8848960001664095,9.26575389,data/final/MP/cifs/Br2Ca1.825Cu1Na0.175O2-MP-mp-545481-synth_doped.cif,data/source/MP/raw/cifs/mp-545481.cif,mp-545481,0.0,,2014-02-21 09:12:30,4.171489837215984,10.17188/1267001,"@misc{osti_1267001,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ca2Cu(BrO)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1267001"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687817'}},0.0,3.0811802,520.0,-34.65890385,-4.9512719785714285,{'tags': ['Dicalcium dibromodioxocuprate']},-34.65890385,-4.9512719785714285,-2.260101375,"['xas', 'elasticity', 'bandstructure']",True,[1028],True,2021-05-12 10:56:22.739000,NM,7,8,mp-545481,oxide,Ca2Cu(BrO)2,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Cu_pv', 'Br', 'O'], 'pot_type': 'paw'}","{'Ca': 2.0, 'Cu': 1.0, 'Br': 2.0, 'O': 2.0}",GGA,mp-545481,"['mp-1000746', 'mp-1007202', 'mp-545481', 'mp-1301034', 'mp-1687817', 'mp-1779505', 'mp-1011944', 'mp-1590430']",0.0093361,"{'Ca': 2.0, 'Cu': 1.0, 'Br': 2.0, 'O': 2.0}",133.55551405583833,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",6.990426464980444e-05,0.0093361,0,0.0093361,MP,data/source/MP/cleaned/cifs/MP-mp-545481.cif,True,,data/final/MP/graphs/Br2Ca1.825Cu1Na0.175O2-MP-mp-545481-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ga0.8Si0.2V3,3,0.0999999999999999,2.0,False,Ga1.6Si0.4V6,Ga2V6,11.24,Other,True,Ga20Si5V75,Ga-Si-V,3,Supercon,V3Ga0.8Si0.2,MP-mp-22568,V6Ga2,Ga-V,Ga25V75,P m -3 n,cubic,4.789645,4.789645,4.789645,data/final/MP/cifs/Ga0.8Si0.2V3-MP-mp-22568-synth_doped.cif,data/source/MP/raw/cifs/mp-22568.cif,mp-22568,0.0,,2014-02-22 11:36:40,6.726541666276222,10.17188/1198793,"@misc{osti_1198793,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Ga (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198793"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686867'}},0.0,5.67452231,520.0,-61.95244347,-7.74405543375,{'tags': ['Gallium vanadium (1/3)']},-61.95244347,-7.74405543375,-0.1741018756249994,"['xas', 'elasticity', 'bandstructure']",True,"[635643, 635628, 635619, 635634, 104021, 635646, 635604, 635610, 635617, 635624, 635626, 635605, 635631, 635625, 635636, 635603, 104020, 635616, 635607]",True,2021-05-12 10:56:16.728000,FM,8,9,mp-22568,,V3Ga,"{'functional': 'PBE', 'labels': ['V_pv', 'Ga_d'], 'pot_type': 'paw'}","{'V': 3.0, 'Ga': 1.0}",GGA,mp-22568,"['mp-941343', 'mp-941663', 'mp-934924', 'mp-22568', 'mp-1440749', 'mp-1686867', 'mp-1804076', 'mp-1593784', 'mp-1595713']",0.09063635,"{'V': 6.0, 'Ga': 2.0}",109.87780534443452,[],FM,True,131,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.0, -0.0, -0.0]",0.0016497662965852,0.09063635,2,0.1812727,MP,data/source/MP/cleaned/cifs/MP-mp-22568.cif,True,,data/final/MP/graphs/Ga0.8Si0.2V3-MP-mp-22568-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Mn0.21Si1V2.79,3,0.1049999999999999,2.0,False,Mn0.42Si2V5.58,Si2V6,15.5,Other,True,Mn5.25Si25V69.75,Mn-Si-V,3,Supercon,Mn0.21Si1V2.79,MP-mp-2567,V6Si2,Si-V,Si25V75,P m -3 n,cubic,4.702381,4.702381,4.702381,data/final/MP/cifs/Mn0.21Si1V2.79-MP-mp-2567-synth_doped.cif,data/source/MP/raw/cifs/mp-2567.cif,mp-2567,0.0,,2011-05-13 19:15:43,5.778142190030859,10.17188/1200874,"@misc{osti_1200874,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Si (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1200874"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668672'}},0.0,7.30599425,520.0,-69.05773321,-8.63221665125,{'tags': ['Vanadium silicide (3/1)']},-69.05773321,-8.63221665125,-0.4452085937499994,"['xas', 'elasticity', 'bandstructure']",True,"[652491, 87328, 652522, 652502, 652510, 652520, 600518, 186003, 652507, 652513, 652497, 601150, 652514, 652487, 22412, 652509, 652529, 652532, 652499, 652539, 652537, 652533, 652512, 652538, 652490, 652493, 652494, 652511, 652519, 87329, 652526, 652500]",True,2021-05-12 10:56:18.721000,FM,8,13,mp-2567,,V3Si,"{'functional': 'PBE', 'labels': ['V_pv', 'Si'], 'pot_type': 'paw'}","{'V': 3.0, 'Si': 1.0}",GGA,mp-2567,"['mp-920081', 'mp-906309', 'mp-919083', 'mp-2567', 'mp-1078474', 'mp-1078852', 'mp-1138781', 'mp-1145907', 'mp-1440678', 'mp-1668672', 'mp-1795955', 'mp-1593554', 'mp-1596575']",0.8382519,"{'V': 6.0, 'Si': 2.0}",103.98086881866836,[],FM,True,131,1,"[0.2, 0.3, 0.3, 0.2, 0.3, 0.3, 0.0, 0.0]",0.0161231947669493,0.8382519,6,1.6765038,MP,data/source/MP/cleaned/cifs/MP-mp-2567.cif,True,,data/final/MP/graphs/Mn0.21Si1V2.79-MP-mp-2567-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Bi2Ca0.1Cu2Pr0.9Sr2O8,2,0.0133333333333333,1.0,True,Bi2Ca0.1Cu2Pr0.9Sr2O8,Bi2Cu2Pr1Sr2O8,0.0,Cuprate,True,Bi13.333Ca0.667Cu13.333Pr6Sr13.333O53.333333333333336,Bi-Ca-Cu-Pr-Sr-O,6,Supercon,Bi2Sr2Ca0.1Pr0.9Cu2O8,MP-mp-1208752,Sr2Pr1Cu2Bi2O8,Bi-Cu-Pr-Sr-O,Bi13.333Cu13.333Pr6.667Sr13.333O53.333333333333336,I 4/m m m,tetragonal,3.834136000030565,3.834136000030565,15.612086169999998,data/final/MP/cifs/Bi2Ca0.1Cu2Pr0.9Sr2O8-MP-mp-1208752-synth_doped.cif,data/source/MP/raw/cifs/mp-1208752.cif,mp-1208752,0.0,,2019-01-12 11:36:34.547000,7.267491513783425,,,{'GGA': {'task_id': 'mp-1737201'}},0.1119466963333302,5.05599766,520.0,-89.97734715,-5.99848981,"{'tags': ['Ba2CaCu2Tl2O8', 'high-Tc cuprate family', 'Sr2Cu2PrBi2O8']}",-89.97734715,-5.99848981,-2.1167527398888883,[],False,[],True,2021-05-12 11:00:21.818000,NM,15,4,mp-1208752,oxide,Sr2PrCu2(BiO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Pr_3', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Pr': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",GGA,mp-1208752,"['mp-1208752', 'mp-1390177', 'mp-1737201', 'mp-1934574']",0.0020197,"{'Sr': 2.0, 'Pr': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",226.019943500512,[],NM,False,139,0,"[0.0, 0.0, 0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",8.935937106786441e-06,0.0020197,0,0.0020197,MP,data/source/MP/cleaned/cifs/MP-mp-1208752.cif,True,,data/final/MP/graphs/Bi2Ca0.1Cu2Pr0.9Sr2O8-MP-mp-1208752-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
La0.95Nd0.05Pt1Si1,2,0.0333333333333333,2.0,False,La1.9Nd0.1Pt2Si2,La2Pt2Si2,2.76,Other,True,La31.667Nd1.667Pt33.333Si33.333,La-Nd-Pt-Si,4,Supercon,La0.95Nd0.05Pt1Si1,MP-mp-1206485,La2Si2Pt2,La-Pt-Si,La33.333Pt33.333Si33.333,I 41 m d,tetragonal,4.277808001286174,4.277808001286175,7.94541446,data/final/MP/cifs/La0.95Nd0.05Pt1Si1-MP-mp-1206485-synth_doped.cif,data/source/MP/raw/cifs/mp-1206485.cif,mp-1206485,0.0,,2019-01-12 09:47:13.211000,8.943745313538361,,,{'GGA': {'task_id': 'mp-1734531'}},0.0,7.90579938,520.0,-39.77896993,-6.629828321666667,{'tags': ['LaPtSi']},-39.77896993,-6.629828321666667,-1.1287520433333331,['bandstructure'],True,[],True,2021-05-12 10:58:37.524000,NM,6,5,mp-1206485,,LaSiPt,"{'functional': 'PBE', 'labels': ['La', 'Si', 'Pt'], 'pot_type': 'paw'}","{'La': 1.0, 'Si': 1.0, 'Pt': 1.0}",GGA,mp-1206485,"['mp-1206485', 'mp-1387492', 'mp-1734531', 'mp-1788111', 'mp-1628393']",1.825e-05,"{'La': 2.0, 'Si': 2.0, 'Pt': 2.0}",134.4491846861766,[],NM,False,109,0,"[0, 0, 0, 0, 0, 0]",2.714780315343388e-07,1.825e-05,0,3.65e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1206485.cif,True,,data/final/MP/graphs/La0.95Nd0.05Pt1Si1-MP-mp-1206485-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,0,0,1,0,1.0,False
Ba0.054Cu1La1.946O4,2,0.0154285714285714,1.0,True,Ba0.054Cu1La1.946O4,Cu1La2O4,0.0,Cuprate,True,Ba0.771Cu14.286La27.8O57.142857142857146,Ba-Cu-La-O,4,Supercon,La1.946Ba0.054Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ba0.054Cu1La1.946O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ba0.054Cu1La1.946O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Cl1Li0.06N1Zr1,3,0.114630467571644,4.0,False,Cl4Li0.24N4Zr4,Cl4Li1N4Zr4,15.2,Other,True,Cl32.68Li1.961N32.68Zr32.68,Cl-Li-N-Zr,4,Supercon,Li0.06Zr1N1Cl1,MP-mp-1222362,Li1Zr4N4Cl4,Cl-Li-N-Zr,Cl30.769Li7.692N30.769Zr30.769,R -3 m,trigonal,3.681774253191133,3.681774253191133,19.4360702,data/final/MP/cifs/Cl1Li0.06N1Zr1-MP-mp-1222362-synth_doped.cif,data/source/MP/raw/cifs/mp-1222362.cif,mp-1222362,0.0,,2019-01-12 22:54:36.562000,4.170964502866723,,,,0.0903183780769225,5.20200093,520.0,-98.5732949,-7.582561146153846,{'tags': []},-98.5732949,-7.582561146153846,-1.971803321025641,[],False,[],True,2021-05-12 11:00:49.659000,NM,13,3,mp-1222362,,LiZr4(NCl)4,"{'functional': 'PBE', 'labels': ['Li_sv', 'Zr_sv', 'N', 'Cl'], 'pot_type': 'paw'}","{'Li': 1.0, 'Zr': 4.0, 'N': 4.0, 'Cl': 4.0}",GGA,mp-1222362,"['mp-1222362', 'mp-1411613', 'mp-1872376']",0.0031614,"{'Li': 1.0, 'Zr': 4.0, 'N': 4.0, 'Cl': 4.0}",226.7986027084237,[],NM,False,166,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.3939239317379532e-05,0.0031614,0,0.0031614,MP,data/source/MP/cleaned/cifs/MP-mp-1222362.cif,True,,data/final/MP/graphs/Cl1Li0.06N1Zr1-MP-mp-1222362-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
C0.984Nb1,2,0.0080645161290322,1.0,True,C0.984Nb1,C1Nb1,9.8,Other,True,C49.597Nb50.403,C-Nb,2,Supercon,C0.984Nb1,MP-mp-910,Nb1C1,C-Nb,C50Nb50,F m -3 m,cubic,3.18634336,3.1863433599999995,3.1863433599999995,data/final/MP/cifs/C0.984Nb1-MP-mp-910-synth_doped.cif,data/source/MP/raw/cifs/mp-910.cif,mp-910,0.0,,2011-05-12 17:28:40,7.616098778357742,10.17188/1282001,"@misc{osti_1282001,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbC (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1282001"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686610'}},0.0408750508333302,7.39992982,520.0,-20.24633413,-10.123167065,"{'tags': ['Niobium carbide (1/1)', 'Niobium carbide (1/1) - RS-type']}",-20.24633413,-10.123167065,-0.4591241950000011,"['xas', 'elasticity', 'bandstructure']",True,"[618465, 77214, 187077, 618456, 181792, 618453, 94449, 618472, 183163, 237582, 618457, 159872, 618480, 618475, 618482, 618469, 155164, 618466, 44355, 618450, 618458, 618449, 44496, 618463, 618462, 618460, 618481, 618471, 618476, 181052, 601142, 618448, 189089, 618478, 26955, 618473, 618484, 618483]",True,2021-05-12 10:56:35.166000,NM,2,25,mp-910,,NbC,"{'functional': 'PBE', 'labels': ['Nb_pv', 'C'], 'pot_type': 'paw'}","{'Nb': 1.0, 'C': 1.0}",GGA,mp-910,"['mp-1000444', 'mp-1001333', 'mp-910', 'mp-1057158', 'mp-1057178', 'mp-1057130', 'mp-1057651', 'mp-1057669', 'mp-1057682', 'mp-1057771', 'mp-1057779', 'mp-1057802', 'mp-1060960', 'mp-1060978', 'mp-1061015', 'mp-1440938', 'mp-1686610', 'mp-1805660', 'mp-1007673', 'mp-1593845', 'mp-1596940', 'mp-1061007', 'mp-1057677', 'mp-1057792', 'mp-1057174']",3.33e-05,"{'Nb': 1.0, 'C': 1.0}",22.87508541625878,[],NM,False,225,0,"[0, 0]",1.4557322691495426e-06,3.33e-05,0,3.33e-05,MP,data/source/MP/cleaned/cifs/MP-mp-910.cif,True,,data/final/MP/graphs/C0.984Nb1-MP-mp-910-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Pd4S1,1,0.0,2.0,False,Pd8S2,Pd8S2,0.0,Other,True,Pd80S20,Pd-S,2,Supercon,Pd4S1,MP-mp-7819,Pd8S2,Pd-S,Pd80S20,P -4 21 c,tetragonal,5.197063,5.197063,5.666153,data/final/MP/cifs/Pd4S1-MP-mp-7819.cif,data/source/MP/raw/cifs/mp-7819.cif,mp-7819,0.0,,2011-05-30 06:05:46,9.933411845754351,10.17188/1307591,"@misc{osti_1307591,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Pd4S (SG:114) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1307591"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700118'}},0.0,5.53812483,520.0,-51.48905343,-5.148905343,{'tags': ['Palladium sulfide (4/1)']},-51.48905343,-5.148905343,-0.2783099216249994,"['xas', 'elasticity', 'bandstructure']",True,"[648748, 648755, 23865]",True,2021-05-12 10:56:31.128000,NM,10,10,mp-7819,,Pd4S,"{'functional': 'PBE', 'labels': ['Pd', 'S'], 'pot_type': 'paw'}","{'Pd': 4.0, 'S': 1.0}",GGA,mp-7819,"['mp-929271', 'mp-930127', 'mp-913042', 'mp-7819', 'mp-1079490', 'mp-1101064', 'mp-1425982', 'mp-1700118', 'mp-1789606', 'mp-1595537']",0.0004298,"{'Pd': 8.0, 'S': 2.0}",153.03975448590575,[],NM,False,114,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.616841211537393e-06,0.0004298,0,0.0008596,MP,data/source/MP/cleaned/cifs/MP-mp-7819.cif,False,,data/final/MP/graphs/Pd4S1-MP-mp-7819.json,0,True,-42m,0,0,0,0,6,0,0,1,0,0,0,1.0,False
Mo0.72Pt0.28,3,0.06,8.0,False,Mo5.76Pt2.24,Mo6Pt2,5.6,Other,True,Mo72Pt28,Mo-Pt,2,Supercon,Mo0.72Pt0.28,MP-mp-1232,Mo6Pt2,Mo-Pt,Mo75Pt25,P m -3 n,cubic,5.021457,5.021457,5.021457,data/final/MP/cifs/Mo0.72Pt0.28-MP-mp-1232-synth_doped.cif,data/source/MP/raw/cifs/mp-1232.cif,mp-1232,0.0,,2011-05-14 07:33:46,12.666325713651156,10.17188/1188699,"@misc{osti_1188699,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Mo3Pt (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188699"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703333'}},0.0468418224999993,8.12451675,520.0,-78.11615432,-9.76451929,{'tags': ['Molybdenum platinum (3/1)']},-78.11615432,-9.76451929,-0.1125600900000005,"['xas', 'elasticity', 'bandstructure']",True,"[105071, 161106]",True,2021-05-12 10:56:12.755000,NM,8,8,mp-1232,,Mo3Pt,"{'functional': 'PBE', 'labels': ['Mo_pv', 'Pt'], 'pot_type': 'paw'}","{'Mo': 3.0, 'Pt': 1.0}",GGA,mp-1232,"['mp-906180', 'mp-919006', 'mp-920031', 'mp-1232', 'mp-1435577', 'mp-1703333', 'mp-1787044', 'mp-1597150']",0.00115405,"{'Mo': 6.0, 'Pt': 2.0}",126.61619092159891,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.822910627148136e-05,0.00115405,0,0.0023081,MP,data/source/MP/cleaned/cifs/MP-mp-1232.cif,True,,data/final/MP/graphs/Mo0.72Pt0.28-MP-mp-1232-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Sr4V3O9.51,3,0.0845548152634766,0.25,False,Sr1V0.75O2.3775,Sr1V1O3,0.0,Oxide,True,Sr24.228V18.171O57.6014536644458,Sr-V-O,3,Supercon,Sr4V3O9.51,MP-mp-18717,Sr1V1O3,Sr-V-O,Sr20V20O60,P m -3 m,cubic,3.900891,3.900891,3.900891,data/final/MP/cifs/Sr4V3O9.51-MP-mp-18717-synth_doped.cif,data/source/MP/raw/cifs/mp-18717.cif,mp-18717,0.0,,2014-02-15 00:19:39,5.21885807260035,10.17188/1193364,"@misc{osti_1193364,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SrVO3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1193364"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",,0.0391016768603389,4.67096136,520.0,-36.25355595,-7.25071119,{'tags': ['Strontium vanadate(IV)']},-36.25355595,-7.25071119,-2.8794546823333342,"['xas', 'elasticity']",False,"[108826, 96291, 88982]",True,2021-05-12 10:56:14.760000,FM,5,2,mp-18717,oxide,SrVO3,"{'functional': 'PBE', 'labels': ['Sr_sv', 'V_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 1.0, 'V': 1.0, 'O': 3.0}",GGA+U,mp-18717,"['mp-18717', 'mp-1794484']",0.999467,"{'Sr': 1.0, 'V': 1.0, 'O': 3.0}",59.35966561911505,[],FM,True,221,1,"[0.0, 1.1, 0.0, 0.0, 0.0]",0.0168374769226825,0.999467,1,0.999467,MP,data/source/MP/cleaned/cifs/MP-mp-18717.cif,True,,data/final/MP/graphs/Sr4V3O9.51-MP-mp-18717-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Cu1Nd0.13Sr0.87O1.95,3,0.0721518987341772,1.0,True,Cu1Nd0.13Sr0.87O1.95,Cu1Sr1O2,0.0,Cuprate,True,Cu25.316Nd3.291Sr22.025O49.36708860759494,Cu-Nd-Sr-O,4,Supercon,Sr0.87Nd0.13Cu1O1.95,MP-mp-37514,Sr1Cu1O2,Cu-Sr-O,Cu25Sr25O50,P 4/m m m,tetragonal,3.484968,3.947813,3.947813,data/final/MP/cifs/Cu1Nd0.13Sr0.87O1.95-MP-mp-37514-synth_doped.cif,data/source/MP/raw/cifs/mp-37514.cif,mp-37514,0.0,,2014-02-19 09:18:09,5.599885836861445,10.17188/1207376,"@misc{osti_1207376,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SrCuO2 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207376"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1731754'}},0.0140859162499999,3.30951965,520.0,-22.56552868,-5.64138217,{'tags': []},-22.56552868,-5.64138217,-2.0637266366666664,"['xas', 'elasticity', 'bandstructure']",True,[],True,2021-05-12 10:56:20.740000,NM,4,6,mp-37514,oxide,SrCuO2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Cu': 1.0, 'O': 2.0}",GGA,mp-37514,"['mp-37514', 'mp-1141686', 'mp-1443464', 'mp-1731754', 'mp-1794901', 'mp-1613121']",0.0002664,"{'Sr': 1.0, 'Cu': 1.0, 'O': 2.0}",54.31401905086751,[],NM,False,123,0,"[0, 0, 0, 0]",4.904811035075576e-06,0.0002664,0,0.0002664,MP,data/source/MP/cleaned/cifs/MP-mp-37514.cif,True,,data/final/MP/graphs/Cu1Nd0.13Sr0.87O1.95-MP-mp-37514-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Pd31Zr69,2,0.0466666666666666,0.0289927536231884,False,Pd0.899Zr2,Pd1Zr2,2.34,Other,True,Pd31Zr69,Pd-Zr,2,Supercon,Pd31Zr69,MP-mp-266,Zr2Pd1,Pd-Zr,Pd33.333Zr66.667,I 4/m m m,tetragonal,3.3580019980484703,3.3580019980484703,5.91909309,data/final/MP/cifs/Pd31Zr69-MP-mp-266-synth_doped.cif,data/source/MP/raw/cifs/mp-266.cif,mp-266,0.0,,2011-05-12 21:30:36,7.845685271874635,10.17188/1201202,"@misc{osti_1201202,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Zr2Pd (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201202"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688097'}},0.0,4.68790204,520.0,-23.73938079,-7.91312693,"{'tags': ['Palladium zirconium (1/2)', 'Palladium zironium hydride (1/2/2)']}",-23.73938079,-7.91312693,-0.4880325733333326,"['xas', 'elasticity', 'bandstructure']",True,"[601954, 649146, 105758, 186412, 649158, 109133]",True,2021-05-12 10:56:18.721000,NM,3,12,mp-266,,Zr2Pd,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Pd'], 'pot_type': 'paw'}","{'Zr': 2.0, 'Pd': 1.0}",GGA,mp-266,"['mp-914366', 'mp-977842', 'mp-266', 'mp-1062819', 'mp-1062894', 'mp-1062980', 'mp-1442272', 'mp-1688097', 'mp-1784401', 'mp-992491', 'mp-1591765', 'mp-1062949']",0.0017364,"{'Zr': 2.0, 'Pd': 1.0}",61.13890405598638,[],NM,False,139,0,"[0, 0, 0]",2.8400901632288605e-05,0.0017364,0,0.0017364,MP,data/source/MP/cleaned/cifs/MP-mp-266.cif,True,,data/final/MP/graphs/Pd31Zr69-MP-mp-266-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Nb6Sn5,1,0.0,2.0,False,Nb12Sn10,Nb12Sn10,2.435,Other,True,Nb54.545Sn45.455,Nb-Sn,2,Supercon,Nb6Sn5,MP-mp-1192223,Nb12Sn10,Nb-Sn,Nb54.545Sn45.455,I m m m,orthorhombic,5.695995996959782,9.307515995216258,10.09522502,data/final/MP/cifs/Nb6Sn5-MP-mp-1192223.cif,data/source/MP/raw/cifs/mp-1192223.cif,mp-1192223,0.0,,2019-01-11 22:18:34.614000,8.488742738132713,,,{'GGA': {'task_id': 'mp-1764528'}},0.0005242445454562,7.769515,520.0,-164.63747585,-7.483521629545454,"{'tags': ['Niobium stannide (6/5)', 'Ti6Sn5', 'Nb6Sn5 ht', 'AlB2 family']}",-164.63747585,-7.483521629545454,-0.1511862190909079,['bandstructure'],True,[645476],True,2021-05-12 10:58:35.561000,NM,22,5,mp-1192223,,Nb6Sn5,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Sn_d'], 'pot_type': 'paw'}","{'Nb': 6.0, 'Sn': 5.0}",GGA,mp-1192223,"['mp-1192223', 'mp-1381964', 'mp-1764528', 'mp-1819703', 'mp-1612623']",0.0002915,"{'Nb': 12.0, 'Sn': 10.0}",450.3048479848651,[],NM,False,71,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.29467848860378e-06,0.0002915,0,0.000583,MP,data/source/MP/cleaned/cifs/MP-mp-1192223.cif,False,,data/final/MP/graphs/Nb6Sn5-MP-mp-1192223.json,0,True,mmm,0,0,0,7,0,0,0,0,0,1,0,1.0,False
Al0.1B2Mg0.9,3,0.0666666666666666,1.0,True,Al0.1B2Mg0.9,B2Mg1,34.3,Other,True,Al3.333B66.667Mg30,Al-B-Mg,3,Supercon,Mg0.9Al0.1B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/Al0.1B2Mg0.9-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/Al0.1B2Mg0.9-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Nb3Pt0.95Rh0.05,2,0.025,2.0,False,Nb6Pt1.9Rh0.1,Nb6Pt2,8.9,Other,True,Nb75Pt23.75Rh1.25,Nb-Pt-Rh,3,Supercon,Nb3Rh0.05Pt0.95,MP-mp-2663,Nb6Pt2,Nb-Pt,Nb75Pt25,P m -3 n,cubic,5.206284,5.206284,5.206284,data/final/MP/cifs/Nb3Pt0.95Rh0.05-MP-mp-2663-synth_doped.cif,data/source/MP/raw/cifs/mp-2663.cif,mp-2663,0.0,,2011-05-14 02:42:41,11.150477426700435,10.17188/1201206,"@misc{osti_1201206,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Pt (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201206"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1667983'}},0.0,5.9039275,520.0,-75.80228808,-9.47528601,{'tags': ['Niobium platinum (3/1)']},-75.80228808,-9.47528601,-0.3815803024999997,"['xas', 'elasticity', 'bandstructure']",True,"[645231, 645226, 645216, 645227, 105203, 645228, 645218, 645236, 645224]",True,2021-05-12 10:56:18.721000,NM,8,8,mp-2663,,Nb3Pt,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Pt'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Pt': 1.0}",GGA,mp-2663,"['mp-929425', 'mp-912670', 'mp-929036', 'mp-2663', 'mp-1438686', 'mp-1667983', 'mp-1778280', 'mp-1593946']",0.0004491,"{'Nb': 6.0, 'Pt': 2.0}",141.11837435118034,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",6.364869239244375e-06,0.0004491,0,0.0008982,MP,data/source/MP/cleaned/cifs/MP-mp-2663.cif,True,,data/final/MP/graphs/Nb3Pt0.95Rh0.05-MP-mp-2663-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
As2Ba1Fe0.75Ru1.25,3,0.1,1.0,True,As2Ba1Fe0.75Ru1.25,As2Ba1Fe1Ru1,0.0,Other,True,As40Ba20Fe15Ru25,As-Ba-Fe-Ru,4,Supercon,Ba1Fe0.75Ru1.25As2,MP-mp-1227957,Ba1Fe1As2Ru1,As-Ba-Fe-Ru,As40Ba20Fe20Ru20,I -4 m 2,tetragonal,4.094864001738776,4.094864001738776,6.95494631,data/final/MP/cifs/As2Ba1Fe0.75Ru1.25-MP-mp-1227957-synth_doped.cif,data/source/MP/raw/cifs/mp-1227957.cif,mp-1227957,0.0,,2019-01-13 03:43:43.313000,6.954649854678861,,,{'GGA': {'task_id': 'mp-1760595'}},0.0416149764999991,4.99960359,520.0,-31.92363508,-6.384727016,{'tags': []},-31.92363508,-6.384727016,-0.5884058670000002,['bandstructure'],True,[],True,2021-05-12 10:58:49.477000,FM,5,5,mp-1227957,,BaFeAs2Ru,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Fe_pv', 'As', 'Ru_pv'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Fe': 1.0, 'As': 2.0, 'Ru': 1.0}",GGA,mp-1227957,"['mp-1227957', 'mp-1384589', 'mp-1760595', 'mp-1795888', 'mp-1627878']",0.1424858,"{'Ba': 1.0, 'Fe': 1.0, 'As': 2.0, 'Ru': 1.0}",106.03277503651196,[],FM,True,119,1,"[0.0, 0.2, 0.0, 0.0, -0.0]",0.0013437901625316,0.1424858,1,0.1424858,MP,data/source/MP/cleaned/cifs/MP-mp-1227957.cif,True,,data/final/MP/graphs/As2Ba1Fe0.75Ru1.25-MP-mp-1227957-synth_doped.json,0,True,-42m,0,0,0,0,6,0,0,0,0,1,0,1.0,False
N1Zr1,1,0.0,1.0,True,N1Zr1,N1Zr1,9.85,Other,True,N50Zr50,N-Zr,2,Supercon,N1Zr1,MP-mp-1352,Zr1N1,N-Zr,N50Zr50,F m -3 m,cubic,3.26515324,3.26515324,3.26515324,data/final/MP/cifs/N1Zr1-MP-mp-1352.cif,data/source/MP/raw/cifs/mp-1352.cif,mp-1352,0.0,,2011-05-12 18:00:29,7.098978292634157,10.17188/1189641,"@misc{osti_1189641,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrN (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189641"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688030'}},0.0,7.38623329,520.0,-20.24349199,-10.121745995,"{'tags': ['Zirconium(III) nitride', 'Zirconium nitride', 'Zirconium nitride (1/1) - RS-type', 'Zirconium nitride - B1, NP', 'Zirconium nitride (1/1)', 'Zirconium nitride - B1', 'Zirconium nitride (1/1) - rocksalt type', 'Zirconium nitride (1/1) - thin film']}",-20.24349199,-10.121745995,-1.8601482175000008,"['xas', 'elasticity', 'bandstructure']",True,"[41934, 644891, 644889, 189103, 167851, 44506, 183181, 644893, 180850, 644895, 644881, 644887, 180849, 180847, 644886, 644898, 644890, 644884, 644888, 644894, 181143, 183417, 658394, 644885, 180848, 186384, 187189, 169453, 26950, 644897, 644882, 644892, 644896, 192045, 658332, 76530, 185548]",True,2021-05-12 10:56:12.755000,NM,2,37,mp-1352,,ZrN,"{'functional': 'PBE', 'labels': ['Zr_sv', 'N'], 'pot_type': 'paw'}","{'Zr': 1.0, 'N': 1.0}",GGA,mp-1352,"['mp-1007211', 'mp-1000757', 'mp-1352', 'mp-1057220', 'mp-1057225', 'mp-1057243', 'mp-1057499', 'mp-1057470', 'mp-1057478', 'mp-1059440', 'mp-1059449', 'mp-1059470', 'mp-1059884', 'mp-1059923', 'mp-1059899', 'mp-1059911', 'mp-1059943', 'mp-1059870', 'mp-1060984', 'mp-1061045', 'mp-1060997', 'mp-1061257', 'mp-1061274', 'mp-1061302', 'mp-1440615', 'mp-1688030', 'mp-1794882', 'mp-1011953', 'mp-1593178', 'mp-1595221', 'mp-1059908', 'mp-1061030', 'mp-1059465', 'mp-1057239', 'mp-1057491', 'mp-1059936', 'mp-1061294']",0.0002243,"{'Zr': 1.0, 'N': 1.0}",24.614765837074486,[],NM,False,225,0,"[0, 0]",9.112416566732552e-06,0.0002243,0,0.0002243,MP,data/source/MP/cleaned/cifs/MP-mp-1352.cif,False,,data/final/MP/graphs/N1Zr1-MP-mp-1352.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ce0.98La0.02Pt3Si1,2,0.008,1.0,True,Ce0.98La0.02Pt3Si1,Ce1Pt3Si1,0.03,Heavy_fermion,True,Ce19.6La0.4Pt60Si20,Ce-La-Pt-Si,4,Supercon,Ce0.98La0.02Pt3Si1,MP-mp-1207119,Ce1Si1Pt3,Ce-Pt-Si,Ce20Pt60Si20,P 4 m m,tetragonal,4.067884,4.067884,5.552623,data/final/MP/cifs/Ce0.98La0.02Pt3Si1-MP-mp-1207119-synth_doped.cif,data/source/MP/raw/cifs/mp-1207119.cif,mp-1207119,0.0,,2019-01-12 10:17:34.047000,13.616649050512317,,,,0.0,7.99187805,520.0,-34.84666915,-6.969333829999999,"{'tags': ['CePt3Si', 'CePt3B']}",-34.84666915,-6.969333829999999,-1.0409085689999995,[],False,[],True,2021-05-12 11:00:19.396000,NM,5,2,mp-1207119,,CeSiPt3,"{'functional': 'PBE', 'labels': ['Ce', 'Si', 'Pt'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Si': 1.0, 'Pt': 3.0}",GGA,mp-1207119,"['mp-1207119', 'mp-1923489']",0.0099182,"{'Ce': 1.0, 'Si': 1.0, 'Pt': 3.0}",91.88302988314366,[],NM,False,99,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",0.0001079437629844,0.0099182,0,0.0099182,MP,data/source/MP/cleaned/cifs/MP-mp-1207119.cif,True,,data/final/MP/graphs/Ce0.98La0.02Pt3Si1-MP-mp-1207119-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
Os4Pr1Sb12,1,0.0,1.0,True,Os4Pr1Sb12,Os4Pr1Sb12,1.60125,Heavy_fermion,True,Os23.529Pr5.882Sb70.588,Os-Pr-Sb,3,Supercon,Pr1Os4Sb12,MP-mp-4251,Pr1Sb12Os4,Os-Pr-Sb,Os23.529Pr5.882Sb70.588,I m -3,cubic,8.16020751180899,8.16020751,8.16020751,data/final/MP/cifs/Os4Pr1Sb12-MP-mp-4251.cif,data/source/MP/raw/cifs/mp-4251.cif,mp-4251,0.0,,2011-05-15 09:44:04,9.380402650313032,10.17188/1208003,"@misc{osti_1208003,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Pr(Sb3Os)4 (SG:204) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208003"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700242'}},0.0086126564705901,7.28147826,520.0,-102.089288,-6.005252235294117,{'tags': ['Praseodymium osmium antimonide (1/4/12)']},-102.089288,-6.005252235294117,-0.1677005267647063,"['xas', 'elasticity', 'bandstructure']",True,"[155178, 155187, 165911, 155182, 155185, 155181, 647731, 155183, 155188, 155180, 155179, 165910, 155184, 155186, 183087]",True,2021-05-12 10:56:20.740000,NM,17,9,mp-4251,,Pr(Sb3Os)4,"{'functional': 'PBE', 'labels': ['Pr_3', 'Sb', 'Os_pv'], 'pot_type': 'paw'}","{'Pr': 1.0, 'Sb': 12.0, 'Os': 4.0}",GGA,mp-4251,"['mp-1000443', 'mp-1006919', 'mp-4251', 'mp-1188290', 'mp-1430112', 'mp-1700242', 'mp-1817791', 'mp-1011635', 'mp-1609307']",0.0526026,"{'Pr': 1.0, 'Sb': 12.0, 'Os': 4.0}",418.2940787754696,[],NM,False,204,0,"[-0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.000125755067234,0.0526026,0,0.0526026,MP,data/source/MP/cleaned/cifs/MP-mp-4251.cif,False,,data/final/MP/graphs/Os4Pr1Sb12-MP-mp-4251.json,0,True,m-3,2,0,0,0,0,0,0,0,0,1,0,1.0,False
Ce0.98Co1In5Yb0.02,2,0.0057142857142857,1.0,True,Ce0.98Co1In5Yb0.02,Ce1Co1In5,1.89,Heavy_fermion,True,Ce14Co14.286In71.429Yb0.286,Ce-Co-In-Yb,4,Supercon,Ce0.98Yb0.02Co1In5,MP-mp-19961,Ce1In5Co1,Ce-Co-In,Ce14.286Co14.286In71.429,P 4/m m m,tetragonal,4.635989,4.635989,7.564124,data/final/MP/cifs/Ce0.98Co1In5Yb0.02-MP-mp-19961-synth_doped.cif,data/source/MP/raw/cifs/mp-19961.cif,mp-19961,0.0,,2014-02-21 14:08:25,7.897022127398995,10.17188/1195145,"@misc{osti_1195145,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeIn5Co (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195145"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701944'}},0.0,7.80626318,520.0,-28.52795357,-4.075421938571429,{'tags': ['Cerium cobalt indium (1/1/5)']},-28.52795357,-4.075421938571429,-0.2468754242857146,"['xas', 'bandstructure']",True,[102108],True,2021-05-12 10:56:57.051000,FM,7,8,mp-19961,,CeIn5Co,"{'functional': 'PBE', 'labels': ['Ce', 'In_d', 'Co'], 'pot_type': 'paw'}","{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",GGA,mp-19961,"['mp-928775', 'mp-912209', 'mp-928270', 'mp-19961', 'mp-1504062', 'mp-1701944', 'mp-1785253', 'mp-1593180']",0.9310323,"{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",162.57113333428427,[],FM,True,123,1,"[0.7, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0057269226147644,0.9310323,1,0.9310323,MP,data/source/MP/cleaned/cifs/MP-mp-19961.cif,True,,data/final/MP/graphs/Ce0.98Co1In5Yb0.02-MP-mp-19961-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Cu0.9La2Li0.1O4,2,0.0285714285714285,1.0,True,Cu0.9La2Li0.1O4,Cu1La2O4,0.0,Cuprate,True,Cu12.857La28.571Li1.429O57.142857142857146,Cu-La-Li-O,4,Supercon,La2Cu0.9Li0.1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu0.9La2Li0.1O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu0.9La2Li0.1O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B2Ir3Th1,1,0.0,1.0,True,B2Ir3Th1,B2Ir3Th1,2.09,Other,True,B33.333Ir50Th16.667,B-Ir-Th,3,Supercon,Th1Ir3B2,MP-mp-10115,Th1B2Ir3,B-Ir-Th,B33.333Ir50Th16.667,P 6/m m m,hexagonal,3.247741,5.490424002615265,5.49042343,data/final/MP/cifs/B2Ir3Th1-MP-mp-10115.cif,data/source/MP/raw/cifs/mp-10115.cif,mp-10115,0.0,,2011-05-28 02:13:06,16.261709275875457,10.17188/1186099,"@misc{osti_1186099,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ThB2Ir3 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1186099"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696625'}},0.0,9.33695294,520.0,-51.49400498,-8.582334163333334,{'tags': ['Thorium iridium boride (1/3/2)']},-51.49400498,-8.582334163333334,-0.701011988055555,"['xas', 'elasticity', 'bandstructure']",True,[44425],True,2021-05-12 10:56:08.727000,NM,6,8,mp-10115,,ThB2Ir3,"{'functional': 'PBE', 'labels': ['Th', 'B', 'Ir'], 'pot_type': 'paw'}","{'Th': 1.0, 'B': 2.0, 'Ir': 3.0}",GGA,mp-10115,"['mp-10115', 'mp-1000815', 'mp-1007266', 'mp-1419032', 'mp-1696625', 'mp-1798568', 'mp-1012020', 'mp-1588913']",0.0063016,"{'Th': 1.0, 'B': 2.0, 'Ir': 3.0}",84.78591820636456,[],NM,False,191,0,"[0, 0, 0, 0, 0, 0]",7.432366285946483e-05,0.0063016,0,0.0063016,MP,data/source/MP/cleaned/cifs/MP-mp-10115.cif,False,,data/final/MP/graphs/B2Ir3Th1-MP-mp-10115.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Co20Zr80,1,0.0,0.1,False,Co2Zr8,Co2Zr8,0.0,Other,True,Co20Zr80,Co-Zr,2,Supercon,Co20Zr80,MP-mp-1207434,Zr8Co2,Co-Zr,Co20Zr80,F d -3 m,cubic,6.8777943200000005,6.87779432,6.87779432,data/final/MP/cifs/Co20Zr80-MP-mp-1207434.cif,data/source/MP/raw/cifs/mp-1207434.cif,mp-1207434,0.0,,2019-01-12 10:32:42.204000,6.118393554392188,,,,0.635151371000001,3.69866139,520.0,-77.93242585,-7.793242585,"{'tags': ['MgCu2', 'ZrCo2', 'Friauf-Laves phase, Frank-Kasper phase']}",-77.93242585,-7.793242585,0.4665814779999991,[],False,[],True,2021-05-12 11:00:19.396000,NM,10,2,mp-1207434,,Zr4Co,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Co'], 'pot_type': 'paw'}","{'Zr': 4.0, 'Co': 1.0}",GGA,mp-1207434,"['mp-1207434', 'mp-1878421']",0.0010203,"{'Zr': 8.0, 'Co': 2.0}",230.05546459426628,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",8.870034900491812e-06,0.0010203,0,0.0020406,MP,data/source/MP/cleaned/cifs/MP-mp-1207434.cif,False,,data/final/MP/graphs/Co20Zr80-MP-mp-1207434.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
B2C1Er0.75Ni2Tb0.25,3,0.0833333333333333,1.0,True,B2C1Er0.75Ni2Tb0.25,B2C1Er1Ni2,4.675000000000001,Other,True,B33.333C16.667Er12.5Ni33.333Tb4.167,B-C-Er-Ni-Tb,5,Supercon,Tb0.25Er0.75Ni2B2C1,MP-mp-6098,Er1Ni2B2C1,B-C-Er-Ni,B33.333C16.667Er16.667Ni33.333,I 4/m m m,tetragonal,3.5122880026935177,3.5122880026935173,5.77805085,data/final/MP/cifs/B2C1Er0.75Ni2Tb0.25-MP-mp-6098-synth_doped.cif,data/source/MP/raw/cifs/mp-6098.cif,mp-6098,0.0,,2011-05-13 04:24:02,8.212015229638553,10.17188/1277667,"@misc{osti_1277667,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ErNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277667"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700042'}},0.0,6.72687579,520.0,-41.84324782,-6.973874636666667,{'tags': []},-41.84324782,-6.973874636666667,-0.5216152347222227,"['xas', 'elasticity', 'bandstructure']",True,"[246431, 79576, 56651]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-6098,,ErNi2B2C,"{'functional': 'PBE', 'labels': ['Er_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Er': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6098,"['mp-1006980', 'mp-1000513', 'mp-6098', 'mp-1441533', 'mp-1700042', 'mp-1793903', 'mp-1011723', 'mp-1589040']",0.0020747,"{'Er': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",64.35860973581151,[],NM,False,139,0,"[0.0, -0.0, -0.0, 0.0, 0.0, 0.0]",3.2236557136900987e-05,0.0020747,0,0.0020747,MP,data/source/MP/cleaned/cifs/MP-mp-6098.cif,True,,data/final/MP/graphs/B2C1Er0.75Ni2Tb0.25-MP-mp-6098-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Au0.2B5Mo1.8,3,0.0571428571428571,1.0,True,Au0.2B5Mo1.8,B5Mo2,4.5,Other,True,Au2.857B71.429Mo25.714,Au-B-Mo,3,Supercon,Au0.2B5Mo1.8,MP-mp-7229,B5Mo2,B-Mo,B71.429Mo28.571,R -3 m,trigonal,3.086062143206312,3.086062143206312,7.38317517,data/final/MP/cifs/Au0.2B5Mo1.8-MP-mp-7229-synth_doped.cif,data/source/MP/raw/cifs/mp-7229.cif,mp-7229,0.0,,2011-05-27 17:15:57,6.910597742884047,10.17188/1287525,"@misc{osti_1287525,
    author = ""Persson, Kristin"",
    title = ""Materials Data on B5Mo2 (SG:166) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1287525"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678538'}},0.4354736101190504,10.26159619,520.0,-54.63026953,-7.804324218571429,"{'tags': ['Molybdenum boride (2/5)', 'Molybdenum boride (1/2.5) - epsilon']}",-54.63026953,-7.804324218571429,0.0654250548809522,['bandstructure'],True,"[157530, 614795, 614810, 24282]",True,2021-05-12 10:58:55.498000,NM,7,11,mp-7229,,B5Mo2,"{'functional': 'PBE', 'labels': ['B', 'Mo_pv'], 'pot_type': 'paw'}","{'B': 5.0, 'Mo': 2.0}",GGA,mp-7229,"['mp-1001204', 'mp-7229', 'mp-1007569', 'mp-1077992', 'mp-1078025', 'mp-1078031', 'mp-1441558', 'mp-1678538', 'mp-1793658', 'mp-1012321', 'mp-1593525']",0.0189101,"{'B': 5.0, 'Mo': 2.0}",59.09541989544843,[],NM,False,166,0,"[0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0]",0.0003199926497426,0.0189101,0,0.0189101,MP,data/source/MP/cleaned/cifs/MP-mp-7229.cif,True,,data/final/MP/graphs/Au0.2B5Mo1.8-MP-mp-7229-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
B2C1Ni2Pr0.2Y0.8,3,0.0666666666666666,1.0,True,B2C1Ni2Pr0.2Y0.8,B2C1Ni2Y1,8.68,Other,True,B33.333C16.667Ni33.333Pr3.333Y13.333,B-C-Ni-Pr-Y,5,Supercon,Y0.8Pr0.2Ni2B2C1,MP-mp-6576,Y1Ni2B2C1,B-C-Ni-Y,B33.333C16.667Ni33.333Y16.667,I 4/m m m,tetragonal,3.548790000501972,3.548790000501972,5.76144136,data/final/MP/cifs/B2C1Ni2Pr0.2Y0.8-MP-mp-6576-synth_doped.cif,data/source/MP/raw/cifs/mp-6576.cif,mp-6576,0.0,,2011-05-13 05:21:43,6.099730998852292,10.17188/1281366,"@misc{osti_1281366,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281366"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688230'}},0.0,6.81083016,520.0,-43.677878,-7.279646333333333,{'tags': []},-43.677878,-7.279646333333333,-0.5109282141666659,"['xas', 'bandstructure']",True,"[75816, 89142, 83231, 79574, 41549]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6576,,YNi2B2C,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6576,"['mp-6576', 'mp-1007054', 'mp-1000583', 'mp-1439516', 'mp-1688230', 'mp-1794280', 'mp-1011792', 'mp-1597064']",0.0006603,"{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.3152437079014,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",1.010943177297096e-05,0.0006603,0,0.0006603,MP,data/source/MP/cleaned/cifs/MP-mp-6576.cif,True,,data/final/MP/graphs/B2C1Ni2Pr0.2Y0.8-MP-mp-6576-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As1Ce1Fe1O0.7,3,0.1216216216216216,2.0,False,As2Ce2Fe2O1.4,As2Ce2Fe2O2,40.2,Ferrite,True,As27.027Ce27.027Fe27.027O18.918918918918916,As-Ce-Fe-O,4,Supercon,Ce1Fe1As1O0.7,MP-mp-605060,Ce2Fe2As2O2,As-Ce-Fe-O,As25Ce25Fe25O25,P 4 m m,tetragonal,3.992256,3.992256,9.041971,data/final/MP/cifs/As1Ce1Fe1O0.7-MP-mp-605060-synth_doped.cif,data/source/MP/raw/cifs/mp-605060.cif,mp-605060,0.0,,2014-02-14 20:12:08,6.611233843492404,10.17188/1277425,"@misc{osti_1277425,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeFeAsO (SG:99) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277425"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-1751604'}},0.2072581873958352,6.30288445,520.0,-55.74271596,-6.967839495,{'tags': []},-55.74271596,-6.967839495,-1.7010452412499992,['bandstructure'],True,[],True,2021-05-12 10:58:51.532000,FiM,8,10,mp-605060,oxide,CeFeAsO,"{'functional': 'PBE', 'labels': ['Ce', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-605060,"['mp-605060', 'mp-917114', 'mp-918266', 'mp-919274', 'mp-1443189', 'mp-1751604', 'mp-1770633', 'mp-1779614', 'mp-1873964', 'mp-1622328']",2.99945325,"{'Ce': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",144.11191005541338,[],FiM,True,99,3,"[-0.5, -0.5, 3.5, 3.5, 0.0, 0.0, 0.0, 0.0]",0.0416267225775671,2.99945325,4,5.9989065,MP,data/source/MP/cleaned/cifs/MP-mp-605060.cif,True,,data/final/MP/graphs/As1Ce1Fe1O0.7-MP-mp-605060-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
Os1P1Ti1,1,0.0,3.0,False,Os3P3Ti3,Os3P3Ti3,0.0,Other,True,Os33.333P33.333Ti33.333,Os-P-Ti,3,Supercon,Ti1Os1P1,MP-mp-1095128,Ti3P3Os3,Os-P-Ti,Os33.333P33.333Ti33.333,P -6 2 m,hexagonal,3.712587,6.262961998503051,6.26296183,data/final/MP/cifs/Os1P1Ti1-MP-mp-1095128.cif,data/source/MP/raw/cifs/mp-1095128.cif,mp-1095128,0.0,,2018-04-27 01:41:40,10.628452887729775,,,{'GGA': {'task_id': 'mp-1695031'}},0.0,9.13550558,520.0,-81.09051291,-9.01005699,"{'tags': ['ZrNiAl', 'TiOsP', 'Osmium titanium phosphide (1/1/1)']}",-81.09051291,-9.01005699,-0.8313367305555567,['bandstructure'],True,[647718],True,2021-05-12 10:58:18.470000,NM,9,5,mp-1095128,,TiPOs,"{'functional': 'PBE', 'labels': ['Ti_pv', 'P', 'Os_pv'], 'pot_type': 'paw'}","{'Ti': 1.0, 'P': 1.0, 'Os': 1.0}",GGA,mp-1095128,"['mp-1095128', 'mp-1475777', 'mp-1695031', 'mp-1803665', 'mp-1590757']",0.0031029666666666,"{'Ti': 3.0, 'P': 3.0, 'Os': 3.0}",126.11501881802114,[],NM,False,189,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",7.38127789001274e-05,0.0031029666666666,0,0.0093089,MP,data/source/MP/cleaned/cifs/MP-mp-1095128.cif,False,,data/final/MP/graphs/Os1P1Ti1-MP-mp-1095128.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Sn1V3,1,0.0,2.0,False,Sn2V6,Sn2V6,4.4625,Other,True,Sn25V75,Sn-V,2,Supercon,Sn1V3,MP-mp-21342,V6Sn2,Sn-V,Sn25V75,P m -3 n,cubic,4.964966,4.964966,4.964966,data/final/MP/cifs/Sn1V3-MP-mp-21342.cif,data/source/MP/raw/cifs/mp-21342.cif,mp-21342,0.0,,2014-02-22 08:04:37,7.368095966501239,10.17188/1196758,"@misc{osti_1196758,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Sn (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196758"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702465'}},0.0,7.68691019,520.0,-63.04343383,-7.88042922875,{'tags': ['Tin vanadium (1/3)']},-63.04343383,-7.88042922875,-0.0651067124999995,"['xas', 'elasticity', 'bandstructure']",True,"[106097, 652826, 652827, 652825, 652830, 652831, 652824]",True,2021-05-12 10:56:16.728000,FM,8,8,mp-21342,,V3Sn,"{'functional': 'PBE', 'labels': ['V_pv', 'Sn_d'], 'pot_type': 'paw'}","{'V': 3.0, 'Sn': 1.0}",GGA,mp-21342,"['mp-942096', 'mp-932834', 'mp-943109', 'mp-21342', 'mp-1441571', 'mp-1702465', 'mp-1803347', 'mp-1596265']",0.7034491,"{'V': 6.0, 'Sn': 2.0}",122.3908177172686,[],FM,True,223,1,"[0.2, 0.2, 0.2, 0.2, 0.2, 0.2, 0.0, 0.0]",0.0114951286889024,0.7034491,6,1.4068982,MP,data/source/MP/cleaned/cifs/MP-mp-21342.cif,False,,data/final/MP/graphs/Sn1V3-MP-mp-21342.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba1Bi0.15Pb0.85O3,3,0.06,2.0,False,Ba2Bi0.3Pb1.7O6,Ba2Pb2O6,8.7,Oxide,True,Ba20Bi3Pb17O60,Ba-Bi-Pb-O,4,Supercon,Ba1Pb0.85Bi0.15O3,MP-mp-20461,Ba2Pb2O6,Ba-Pb-O,Ba20Pb20O60,C 1 2/m 1,monoclinic,6.13110795,6.15036645,6.15036645,data/final/MP/cifs/Ba1Bi0.15Pb0.85O3-MP-mp-20461-synth_doped.cif,data/source/MP/raw/cifs/mp-20461.cif,mp-20461,0.2051999999999996,,2014-02-21 12:57:54,7.877180851020856,10.17188/1195591,"@misc{osti_1195591,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BaPbO3 (SG:12) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195591"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688120'}},0.0,2.99844765,520.0,-57.91699323,-5.7916993230000005,"{'tags': ['Barium plumbate', 'Barium lead(IV) oxide']}",-57.91699323,-5.7916993230000005,-2.108799140000001,"['diel', 'xas', 'bandstructure']",True,"[67299, 51656]",True,2021-05-12 10:56:45.290000,NM,10,10,mp-20461,oxide,BaPbO3,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Pb_d', 'O'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Pb': 1.0, 'O': 3.0}",GGA,mp-20461,"['mp-919763', 'mp-918765', 'mp-905786', 'mp-551164', 'mp-20461', 'mp-1141988', 'mp-1439228', 'mp-1688120', 'mp-1833847', 'mp-1588870']",5.695e-05,"{'Ba': 2.0, 'Pb': 2.0, 'O': 6.0}",165.49154870311418,[],NM,False,12,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.882526684449154e-07,5.695e-05,0,0.0001139,MP,data/source/MP/cleaned/cifs/MP-mp-20461.cif,True,,data/final/MP/graphs/Ba1Bi0.15Pb0.85O3-MP-mp-20461-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,0.5,False
Al2Ce1,1,0.0,2.0,False,Al4Ce2,Al4Ce2,0.0,Heavy_fermion,True,Al66.667Ce33.333,Al-Ce,2,Supercon,Al2Ce1,MP-mp-2088,Ce2Al4,Al-Ce,Al66.667Ce33.333,F d -3 m,cubic,5.6239752,5.6239752,5.6239752,data/final/MP/cifs/Al2Ce1-MP-mp-2088.cif,data/source/MP/raw/cifs/mp-2088.cif,mp-2088,0.0,,2011-05-12 22:20:34,5.12439524065453,10.17188/1196075,"@misc{osti_1196075,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeAl2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196075"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686735'}},0.0,7.92767096,520.0,-29.63345023,-4.938908371666667,"{'tags': ['High pressure experimental phase', 'Aluminium cerium (2/1)', 'Aluminium cerium (1/2)']}",-29.63345023,-4.938908371666667,-0.4641614333333332,"['xas', 'elasticity', 'bandstructure']",True,"[606381, 604451, 606357, 657257, 606389, 606363, 606376, 606364, 606366, 606367, 606370, 606382, 606350, 606362, 606360, 606353, 606387, 606373, 57555, 603174, 606361, 606396, 606356]",True,2021-05-12 10:56:14.760000,FM,6,10,mp-2088,,CeAl2,"{'functional': 'PBE', 'labels': ['Ce', 'Al'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Al': 2.0}",GGA,mp-2088,"['mp-927447', 'mp-927867', 'mp-911539', 'mp-2088', 'mp-1252128', 'mp-1440780', 'mp-1686735', 'mp-1802526', 'mp-1589866', 'mp-1594205']",0.813417,"{'Ce': 2.0, 'Al': 4.0}",125.781043251111,[],FM,True,227,1,"[0.6, 0.6, 0.0, 0.0, 0.0, 0.0]",0.0129338567875619,0.813417,2,1.626834,MP,data/source/MP/cleaned/cifs/MP-mp-2088.cif,False,,data/final/MP/graphs/Al2Ce1-MP-mp-2088.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ca1Cu5,1,0.0,1.0,True,Ca1Cu5,Ca1Cu5,0.0,Other,True,Ca16.667Cu83.333,Ca-Cu,2,Supercon,Ca1Cu5,MP-mp-1882,Ca1Cu5,Ca-Cu,Ca16.667Cu83.333,P 6/m m m,hexagonal,4.026157,5.105657999945033,5.10565754,data/final/MP/cifs/Ca1Cu5-MP-mp-1882.cif,data/source/MP/raw/cifs/mp-1882.cif,mp-1882,0.0,,2011-05-14 11:20:55,6.536938773842889,10.17188/1193525,"@misc{osti_1193525,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CaCu5 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1193525"",
    place = ""United States"",
    year = ""2016"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-993370'}},0.0,5.49308222,520.0,-23.23329411,-3.872215685,{'tags': ['Calcium copper (1/5)']},-23.23329411,-3.872215685,-0.1219434799999993,"['xas', 'elasticity', 'bandstructure']",True,"[619214, 184363, 58883, 619215, 58882, 260679]",True,2021-05-12 10:56:14.760000,NM,6,8,mp-1882,,CaCu5,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Cu_pv'], 'pot_type': 'paw'}","{'Ca': 1.0, 'Cu': 5.0}",GGA,mp-1882,"['mp-993370', 'mp-991403', 'mp-1882', 'mp-1076976', 'mp-1439791', 'mp-1797449', 'mp-994693', 'mp-1589122']",0.0008474,"{'Ca': 1.0, 'Cu': 5.0}",90.8918046960268,[],NM,False,191,0,"[0, 0, 0, 0, 0, 0]",9.323172785863308e-06,0.0008474,0,0.0008474,MP,data/source/MP/cleaned/cifs/MP-mp-1882.cif,False,,data/final/MP/graphs/Ca1Cu5-MP-mp-1882.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
La0.95Pb3Pr0.05,2,0.025,1.0,True,La0.95Pb3Pr0.05,La1Pb3,3.3,Other,True,La23.75Pb75Pr1.25,La-Pb-Pr,3,Supercon,La0.95Pr0.05Pb3,MP-mp-21432,La1Pb3,La-Pb,La25Pb75,P m -3 m,cubic,4.968277,4.968277,4.968277,data/final/MP/cifs/La0.95Pb3Pr0.05-MP-mp-21432-synth_doped.cif,data/source/MP/raw/cifs/mp-21432.cif,mp-21432,0.0,,2014-02-21 08:53:02,10.297552988886016,10.17188/1196890,"@misc{osti_1196890,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaPb3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196890"",
    place = ""United States"",
    year = ""2016"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687535'}},0.0,7.94036935,520.0,-17.86283558,-4.465708895,{'tags': ['Lanthanum lead (1/3)']},-17.86283558,-4.465708895,-0.447221816249999,"['xas', 'elasticity', 'bandstructure']",True,"[641644, 104691, 641647, 641640, 104692, 151360]",True,2021-05-12 10:56:16.728000,NM,4,8,mp-21432,,LaPb3,"{'functional': 'PBE', 'labels': ['La', 'Pb_d'], 'pot_type': 'paw'}","{'La': 1.0, 'Pb': 3.0}",GGA,mp-21432,"['mp-993074', 'mp-991107', 'mp-21432', 'mp-1439281', 'mp-1687535', 'mp-1784789', 'mp-994394', 'mp-1589043']",0.0017048,"{'La': 1.0, 'Pb': 3.0}",122.63583830653424,[],NM,False,221,0,"[0, 0, 0, 0]",1.3901319740961604e-05,0.0017048,0,0.0017048,MP,data/source/MP/cleaned/cifs/MP-mp-21432.cif,True,,data/final/MP/graphs/La0.95Pb3Pr0.05-MP-mp-21432-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
La1N1,1,0.0,2.0,False,La2N2,La2N2,1.175,Other,True,La50N50,La-N,2,Supercon,La1N1,MP-mp-567290,La2N2,La-N,La50N50,P 63 m c,hexagonal,4.132863999720982,4.13286468,5.960067,data/final/MP/cifs/La1N1-MP-mp-567290.cif,data/source/MP/raw/cifs/mp-567290.cif,mp-567290,1.1489000000000005,,2013-09-22 15:00:24,5.76019316242597,10.17188/1273789,"@misc{osti_1273789,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaN (SG:186) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1273789"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1712385'}},0.0,6.32236946,520.0,-31.82808387,-7.9570209675,{'tags': ['Lanthanum nitride']},-31.82808387,-7.9570209675,-1.5012699525000004,"['piezo', 'bandstructure', 'diel', 'phonons', 'elasticity']",True,[162195],True,2021-05-12 10:56:22.739000,NM,4,10,mp-567290,,LaN,"{'functional': 'PBE', 'labels': ['La', 'N'], 'pot_type': 'paw'}","{'La': 1.0, 'N': 1.0}",GGA,mp-567290,"['mp-655510', 'mp-663539', 'mp-658377', 'mp-567290', 'mp-1141817', 'mp-1119521', 'mp-1434771', 'mp-1712385', 'mp-1801348', 'mp-1617444']",6e-06,"{'La': 2.0, 'N': 2.0}",88.16254069390989,[],NM,False,186,0,"[0, 0, 0, 0]",1.3611222981495748e-07,6e-06,0,1.2e-05,MP,data/source/MP/cleaned/cifs/MP-mp-567290.cif,False,,data/final/MP/graphs/La1N1-MP-mp-567290.json,0,True,6mm,0,5,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Cu3Nd0.3Pr0.7O7,3,0.0307692307692307,2.0,False,Ba4Cu6Nd0.6Pr1.4O14,Ba4Cu6Nd1Pr1O14,0.0,Cuprate,True,Ba15.385Cu23.077Nd2.308Pr5.385O53.84615384615385,Ba-Cu-Nd-Pr-O,5,Supercon,Nd0.3Pr0.7Ba2Cu3O7,MP-mp-1228202,Ba4Pr1Nd1Cu6O14,Ba-Cu-Nd-Pr-O,Ba15.385Cu23.077Nd3.846Pr3.846O53.84615384615385,P m m m,orthorhombic,3.889567,3.959351,23.802181,data/final/MP/cifs/Ba2Cu3Nd0.3Pr0.7O7-MP-mp-1228202-synth_doped.cif,data/source/MP/raw/cifs/mp-1228202.cif,mp-1228202,0.0,,2019-01-13 03:56:34.978000,6.5220887552009446,,,,0.0255490605208263,3.22208434,520.0,-157.3612514,-6.0523558230769225,{'tags': []},-157.3612514,-6.0523558230769225,-2.149524293653845,[],False,[],True,2021-05-12 11:00:59.151000,NM,26,3,mp-1228202,oxide,Ba4PrNd(Cu3O7)2,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Pr_3', 'Nd_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 4.0, 'Pr': 1.0, 'Nd': 1.0, 'Cu': 6.0, 'O': 14.0}",GGA,mp-1228202,"['mp-1228202', 'mp-1375393', 'mp-1836040']",0.0068628,"{'Ba': 4.0, 'Pr': 1.0, 'Nd': 1.0, 'Cu': 6.0, 'O': 14.0}",366.557419337326,[],NM,False,47,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, 0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",1.8722305532395948e-05,0.0068628,0,0.0068628,MP,data/source/MP/cleaned/cifs/MP-mp-1228202.cif,True,,data/final/MP/graphs/Ba2Cu3Nd0.3Pr0.7O7-MP-mp-1228202-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Bi2Cu1La0.24Sr1.76O6,3,0.0436363636363636,2.0,False,Bi4Cu2La0.48Sr3.52O12,Bi4Cu2Sr4O12,24.0,Cuprate,True,Bi18.182Cu9.091La2.182Sr16O54.54545454545455,Bi-Cu-La-Sr-O,5,Supercon,Bi2Sr1.76La0.24Cu1O6,MP-mp-555827,Sr4Cu2Bi4O12,Bi-Cu-Sr-O,Bi18.182Cu9.091Sr18.182O54.54545454545455,C c c m,orthorhombic,5.133052,5.52519599964684,13.01880065,data/final/MP/cifs/Bi2Cu1La0.24Sr1.76O6-MP-mp-555827-synth_doped.cif,data/source/MP/raw/cifs/mp-555827.cif,mp-555827,0.0,,2014-02-22 10:13:35,6.928457216674172,10.17188/1269010,"@misc{osti_1269010,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr2Cu(BiO3)2 (SG:66) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1269010"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1707731'}},0.0585641377272736,4.75363105,520.0,-126.5422218,-5.7519191727272725,{'tags': ['Dibismuth distrontium copper hexaoxide']},-126.5422218,-5.7519191727272725,-2.0406438793939388,"['xas', 'bandstructure']",True,[67426],True,2021-05-12 10:57:17.297000,NM,22,8,mp-555827,oxide,Sr2Cu(BiO3)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Cu': 1.0, 'Bi': 2.0, 'O': 6.0}",GGA,mp-555827,"['mp-932594', 'mp-931549', 'mp-918058', 'mp-555827', 'mp-1418436', 'mp-1707731', 'mp-1837530', 'mp-1605675']",0.00627605,"{'Sr': 4.0, 'Cu': 2.0, 'Bi': 4.0, 'O': 12.0}",360.8189966762927,[],NM,False,66,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",3.478780251490214e-05,0.00627605,0,0.0125521,MP,data/source/MP/cleaned/cifs/MP-mp-555827.cif,True,,data/final/MP/graphs/Bi2Cu1La0.24Sr1.76O6-MP-mp-555827-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Mo1O2,1,0.0,8.0,False,Mo8O16,Mo8O16,0.0,Oxide,True,Mo33.333O66.66666666666667,Mo-O,2,Supercon,Mo1O2,MP-mvc-5806,Mo8O16,Mo-O,Mo33.333O66.66666666666667,P n m a,orthorhombic,3.284472,9.160096,11.105456,data/final/MP/cifs/Mo1O2-MP-mvc-5806.cif,data/source/MP/raw/cifs/mvc-5806.cif,mvc-5806,1.2865000000000002,,2017-11-29 10:25:08,5.086738038941426,10.17188/1321544,"@misc{osti_1321544,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MoO2 (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1321544"",
    place = ""United States"",
    year = ""2014"",
    month = ""9"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-1047091'}},0.0799046241666658,2.84730362,520.0,-175.92283764,-7.330118235,{'tags': []},-175.92283764,-7.330118235,-1.9415965550000007,"['xas', 'bandstructure']",True,[],True,2021-05-12 10:58:05.262000,FM,24,6,mvc-5806,oxide,MoO2,"{'functional': 'PBE', 'labels': ['Mo_pv', 'O'], 'pot_type': 'paw'}","{'Mo': 1.0, 'O': 2.0}",GGA+U,mvc-5806,"['mvc-5806', 'mp-1047075', 'mp-1047091', 'mp-1326244', 'mp-1812070', 'mp-1047096']",2.0000521375,"{'Mo': 8.0, 'O': 16.0}",334.1196246514559,[],FM,True,62,2,"[2.0, 2.0, 2.0, 2.0, 2.0, 2.0, 2.0, 2.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0478882888626825,2.0000521375,8,16.0004171,MP,data/source/MP/cleaned/cifs/MP-mvc-5806.cif,False,,data/final/MP/graphs/Mo1O2-MP-mvc-5806.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ir0.8Pt0.2Te2,3,0.1333333333333333,4.0,False,Ir3.2Pt0.8Te8,Ir4Te8,0.0,Other,True,Ir26.667Pt6.667Te66.667,Ir-Pt-Te,3,Supercon,Ir0.8Pt0.2Te2,MP-mp-569322,Te8Ir4,Ir-Te,Ir33.333Te66.667,P n m a,orthorhombic,4.049805,5.441863,13.587474,data/final/MP/cifs/Ir0.8Pt0.2Te2-MP-mp-569322-synth_doped.cif,data/source/MP/raw/cifs/mp-569322.cif,mp-569322,0.0,,2014-02-16 04:48:25,9.924328423353325,10.17188/1275037,"@misc{osti_1275037,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Te2Ir (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1275037"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1746248'}},0.0123894575000003,7.60847828,520.0,-63.94410921,-5.3286757675,{'tags': ['Iridium telluride (1/2)']},-63.94410921,-5.3286757675,-0.5683316741666667,"['xas', 'bandstructure']",True,[93894],True,2021-05-12 10:57:24.969000,NM,12,7,mp-569322,,Te2Ir,"{'functional': 'PBE', 'labels': ['Te', 'Ir'], 'pot_type': 'paw'}","{'Te': 2.0, 'Ir': 1.0}",GGA,mp-569322,"['mp-927873', 'mp-927408', 'mp-569322', 'mp-911451', 'mp-1392626', 'mp-1746248', 'mp-1810340']",0.000153075,"{'Te': 8.0, 'Ir': 4.0}",299.44732816890644,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.0447669503153013e-06,0.000153075,0,0.0006123,MP,data/source/MP/cleaned/cifs/MP-mp-569322.cif,True,,data/final/MP/graphs/Ir0.8Pt0.2Te2-MP-mp-569322-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
As1F0.044Fe1Pr1O0.956,2,0.022,2.0,False,As2F0.088Fe2Pr2O1.912,As2Fe2Pr2O2,0.0,Ferrite,True,As25F1.1Fe25Pr25O23.9,As-F-Fe-Pr-O,5,Supercon,Pr1Fe1As1F0.044O0.956,MP-mp-22491,Pr2Fe2As2O2,As-Fe-Pr-O,As25Fe25Pr25O25,P 4/n m m,tetragonal,4.094889,4.094889,9.258722,data/final/MP/cifs/As1F0.044Fe1Pr1O0.956-MP-mp-22491-synth_doped.cif,data/source/MP/raw/cifs/mp-22491.cif,mp-22491,0.0,,2014-02-25 19:17:30,6.153806906111091,,,{'GGA+U': {'task_id': 'mp-1695715'}},0.3808778432291664,4.12348168,520.0,-51.7633941,-6.4704242625,{'tags': ['Praseodymium iron arsenic oxide (1/1/1/1)']},-51.7633941,-6.4704242625,-1.491677511249999,"['xas', 'bandstructure']",True,"[162830, 162833, 246832, 90316, 422000, 236649, 236648, 602491]",True,2021-05-12 10:57:10.838000,FM,8,8,mp-22491,oxide,PrFeAsO,"{'functional': 'PBE', 'labels': ['Pr_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Pr': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-22491,"['mp-510622', 'mp-1079608', 'mp-1079857', 'mp-22491', 'mp-1476145', 'mp-1695715', 'mp-1778524', 'mp-1596397']",3.7947681,"{'Pr': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",155.25132378854377,[],FM,True,129,1,"[0.0, 0.0, 3.5, 3.5, 0.0, 0.0, 0.0, 0.0]",0.0488854846116297,3.7947681,2,7.5895362,MP,data/source/MP/cleaned/cifs/MP-mp-22491.cif,True,,data/final/MP/graphs/As1F0.044Fe1Pr1O0.956-MP-mp-22491-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B1.826C0.174Mg1,3,0.1159999999999999,1.0,True,B1.826C0.174Mg1,B2Mg1,30.8,Other,True,B60.867C5.8Mg33.333,B-C-Mg,3,Supercon,Mg1B1.826C0.174,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B1.826C0.174Mg1-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B1.826C0.174Mg1-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
As1F0.1La1Ni1O0.9,2,0.0499999999999999,2.0,False,As2F0.2La2Ni2O1.8,As2La2Ni2O2,3.9,Ferrite,True,As25F2.5La25Ni25O22.5,As-F-La-Ni-O,5,Supercon,La1Ni1As1F0.1O0.9,MP-mp-1079362,La2Ni2As2O2,As-La-Ni-O,As25La25Ni25O25,P 4/n m m,tetragonal,4.17505,4.17505,8.043113,data/final/MP/cifs/As1F0.1La1Ni1O0.9-MP-mp-1079362-synth_doped.cif,data/source/MP/raw/cifs/mp-1079362.cif,mp-1079362,0.0,,2018-04-14 20:51:09,6.834508513823669,,,{'GGA+U': {'task_id': 'mp-1670926'}},0.4514602021279756,7.44178584,520.0,-46.79067614,-5.8488345175,{'tags': []},-46.79067614,-5.8488345175,-1.5750287187500005,['bandstructure'],True,"[163836, 246061]",True,2021-05-12 10:58:16.596000,NM,8,6,mp-1079362,oxide,LaNiAsO,"{'functional': 'PBE', 'labels': ['La', 'Ni_pv', 'As', 'O'], 'pot_type': 'paw'}","{'La': 1.0, 'Ni': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-1079362,"['mp-1079362', 'mp-1080674', 'mp-1301057', 'mp-1670926', 'mp-1925373', 'mp-1593774']",0.00017445,"{'La': 2.0, 'Ni': 2.0, 'As': 2.0, 'O': 2.0}",140.19984455541027,[],NM,False,129,0,"[0, 0, 0, 0, 0, 0, 0, 0]",2.488590490998059e-06,0.00017445,0,0.0003489,MP,data/source/MP/cleaned/cifs/MP-mp-1079362.cif,True,,data/final/MP/graphs/As1F0.1La1Ni1O0.9-MP-mp-1079362-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ba2Ca0.2Cu4Y0.8O8,3,0.0266666666666666,1.0,True,Ba2Ca0.2Cu4Y0.8O8,Ba2Cu4Y1O8,87.8,Cuprate,True,Ba13.333Ca1.333Cu26.667Y5.333O53.333333333333336,Ba-Ca-Cu-Y-O,5,Supercon,Y0.8Ca0.2Ba2Cu4O8,MP-mp-6790,Ba2Y1Cu4O8,Ba-Cu-Y-O,Ba13.333Cu26.667Y6.667O53.333333333333336,C m m m,orthorhombic,3.889922,3.899603999537882,13.88942687,data/final/MP/cifs/Ba2Ca0.2Cu4Y0.8O8-MP-mp-6790-synth_doped.cif,data/source/MP/raw/cifs/mp-6790.cif,mp-6790,0.0,,2011-05-16 03:21:24,5.936250568336678,10.17188/1283441,"@misc{osti_1283441,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Y(CuO2)4 (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1283441"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686864'}},0.0,3.31391536,520.0,-91.58381472,-6.105587648,"{'tags': ['Yttrium barium copper oxide (1/2/4/8)', 'High pressure experimental phase']}",-91.58381472,-6.105587648,-2.0529924817777783,"['xas', 'bandstructure']",True,"[72261, 85273, 74251, 400273, 85277, 85275, 400280, 67632, 85272, 67631, 83920, 66613, 85279, 400277, 75689, 74259, 85278, 85280, 66603, 94265, 400276, 88873, 71417, 75712, 97052, 66605, 72258, 85281, 85274, 400279, 66604, 69698]",True,2021-05-12 10:57:34.594000,NM,15,10,mp-6790,oxide,Ba2Y(CuO2)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-6790,"['mp-1000664', 'mp-6790', 'mp-1007136', 'mp-1237713', 'mp-1440937', 'mp-1686864', 'mp-1834179', 'mp-1011883', 'mp-1590064', 'mp-1590433']",0.0004643,"{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",208.60454115924333,[],NM,False,65,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.225742533790601e-06,0.0004643,0,0.0004643,MP,data/source/MP/cleaned/cifs/MP-mp-6790.cif,True,,data/final/MP/graphs/Ba2Ca0.2Cu4Y0.8O8-MP-mp-6790-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
In0.7Sn0.3,3,0.1,4.0,False,In2.8Sn1.2,In3Sn1,7.3,Other,True,In70Sn30,In-Sn,2,Supercon,In0.7Sn0.3,MP-mp-1184894,In3Sn1,In-Sn,In75Sn25,P m -3 m,cubic,4.799954,4.799954,4.799954,data/final/MP/cifs/In0.7Sn0.3-MP-mp-1184894-synth_doped.cif,data/source/MP/raw/cifs/mp-1184894.cif,mp-1184894,0.0,,2019-01-11 13:08:33.613000,6.954608184557911,,,{'GGA': {'task_id': 'mp-1731706'}},0.0332779312500002,7.18042608,520.0,-12.13151132,-3.03287783,{'tags': []},-12.13151132,-3.03287783,0.0332779312500002,['bandstructure'],True,[],True,2021-05-12 10:58:27.755000,NM,4,5,mp-1184894,,In3Sn,"{'functional': 'PBE', 'labels': ['In_d', 'Sn_d'], 'pot_type': 'paw'}","{'In': 3.0, 'Sn': 1.0}",GGA,mp-1184894,"['mp-1184894', 'mp-1405576', 'mp-1731706', 'mp-1785591', 'mp-1638095']",0.0021229,"{'In': 3.0, 'Sn': 1.0}",110.58882051047028,[],NM,False,221,0,"[0, 0, 0, 0]",1.919633458608964e-05,0.0021229,0,0.0021229,MP,data/source/MP/cleaned/cifs/MP-mp-1184894.cif,True,,data/final/MP/graphs/In0.7Sn0.3-MP-mp-1184894-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
C8.1K1,2,0.0024420024420024,1.9751543209876543,False,C16K1.975,C16K2,0.152,Carbon,True,C89.011K10.989,C-K,2,Supercon,C8.1K1,MP-mp-28930,K2C16,C-K,C88.889K11.111,F d d d,orthorhombic,4.976155999702512,4.981636772091846,11.00547636443826,data/final/MP/cifs/C8.1K1-MP-mp-28930-synth_doped.cif,data/source/MP/raw/cifs/mp-28930.cif,mp-28930,0.0,,2014-02-26 00:24:54,1.949986489747616,10.17188/1203000,"@misc{osti_1203000,
    author = ""Persson, Kristin"",
    title = ""Materials Data on KC8 (SG:70) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1203000"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1708126'}},0.0,4.44843804,520.0,-150.50538646,-8.36141035888889,{'tags': ['Potassium carbon (1/8)']},-150.50538646,-8.36141035888889,-0.0364498536666673,"['xas', 'bandstructure']",True,[70020],True,2021-05-12 10:57:03.017000,NM,18,9,mp-28930,,KC8,"{'functional': 'PBE', 'labels': ['K_sv', 'C'], 'pot_type': 'paw'}","{'K': 1.0, 'C': 8.0}",GGA,mp-28930,"['mp-916481', 'mp-931769', 'mp-937202', 'mp-505211', 'mp-28930', 'mp-1426078', 'mp-1708126', 'mp-1775532', 'mp-1608630']",0.00080825,"{'K': 2.0, 'C': 16.0}",230.2355922008482,[],NM,False,70,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",7.021069090785194e-06,0.00080825,0,0.0016165,MP,data/source/MP/cleaned/cifs/MP-mp-28930.cif,True,,data/final/MP/graphs/C8.1K1-MP-mp-28930-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,0,0,1,1.0,False
Cu0.2S2Zn0.8,3,0.1333333333333333,4.0,False,Cu0.8S8Zn3.2,S8Zn4,0.0,Other,True,Cu6.667S66.667Zn26.667,Cu-S-Zn,3,Supercon,Cu0.2S2Zn0.8,MP-mp-1102743,Zn4S8,S-Zn,S66.667Zn33.333,P a -3,cubic,6.000396,6.000396,6.000396,data/final/MP/cifs/Cu0.2S2Zn0.8-MP-mp-1102743-synth_doped.cif,data/source/MP/raw/cifs/mp-1102743.cif,mp-1102743,2.0035,,2018-07-18 15:14:57,3.982629353051161,,,{'GGA': {'task_id': 'mp-1702417'}},0.0060514775297604,4.23021824,700.0,-42.53900696,-3.544917246666667,"{'tags': ['FeS2', 'pyrite-marcasite family', 'ZnS2', 'Zinc persulfide']}",-42.53900696,-3.544917246666667,-0.7027027987500004,"['diel', 'bandstructure']",True,[651447],True,2021-05-12 10:56:43.348000,NM,12,7,mp-1102743,,ZnS2,"{'functional': 'PBE', 'labels': ['Zn', 'S'], 'pot_type': 'paw'}","{'Zn': 1.0, 'S': 2.0}",GGA,mp-1102743,"['mp-1102743', 'mp-1418688', 'mp-1541110', 'mp-1540547', 'mp-1702417', 'mp-1832351', 'mp-1602244']",0.0,"{'Zn': 4.0, 'S': 8.0}",216.04277082275013,[],NM,False,205,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0,0.0,0,0.0,MP,data/source/MP/cleaned/cifs/MP-mp-1102743.cif,True,,data/final/MP/graphs/Cu0.2S2Zn0.8-MP-mp-1102743-synth_doped.json,0,True,m-3,2,0,0,0,0,0,0,1,0,0,0,1.0,False
Bi2Ca1Cu2Sr2O8.329,2,0.0200317481027247,1.9209997838876216,False,Bi3.842Ca1.921Cu3.842Sr3.842O16,Bi4Ca2Cu4Sr4O16,47.3,Cuprate,True,Bi13.047Ca6.524Cu13.047Sr13.047O54.33492073846957,Bi-Ca-Cu-Sr-O,5,Supercon,Bi2Sr2Ca1Cu2O8.329,MP-mp-1218930,Sr4Ca2Cu4Bi4O16,Bi-Ca-Cu-Sr-O,Bi13.333Ca6.667Cu13.333Sr13.333O53.333333333333336,C c c 2,orthorhombic,5.417115,5.472898000129128,16.11398919,data/final/MP/cifs/Bi2Ca1Cu2Sr2O8.329-MP-mp-1218930-synth_doped.cif,data/source/MP/raw/cifs/mp-1218930.cif,mp-1218930,0.0,,2019-01-12 20:01:06.544000,6.266668983881059,,,,0.039252223722225,4.51768334,520.0,-173.15021002,-5.771673667333333,{'tags': []},-173.15021002,-5.771673667333333,-2.074956548222222,[],False,[],True,2021-05-12 11:00:42.526000,NM,30,3,mp-1218930,oxide,Sr2CaCu2(BiO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",GGA,mp-1218930,"['mp-1218930', 'mp-1359698', 'mp-1817714']",0.00011165,"{'Sr': 4.0, 'Ca': 2.0, 'Cu': 4.0, 'Bi': 4.0, 'O': 16.0}",470.7976286073367,[],NM,False,37,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.743014544498498e-07,0.00011165,0,0.0002233,MP,data/source/MP/cleaned/cifs/MP-mp-1218930.cif,True,,data/final/MP/graphs/Bi2Ca1Cu2Sr2O8.329-MP-mp-1218930-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Ru0.999Sr2Ti0.001O4,2,0.0002857142857142,1.0,True,Ru0.999Sr2Ti0.001O4,Ru1Sr2O4,0.53,Oxide,True,Ru14.271Sr28.571Ti0.014O57.142857142857146,Ru-Sr-Ti-O,4,Supercon,Sr2Ru0.99875Ti0.00125O4,MP-mp-4596,Sr2Ru1O4,Ru-Sr-O,Ru14.286Sr28.571O57.142857142857146,I 4/m m m,tetragonal,3.90349200031108,3.90349200031108,7.01667232,data/final/MP/cifs/Ru0.999Sr2Ti0.001O4-MP-mp-4596-synth_doped.cif,data/source/MP/raw/cifs/mp-4596.cif,mp-4596,0.0,,2011-05-13 08:08:22,5.748954439320184,10.17188/1208277,"@misc{osti_1208277,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr2RuO4 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208277"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668168'}},0.0,4.0615071,520.0,-47.01379905,-6.716257007142858,"{'tags': ['Distrontium ruthenium(IV) oxide', 'Distrontium ruthenate(IV)']}",-47.01379905,-6.716257007142858,-2.473796924047619,"['xas', 'bandstructure']",True,"[84484, 94191, 41609, 41610, 78630, 78285, 94194, 78631, 94193, 41607, 33802, 78629, 94184, 75151, 82898, 41604, 94200, 78286, 157401, 94189, 83110, 75152, 94188, 94197, 94199, 94185, 188554, 83109, 94198, 90737, 94192, 94195, 83111, 41606, 94186, 41608, 41605, 73395, 94187, 94196, 73394, 94190]",True,2021-05-12 10:57:08.928000,FM,7,10,mp-4596,oxide,Sr2RuO4,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ru_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ru': 1.0, 'O': 4.0}",GGA,mp-4596,"['mp-921970', 'mp-922219', 'mp-907609', 'mp-4596', 'mp-1078075', 'mp-1440912', 'mp-1668168', 'mp-1797475', 'mp-1594347', 'mp-1595037']",1.6420578,"{'Sr': 2.0, 'Ru': 1.0, 'O': 4.0}",98.29510225301225,[],FM,True,139,1,"[0.0, 0.0, 1.1, 0.0, 0.0, 0.0, 0.0]",0.0167053877798848,1.6420578,1,1.6420578,MP,data/source/MP/cleaned/cifs/MP-mp-4596.cif,True,,data/final/MP/graphs/Ru0.999Sr2Ti0.001O4-MP-mp-4596-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As0.05Nb3Sn0.95,2,0.025,2.0,False,As0.1Nb6Sn1.9,Nb6Sn2,18.19,Other,True,As1.25Nb75Sn23.75,As-Nb-Sn,3,Supercon,Nb3As0.05Sn0.95,MP-mp-1326,Nb6Sn2,Nb-Sn,Nb75Sn25,P m -3 n,cubic,5.334611,5.334611,5.334611,data/final/MP/cifs/As0.05Nb3Sn0.95-MP-mp-1326-synth_doped.cif,data/source/MP/raw/cifs/mp-1326.cif,mp-1326,0.0,,2011-05-14 09:51:48,8.694218121896231,10.17188/1189484,"@misc{osti_1189484,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Sn (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189484"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668415'}},0.0,6.59372491,520.0,-69.93787048,-8.74223381,{'tags': ['Niobium tin (3/1)']},-69.93787048,-8.74223381,-0.163862066250001,"['xas', 'elasticity', 'bandstructure']",True,"[105230, 645503, 645489, 105231, 645498, 645485, 645474, 645496, 645480, 645488, 645482, 645487, 645500, 645493, 645477, 645484, 645502, 645483, 150878, 645479, 645481, 645486, 645473]",True,2021-05-12 10:56:12.755000,NM,8,9,mp-1326,,Nb3Sn,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Sn_d'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Sn': 1.0}",GGA,mp-1326,"['mp-930046', 'mp-913770', 'mp-930577', 'mp-1326', 'mp-1440651', 'mp-1668415', 'mp-1880085', 'mp-1594093', 'mp-1594507']",0.62023085,"{'Nb': 6.0, 'Sn': 2.0}",151.81275738025872,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0081709977567491,0.62023085,0,1.2404617,MP,data/source/MP/cleaned/cifs/MP-mp-1326.cif,True,,data/final/MP/graphs/As0.05Nb3Sn0.95-MP-mp-1326-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Cu3Gd0.922Pr0.078O7,2,0.0119999999999999,1.0,True,Ba2Cu3Gd0.922Pr0.078O7,Ba2Cu3Gd1O7,84.0,Cuprate,True,Ba15.385Cu23.077Gd7.092Pr0.6O53.84615384615385,Ba-Cu-Gd-Pr-O,5,Supercon,Gd0.922Pr0.078Ba2Cu3O7,MP-mp-19813,Ba2Gd1Cu3O7,Ba-Cu-Gd-O,Ba15.385Cu23.077Gd7.692O53.84615384615385,P m m m,orthorhombic,3.866027,3.930015,11.83802,data/final/MP/cifs/Ba2Cu3Gd0.922Pr0.078O7-MP-mp-19813-synth_doped.cif,data/source/MP/raw/cifs/mp-19813.cif,mp-19813,0.0,,2014-02-22 19:20:06,6.781489399734723,10.17188/1195011,"@misc{osti_1195011,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2GdCu3O7 (SG:47) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195011"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702590'}},0.0282650169230738,3.15888808,520.0,-88.25301217,-6.788693243846154,"{'tags': ['Gadolinium dibarium tricopper heptaoxide', 'Gadolinium barium copper oxide (1/2/3/7)', 'Dibarium gadolinium dicopper copper(III) oxide']}",-88.25301217,-6.788693243846154,-2.170353940384615,['bandstructure'],True,"[56514, 86959, 81172]",True,2021-05-12 10:58:49.477000,FM,13,5,mp-19813,oxide,Ba2GdCu3O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Gd', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Gd': 1.0, 'Cu': 3.0, 'O': 7.0}",GGA,mp-19813,"['mp-19813', 'mp-1432948', 'mp-1702590', 'mp-1829895', 'mp-1597575']",6.9263247,"{'Ba': 2.0, 'Gd': 1.0, 'Cu': 3.0, 'O': 7.0}",179.8614789314764,[],FM,True,47,1,"[0.0, 0.0, 6.9, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0385092168770545,6.9263247,1,6.9263247,MP,data/source/MP/cleaned/cifs/MP-mp-19813.cif,True,,data/final/MP/graphs/Ba2Cu3Gd0.922Pr0.078O7-MP-mp-19813-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Bi1Ca0.35Cu2Pb1Sr2Y0.65O8,2,0.02,4.0,False,Bi4Ca1.4Cu8Pb4Sr8Y2.6O32,Bi4Ca2Cu8Pb4Sr8Y2O32,76.0,Cuprate,True,Bi6.667Ca2.333Cu13.333Pb6.667Sr13.333Y4.333O53.333333333333336,Bi-Ca-Cu-Pb-Sr-Y-O,7,Supercon,Bi1Pb1Sr2Y0.65Ca0.35Cu2O8,MP-mp-1218870,Sr8Ca2Y2Cu8Bi4Pb4O32,Bi-Ca-Cu-Pb-Sr-Y-O,Bi6.667Ca3.333Cu13.333Pb6.667Sr13.333Y3.333O53.333333333333336,P 1 2/c 1,monoclinic,5.393147,5.46205321,31.57964053,data/final/MP/cifs/Bi1Ca0.35Cu2Pb1Sr2Y0.65O8-MP-mp-1218870-synth_doped.cif,data/source/MP/raw/cifs/mp-1218870.cif,mp-1218870,0.0,,2019-01-12 19:58:05.080000,6.504642892556258,,,,0.0174792517343735,3.51648169,520.0,-359.0010128,-5.983350213333334,{'tags': []},-359.0010128,-5.983350213333334,-2.1497632024444444,[],False,[],True,2021-05-12 11:00:42.526000,NM,60,2,mp-1218870,oxide,Sr4CaYCu4Bi2(PbO8)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Y_sv', 'Cu_pv', 'Bi', 'Pb_d', 'O'], 'pot_type': 'paw'}","{'Sr': 4.0, 'Ca': 1.0, 'Y': 1.0, 'Cu': 4.0, 'Bi': 2.0, 'Pb': 2.0, 'O': 16.0}",GGA,mp-1218870,"['mp-1218870', 'mp-1894487']",0.0660297,"{'Sr': 8.0, 'Ca': 2.0, 'Y': 2.0, 'Cu': 8.0, 'Bi': 4.0, 'Pb': 4.0, 'O': 32.0}",930.2587864724716,[],NM,False,13,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001419598523769,0.0660297,0,0.1320594,MP,data/source/MP/cleaned/cifs/MP-mp-1218870.cif,True,,data/final/MP/graphs/Bi1Ca0.35Cu2Pb1Sr2Y0.65O8-MP-mp-1218870-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,1,0,0,0,1.0,False
Hf0.5V2Zr0.5,1,0.0,2.0,False,Hf1V4Zr1,Hf1V4Zr1,10.1,Other,True,Hf16.667V66.667Zr16.667,Hf-V-Zr,3,Supercon,Hf0.5V2Zr0.5,MP-mp-1224085,Hf1Zr1V4,Hf-V-Zr,Hf16.667V66.667Zr16.667,F -4 3 m,cubic,5.18701573,5.187015729999999,5.187015729999999,data/final/MP/cifs/Hf0.5V2Zr0.5-MP-mp-1224085.cif,data/source/MP/raw/cifs/mp-1224085.cif,mp-1224085,0.0,,2019-01-13 00:23:09.162000,7.967334263158579,,,{'GGA': {'task_id': 'mp-1756967'}},0.0410283783333351,5.00695262,520.0,-54.59434349,-9.099057248333333,{'tags': []},-54.59434349,-9.099057248333333,0.0410283783333322,['bandstructure'],True,[],True,2021-05-12 10:58:45.495000,FM,6,5,mp-1224085,,HfZrV4,"{'functional': 'PBE', 'labels': ['Hf_pv', 'Zr_sv', 'V_pv'], 'pot_type': 'paw'}","{'Hf': 1.0, 'Zr': 1.0, 'V': 4.0}",GGA,mp-1224085,"['mp-1224085', 'mp-1444296', 'mp-1756967', 'mp-1796002', 'mp-1624522']",0.362572,"{'Hf': 1.0, 'Zr': 1.0, 'V': 4.0}",98.68194446031352,[],FM,True,160,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.1]",0.0036741473020509,0.362572,3,0.362572,MP,data/source/MP/cleaned/cifs/MP-mp-1224085.cif,False,,data/final/MP/graphs/Hf0.5V2Zr0.5-MP-mp-1224085.json,0,True,-43m,5,0,0,0,0,0,0,0,0,0,1,1.0,False
Ba1.8Cu4La0.2Y1O8,3,0.0266666666666666,1.0,True,Ba1.8Cu4La0.2Y1O8,Ba2Cu4Y1O8,44.0,Cuprate,True,Ba12Cu26.667La1.333Y6.667O53.333333333333336,Ba-Cu-La-Y-O,5,Supercon,Y1Ba1.8La0.2Cu4O8,MP-mp-6790,Ba2Y1Cu4O8,Ba-Cu-Y-O,Ba13.333Cu26.667Y6.667O53.333333333333336,C m m m,orthorhombic,3.889922,3.899603999537882,13.88942687,data/final/MP/cifs/Ba1.8Cu4La0.2Y1O8-MP-mp-6790-synth_doped.cif,data/source/MP/raw/cifs/mp-6790.cif,mp-6790,0.0,,2011-05-16 03:21:24,5.936250568336678,10.17188/1283441,"@misc{osti_1283441,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Y(CuO2)4 (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1283441"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686864'}},0.0,3.31391536,520.0,-91.58381472,-6.105587648,"{'tags': ['Yttrium barium copper oxide (1/2/4/8)', 'High pressure experimental phase']}",-91.58381472,-6.105587648,-2.0529924817777783,"['xas', 'bandstructure']",True,"[72261, 85273, 74251, 400273, 85277, 85275, 400280, 67632, 85272, 67631, 83920, 66613, 85279, 400277, 75689, 74259, 85278, 85280, 66603, 94265, 400276, 88873, 71417, 75712, 97052, 66605, 72258, 85281, 85274, 400279, 66604, 69698]",True,2021-05-12 10:57:34.594000,NM,15,10,mp-6790,oxide,Ba2Y(CuO2)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-6790,"['mp-1000664', 'mp-6790', 'mp-1007136', 'mp-1237713', 'mp-1440937', 'mp-1686864', 'mp-1834179', 'mp-1011883', 'mp-1590064', 'mp-1590433']",0.0004643,"{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",208.60454115924333,[],NM,False,65,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.225742533790601e-06,0.0004643,0,0.0004643,MP,data/source/MP/cleaned/cifs/MP-mp-6790.cif,True,,data/final/MP/graphs/Ba1.8Cu4La0.2Y1O8-MP-mp-6790-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Co0.95Ga0.05Zr2,2,0.0333333333333333,2.0,False,Co1.9Ga0.1Zr4,Co2Zr4,5.79,Other,True,Co31.667Ga1.667Zr66.667,Co-Ga-Zr,3,Supercon,Zr2Co0.95Ga0.05,MP-mp-628,Zr4Co2,Co-Zr,Co33.333Zr66.667,I 4/m c m,tetragonal,5.27792884001752,5.27792884,5.277928840000001,data/final/MP/cifs/Co0.95Ga0.05Zr2-MP-mp-628-synth_doped.cif,data/source/MP/raw/cifs/mp-628.cif,mp-628,0.0,,2011-05-13 12:16:44,7.17077101131263,10.17188/1278899,"@misc{osti_1278899,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Zr2Co (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278899"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677545'}},0.0,4.51380976,520.0,-49.95120762,-8.325201269999999,"{'tags': ['Cobalt zirconium (1/2)', 'Zirconium cobalt (2/1)']}",-49.95120762,-8.325201269999999,-0.2572949183333328,"['xas', 'elasticity', 'bandstructure']",True,"[625671, 191386, 625688, 102740, 625665]",True,2021-05-12 10:56:27.046000,NM,6,20,mp-628,,Zr2Co,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Co'], 'pot_type': 'paw'}","{'Zr': 2.0, 'Co': 1.0}",GGA,mp-628,"['mp-928347', 'mp-912327', 'mp-928866', 'mp-628', 'mp-1071352', 'mp-1071381', 'mp-1071431', 'mp-1071762', 'mp-1071803', 'mp-1071859', 'mp-1071883', 'mp-1071742', 'mp-1071925', 'mp-1441633', 'mp-1677545', 'mp-1802810', 'mp-1591799', 'mp-1071792', 'mp-1071416', 'mp-1071915']",0.0001226,"{'Zr': 4.0, 'Co': 2.0}",111.79353060019714,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0]",2.1933290654975308e-06,0.0001226,0,0.0002452,MP,data/source/MP/cleaned/cifs/MP-mp-628.cif,True,,data/final/MP/graphs/Co0.95Ga0.05Zr2-MP-mp-628-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Bi1Pd1Te1,1,0.0,4.0,False,Bi4Pd4Te4,Bi4Pd4Te4,1.2,Other,True,Bi33.333Pd33.333Te33.333,Bi-Pd-Te,3,Supercon,Bi1Pd1Te1,MP-mp-29011,Bi4Te4Pd4,Bi-Pd-Te,Bi33.333Pd33.333Te33.333,P 21 3,cubic,6.756633,6.756633,6.756633,data/final/MP/cifs/Bi1Pd1Te1-MP-mp-29011.cif,data/source/MP/raw/cifs/mp-29011.cif,mp-29011,0.0,,2014-02-25 19:31:49,9.539425423637384,10.17188/1203060,"@misc{osti_1203060,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BiTePd (SG:198) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1203060"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1708279'}},0.1037315816666657,6.44026521,520.0,-52.94427588,-4.41202299,"{'tags': ['Palladium bismuth telluride (1/1/1)', 'Michenerite']}",-52.94427588,-4.41202299,-0.3409506399999997,"['xas', 'elasticity', 'bandstructure']",True,"[70060, 616961]",True,2021-05-12 10:56:18.721000,NM,12,9,mp-29011,,BiTePd,"{'functional': 'PBE', 'labels': ['Bi', 'Te', 'Pd'], 'pot_type': 'paw'}","{'Bi': 1.0, 'Te': 1.0, 'Pd': 1.0}",GGA,mp-29011,"['mp-923894', 'mp-908951', 'mp-924517', 'mp-505251', 'mp-29011', 'mp-1426428', 'mp-1708279', 'mp-1809514', 'mp-1604024']",5.675e-06,"{'Bi': 4.0, 'Te': 4.0, 'Pd': 4.0}",308.4544144122823,[],NM,False,198,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",7.35927220988286e-08,5.675e-06,0,2.27e-05,MP,data/source/MP/cleaned/cifs/MP-mp-29011.cif,False,,data/final/MP/graphs/Bi1Pd1Te1-MP-mp-29011.json,0,True,23,1,0,0,0,0,0,0,1,0,0,0,1.0,False
La1Mg2,1,0.0,2.0,False,La2Mg4,La2Mg4,1.05,Other,True,La33.333Mg66.667,La-Mg,2,Supercon,La1Mg2,MP-mp-1909,La2Mg4,La-Mg,La33.333Mg66.667,F d -3 m,cubic,6.210098840000001,6.210098839999999,6.21009884,data/final/MP/cifs/La1Mg2-MP-mp-1909.cif,data/source/MP/raw/cifs/mp-1909.cif,mp-1909,0.0,,2011-05-13 05:06:49,3.677355842745746,10.17188/1193875,"@misc{osti_1193875,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaMg2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1193875"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678131'}},0.0005135316666668,4.58424477,520.0,-17.02016004,-2.83669334,{'tags': ['Lanthanum magnesium (1/2)']},-17.02016004,-2.83669334,-0.1245042716666666,"['bandstructure', 'elasticity']",True,"[641406, 641407, 150961, 657962, 104660, 170775]",True,2021-05-12 10:56:14.760000,NM,6,8,mp-1909,,LaMg2,"{'functional': 'PBE', 'labels': ['La', 'Mg_pv'], 'pot_type': 'paw'}","{'La': 1.0, 'Mg': 2.0}",GGA,mp-1909,"['mp-929404', 'mp-929019', 'mp-912607', 'mp-1909', 'mp-1441716', 'mp-1678131', 'mp-1828241', 'mp-1596834']",0.00038415,"{'La': 2.0, 'Mg': 4.0}",169.34818214076705,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",4.536806892685551e-06,0.00038415,0,0.0007683,MP,data/source/MP/cleaned/cifs/MP-mp-1909.cif,False,,data/final/MP/graphs/La1Mg2-MP-mp-1909.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Cu1La1.774Sr0.226O4,3,0.0645714285714285,1.0,True,Cu1La1.774Sr0.226O4,Cu1La2O4,19.8,Cuprate,True,Cu14.286La25.343Sr3.229O57.142857142857146,Cu-La-Sr-O,4,Supercon,La1.774Sr0.226Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La1.774Sr0.226O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La1.774Sr0.226O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Al3Tl1,1,0.0,1.0,True,Al3Tl1,Al3Tl1,0.75,Other,True,Al75Tl25,Al-Tl,2,Supercon,Al3Tl1,MP-mp-983584,Al3Tl1,Al-Tl,Al75Tl25,P m -3 m,cubic,4.354232,4.354232,4.354232,data/final/MP/cifs/Al3Tl1-MP-mp-983584.cif,data/source/MP/raw/cifs/mp-983584.cif,mp-983584,0.0,,2015-10-15 06:32:33,5.739296558237878,10.17188/1316528,"@misc{osti_1316528,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Al3Tl (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1316528"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1765814'}},0.2847036166666665,7.06710159,520.0,-12.46055617,-3.1151390425,{'tags': []},-12.46055617,-3.1151390425,0.2847036166666665,"['xas', 'elasticity', 'bandstructure']",True,[],True,2021-05-12 10:56:37.246000,NM,4,7,mp-983584,,Al3Tl,"{'functional': 'PBE', 'labels': ['Al', 'Tl_d'], 'pot_type': 'paw'}","{'Al': 3.0, 'Tl': 1.0}",GGA,mp-983584,"['mp-984075', 'mp-983584', 'mp-1252602', 'mp-1436137', 'mp-1765814', 'mp-1799677', 'mp-1616838']",3.33e-05,"{'Al': 3.0, 'Tl': 1.0}",82.55334885899755,[],NM,False,221,0,"[0, 0, 0, 0]",4.03375519712434e-07,3.33e-05,0,3.33e-05,MP,data/source/MP/cleaned/cifs/MP-mp-983584.cif,False,,data/final/MP/graphs/Al3Tl1-MP-mp-983584.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Eu1Ga1Si1,1,0.0,1.0,True,Eu1Ga1Si1,Eu1Ga1Si1,0.0,Other,True,Eu33.333Ga33.333Si33.333,Eu-Ga-Si,3,Supercon,Eu1Ga1Si1,MP-mp-1225124,Eu1Ga1Si1,Eu-Ga-Si,Eu33.333Ga33.333Si33.333,P -6 m 2,hexagonal,4.174393995788113,4.17439378,4.481725,data/final/MP/cifs/Eu1Ga1Si1-MP-mp-1225124.cif,data/source/MP/raw/cifs/mp-1225124.cif,mp-1225124,0.0,,2019-01-13 01:16:49.064000,6.132407934084009,,,{'GGA': {'task_id': 'mp-1764750'}},0.0,4.27461366,520.0,-20.37000927,-6.79000309,{'tags': []},-20.37000927,-6.79000309,-0.5178519174999998,['bandstructure'],True,[],True,2021-05-12 10:58:45.495000,FM,3,5,mp-1225124,,EuGaSi,"{'functional': 'PBE', 'labels': ['Eu', 'Ga_d', 'Si'], 'pot_type': 'paw'}","{'Eu': 1.0, 'Ga': 1.0, 'Si': 1.0}",GGA,mp-1225124,"['mp-1225124', 'mp-1410172', 'mp-1764750', 'mp-1784226', 'mp-1629619']",7.0635107,"{'Eu': 1.0, 'Ga': 1.0, 'Si': 1.0}",67.63362751964416,[],FM,True,187,1,"[6.8, -0.0, -0.0]",0.1044378508006007,7.0635107,1,7.0635107,MP,data/source/MP/cleaned/cifs/MP-mp-1225124.cif,False,,data/final/MP/graphs/Eu1Ga1Si1-MP-mp-1225124.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Ce1S1,1,0.0,1.0,True,Ce1S1,Ce1S1,0.0,Heavy_fermion,True,Ce50S50,Ce-S,2,Supercon,Ce1S1,MP-mp-1096,Ce1S1,Ce-S,Ce50S50,F m -3 m,cubic,4.01819085,4.01819085,4.01819085,data/final/MP/cifs/Ce1S1-MP-mp-1096.cif,data/source/MP/raw/cifs/mp-1096.cif,mp-1096,0.0,,2011-05-12 18:20:21,6.232433296978239,10.17188/1187481,"@misc{osti_1187481,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeS (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187481"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688412'}},0.0,8.46437524,520.0,-14.16108828,-7.08054414,"{'tags': ['Cerium sulfide (1/1)', 'Cerium(II) sulfide', 'High pressure experimental phase']}",-14.16108828,-7.08054414,-2.2972746290625,"['xas', 'elasticity', 'bandstructure']",True,"[603041, 29397, 622013, 31706, 622035, 622033, 102279, 183945, 622039, 622029, 622009, 102280, 622016, 603087, 622010]",True,2021-05-12 10:56:10.715000,FM,2,7,mp-1096,,CeS,"{'functional': 'PBE', 'labels': ['Ce', 'S'], 'pot_type': 'paw'}","{'Ce': 1.0, 'S': 1.0}",GGA,mp-1096,"['mp-1096', 'mp-1076900', 'mp-1440849', 'mp-1688412', 'mp-1790865', 'mp-1594709', 'mp-1593380']",0.1440823,"{'Ce': 1.0, 'S': 1.0}",45.875064104557374,[],FM,True,225,1,"[0.1, 0.0]",0.0031407541942962,0.1440823,1,0.1440823,MP,data/source/MP/cleaned/cifs/MP-mp-1096.cif,False,,data/final/MP/graphs/Ce1S1-MP-mp-1096.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Bi2Cu1Sr2O6.18,2,0.0146365262644332,1.9416868932038835,False,Bi3.883Cu1.942Sr3.883O12,Bi4Cu2Sr4O12,3.0,Cuprate,True,Bi17.889Cu8.945Sr17.889O55.27728085867621,Bi-Cu-Sr-O,4,Supercon,Bi2Sr2Cu1O6.18,MP-mp-555827,Sr4Cu2Bi4O12,Bi-Cu-Sr-O,Bi18.182Cu9.091Sr18.182O54.54545454545455,C c c m,orthorhombic,5.133052,5.52519599964684,13.01880065,data/final/MP/cifs/Bi2Cu1Sr2O6.18-MP-mp-555827-synth_doped.cif,data/source/MP/raw/cifs/mp-555827.cif,mp-555827,0.0,,2014-02-22 10:13:35,6.928457216674172,10.17188/1269010,"@misc{osti_1269010,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr2Cu(BiO3)2 (SG:66) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1269010"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1707731'}},0.0585641377272736,4.75363105,520.0,-126.5422218,-5.7519191727272725,{'tags': ['Dibismuth distrontium copper hexaoxide']},-126.5422218,-5.7519191727272725,-2.0406438793939388,"['xas', 'bandstructure']",True,[67426],True,2021-05-12 10:57:17.297000,NM,22,8,mp-555827,oxide,Sr2Cu(BiO3)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Cu': 1.0, 'Bi': 2.0, 'O': 6.0}",GGA,mp-555827,"['mp-932594', 'mp-931549', 'mp-918058', 'mp-555827', 'mp-1418436', 'mp-1707731', 'mp-1837530', 'mp-1605675']",0.00627605,"{'Sr': 4.0, 'Cu': 2.0, 'Bi': 4.0, 'O': 12.0}",360.8189966762927,[],NM,False,66,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",3.478780251490214e-05,0.00627605,0,0.0125521,MP,data/source/MP/cleaned/cifs/MP-mp-555827.cif,True,,data/final/MP/graphs/Bi2Cu1Sr2O6.18-MP-mp-555827-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
B2Mg0.99Pb0.01,2,0.0066666666666666,1.0,True,B2Mg0.99Pb0.01,B2Mg1,35.9,Other,True,B66.667Mg33Pb0.333,B-Mg-Pb,3,Supercon,Mg0.99Pb0.01B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B2Mg0.99Pb0.01-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B2Mg0.99Pb0.01-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Be1,1,0.0,2.0,False,Be2,Be2,3.1065,Other,True,Be100,Be,1,Supercon,Be1,MP-mp-87,Be2,Be,Be100,P 63/m m c,hexagonal,2.2598259971270527,2.25982537,3.569878,data/final/MP/cifs/Be1-MP-mp-87.cif,data/source/MP/raw/cifs/mp-87.cif,mp-87,0.0,,2011-05-12 17:07:03,1.895724397211328,10.17188/1312591,"@misc{osti_1312591,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Be (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1312591"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668421'}},0.0,4.97921307,520.0,-7.47882573,-3.739412865,"{'tags': ['Beryllium', 'Beryllium - alpha']}",-7.47882573,-3.739412865,0.0,"['surfaces', 'eos', 'bandstructure', 'xas', 'elasticity']",True,"[150618, 600013, 190781, 76743, 52707, 616179, 43363, 52263, 426928, 53766, 52229, 20686, 1425, 150617, 616181]",True,2021-05-12 10:56:33.121000,NM,2,17,mp-87,,Be,"{'functional': 'PBE', 'labels': ['Be_sv'], 'pot_type': 'paw'}",{'Be': 1.0},GGA,mp-87,"['mp-987956', 'mp-87', 'mp-986800', 'mp-1058997', 'mp-1058908', 'mp-1058938', 'mp-1060175', 'mp-1060209', 'mp-1060259', 'mp-1440665', 'mp-1668421', 'mp-1790555', 'mp-988135', 'mp-1594681', 'mp-1595150', 'mp-1058962', 'mp-1060226']",2.95e-05,{'Be': 2.0},15.788244650249196,[],NM,False,194,0,"[0, 0]",3.736957547023365e-06,2.95e-05,0,5.9e-05,MP,data/source/MP/cleaned/cifs/MP-mp-87.cif,False,,data/final/MP/graphs/Be1-MP-mp-87.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Sb0.249V0.751,2,0.002,8.0,False,Sb1.992V6.008,Sb2V6,0.0,Other,True,Sb24.9V75.1,Sb-V,2,Supercon,Sb0.249V0.751,MP-mp-1555,V6Sb2,Sb-V,Sb25V75,P m -3 n,cubic,4.935,4.935,4.935,data/final/MP/cifs/Sb0.249V0.751-MP-mp-1555-synth_doped.cif,data/source/MP/raw/cifs/mp-1555.cif,mp-1555,0.0,,2011-05-13 19:31:48,7.587411530928405,10.17188/1191232,"@misc{osti_1191232,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Sb (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191232"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699451'}},0.0,8.2538452,520.0,-64.48303092,-8.060378865,"{'tags': ['Vanadium antimonide (1/3)', 'Vanadium antimonide (3/1)']}",-64.48303092,-8.060378865,-0.2631990025000004,"['xas', 'elasticity', 'bandstructure']",True,"[651731, 52330, 106037, 651717]",True,2021-05-12 10:56:12.755000,NM,8,8,mp-1555,,V3Sb,"{'functional': 'PBE', 'labels': ['V_pv', 'Sb'], 'pot_type': 'paw'}","{'V': 3.0, 'Sb': 1.0}",GGA,mp-1555,"['mp-926619', 'mp-927153', 'mp-911044', 'mp-1555', 'mp-1413633', 'mp-1699451', 'mp-1805224', 'mp-1596724']",0.0044149,"{'V': 6.0, 'Sb': 2.0}",120.18810037499998,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",7.34665076862856e-05,0.0044149,0,0.0088298,MP,data/source/MP/cleaned/cifs/MP-mp-1555.cif,True,,data/final/MP/graphs/Sb0.249V0.751-MP-mp-1555-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ga1Ti3,1,0.0,2.0,False,Ga2Ti6,Ga2Ti6,0.0,Other,True,Ga25Ti75,Ga-Ti,2,Supercon,Ga1Ti3,MP-mp-30672,Ti6Ga2,Ga-Ti,Ga25Ti75,P 63/m m c,hexagonal,4.651062,5.69844799658224,5.69844823,data/final/MP/cifs/Ga1Ti3-MP-mp-30672.cif,data/source/MP/raw/cifs/mp-30672.cif,mp-30672,0.0,,2014-02-25 20:52:29,5.416551144187925,10.17188/1205044,"@misc{osti_1205044,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ti3Ga (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1205044"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696091'}},0.0,5.65996682,520.0,-56.00010115,-7.00001264375,"{'tags': ['Titanium gallium (3/1)', 'Gallium titanium (1/3)', 'Titanium gallide (3/1)']}",-56.00010115,-7.00001264375,-0.3213696256249996,"['xas', 'elasticity', 'bandstructure']",True,"[635554, 182429, 103991]",True,2021-05-12 10:56:18.721000,NM,8,10,mp-30672,,Ti3Ga,"{'functional': 'PBE', 'labels': ['Ti_pv', 'Ga_d'], 'pot_type': 'paw'}","{'Ti': 3.0, 'Ga': 1.0}",GGA,mp-30672,"['mp-941646', 'mp-941830', 'mp-934939', 'mp-30672', 'mp-510175', 'mp-1079453', 'mp-1424261', 'mp-1696091', 'mp-1866200', 'mp-1596884']",0.0085042,"{'Ti': 6.0, 'Ga': 2.0}",130.79645199084948,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0001300371664606,0.0085042,0,0.0170084,MP,data/source/MP/cleaned/cifs/MP-mp-30672.cif,False,,data/final/MP/graphs/Ga1Ti3-MP-mp-30672.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
C1Ga1Ni3,1,0.0,1.0,True,C1Ga1Ni3,C1Ga1Ni3,0.0,Other,True,C20Ga20Ni60,C-Ga-Ni,3,Supercon,Ga1C1Ni3,MP-mp-1206991,Ga1Ni3C1,C-Ga-Ni,C20Ga20Ni60,P m -3 m,cubic,3.775591,3.775591,3.775591,data/final/MP/cifs/C1Ga1Ni3-MP-mp-1206991.cif,data/source/MP/raw/cifs/mp-1206991.cif,mp-1206991,0.0,,2019-01-12 10:11:26.015000,7.95427496167457,,,{'GGA': {'task_id': 'mp-1732817'}},0.1567730159999989,7.52578268,520.0,-29.97224719,-5.994449438,"{'tags': ['CaTiO3', 'Ni3GaC', 'perovskite']}",-29.97224719,-5.994449438,-0.0753920854999996,['bandstructure'],True,[],True,2021-05-12 10:58:39.488000,NM,5,5,mp-1206991,,GaNi3C,"{'functional': 'PBE', 'labels': ['Ga_d', 'Ni_pv', 'C'], 'pot_type': 'paw'}","{'Ga': 1.0, 'Ni': 3.0, 'C': 1.0}",GGA,mp-1206991,"['mp-1206991', 'mp-1422739', 'mp-1732817', 'mp-1795441', 'mp-1613068']",0.002119,"{'Ga': 1.0, 'Ni': 3.0, 'C': 1.0}",53.82137968893875,[],NM,False,221,0,"[0, 0, 0, 0, 0]",3.937097139179232e-05,0.002119,0,0.002119,MP,data/source/MP/cleaned/cifs/MP-mp-1206991.cif,False,,data/final/MP/graphs/C1Ga1Ni3-MP-mp-1206991.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Al1Ni2Ta1,1,0.0,1.0,True,Al1Ni2Ta1,Al1Ni2Ta1,0.0,Other,True,Al25Ni50Ta25,Al-Ni-Ta,3,Supercon,Ni2Ta1Al1,MP-mp-5921,Ta1Al1Ni2,Al-Ni-Ta,Al25Ni50Ta25,F m -3 m,cubic,4.22776882,4.22776882,4.22776882,data/final/MP/cifs/Al1Ni2Ta1-MP-mp-5921.cif,data/source/MP/raw/cifs/mp-5921.cif,mp-5921,0.0,,2011-05-13 01:29:37,10.109649925044955,10.17188/1277180,"@misc{osti_1277180,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TaAlNi2 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277180"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671849'}},0.0141429445000005,7.94017361,520.0,-28.99541271,-7.2488531775,{'tags': ['Aluminium nickel tantalum (1/2/1)']},-28.99541271,-7.2488531775,-0.4579464725000006,"['xas', 'elasticity', 'bandstructure']",True,"[58055, 608870]",True,2021-05-12 10:56:27.046000,NM,4,9,mp-5921,,TaAlNi2,"{'functional': 'PBE', 'labels': ['Ta_pv', 'Al', 'Ni_pv'], 'pot_type': 'paw'}","{'Ta': 1.0, 'Al': 1.0, 'Ni': 2.0}",GGA,mp-5921,"['mp-927905', 'mp-911560', 'mp-927453', 'mp-5921', 'mp-1258538', 'mp-1437808', 'mp-1671849', 'mp-1793854', 'mp-1596244']",0.0001214,"{'Ta': 1.0, 'Al': 1.0, 'Ni': 2.0}",53.434124226757866,[],NM,False,225,0,"[0, 0, 0, 0]",2.271956390354898e-06,0.0001214,0,0.0001214,MP,data/source/MP/cleaned/cifs/MP-mp-5921.cif,False,,data/final/MP/graphs/Al1Ni2Ta1-MP-mp-5921.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Al1Nb2.7V0.3,3,0.1499999999999999,2.0,False,Al2Nb5.4V0.6,Al2Nb6,15.4,Other,True,Al25Nb67.5V7.5,Al-Nb-V,3,Supercon,Al1Nb2.7V0.3,MP-mp-796,Nb6Al2,Al-Nb,Al25Nb75,P m -3 n,cubic,5.215254,5.215254,5.215254,data/final/MP/cifs/Al1Nb2.7V0.3-MP-mp-796-synth_doped.cif,data/source/MP/raw/cifs/mp-796.cif,mp-796,0.0,,2011-05-13 16:07:37,7.157298025966356,,,{'GGA': {'task_id': 'mp-1686893'}},0.0460773865000003,5.52947534,520.0,-69.48918494,-8.6861481175,"{'tags': ['Aluminium niobium (1/3)', 'Niobium aluminide (3/1)', 'Aluminum niobium (1/3)']}",-69.48918494,-8.6861481175,-0.1737753800000003,"['bandstructure', 'elasticity']",True,"[608675, 608654, 608688, 608668, 608669, 608685, 608676, 608683, 58014, 608657, 107856, 608655, 608666, 608691, 608656, 608665, 608673, 608653, 608661]",True,2021-05-12 10:56:31.128000,NM,8,10,mp-796,,Nb3Al,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Al': 1.0}",GGA,mp-796,"['mp-911586', 'mp-927906', 'mp-796', 'mp-927472', 'mp-1260512', 'mp-1440919', 'mp-1686893', 'mp-1927652', 'mp-1591599', 'mp-1587739']",0.16323955,"{'Nb': 6.0, 'Al': 2.0}",141.8490379078192,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0023015954483396,0.16323955,0,0.3264791,MP,data/source/MP/cleaned/cifs/MP-mp-796.cif,True,,data/final/MP/graphs/Al1Nb2.7V0.3-MP-mp-796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Ca0.26Cu3Y0.74O6,3,0.0433333333333333,1.0,True,Ba2Ca0.26Cu3Y0.74O6,Ba2Cu3Y1O6,44.7,Cuprate,True,Ba16.667Ca2.167Cu25Y6.167O50,Ba-Ca-Cu-Y-O,5,Supercon,Y0.74Ca0.26Ba2Cu3O6,MP-mp-22215,Ba2Y1Cu3O6,Ba-Cu-Y-O,Ba16.667Cu25Y8.333O50,P 4/m m m,tetragonal,3.890574,3.890574,12.12302,data/final/MP/cifs/Ba2Ca0.26Cu3Y0.74O6-MP-mp-22215-synth_doped.cif,data/source/MP/raw/cifs/mp-22215.cif,mp-22215,0.0,,2014-02-22 10:32:14,5.883747679108356,10.17188/1197430,"@misc{osti_1197430,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Y(CuO2)3 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197430"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697120'}},0.0102308603749952,3.24358281,520.0,-74.96347692,-6.24695641,"{'tags': ['Dibarium yttrium dicopper copper(I) hexaoxide', 'Yttrium dibarium copper(I) dicopper oxide', 'Yttrium dibarium copper oxide (1/2/3/6)', 'Dibarium yttrium tricopper hexaoxide', 'Yttrium barium copper oxide (1/2/3/6)']}",-74.96347692,-6.24695641,-2.232973175555556,"['xas', 'bandstructure']",True,"[68290, 72254, 63424, 66903, 68046, 68008, 67016, 84739, 203116, 63269]",True,2021-05-12 10:56:59.077000,NM,12,11,mp-22215,oxide,Ba2Y(CuO2)3,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Cu': 3.0, 'O': 6.0}",GGA,mp-22215,"['mp-917350', 'mp-923178', 'mp-922392', 'mp-610585', 'mp-22215', 'mp-1182689', 'mp-1236883', 'mp-1432999', 'mp-1697120', 'mp-1830265', 'mp-1587968']",0.1132814,"{'Ba': 2.0, 'Y': 1.0, 'Cu': 3.0, 'O': 6.0}",183.5008929491185,[],NM,False,123,0,"[0.0, 0.0, 0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0006173343256232,0.1132814,0,0.1132814,MP,data/source/MP/cleaned/cifs/MP-mp-22215.cif,True,,data/final/MP/graphs/Ba2Ca0.26Cu3Y0.74O6-MP-mp-22215-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ge0.3In0.7,3,0.1,8.0,False,Ge2.4In5.6,Ge2In6,0.0,Other,True,Ge30In70,Ge-In,2,Supercon,Ge0.3In0.7,MP-mp-1184915,In6Ge2,Ge-In,Ge25In75,P 63/m m c,hexagonal,5.298441,6.6694579993963234,6.669457949999999,data/final/MP/cifs/Ge0.3In0.7-MP-mp-1184915-synth_doped.cif,data/source/MP/raw/cifs/mp-1184915.cif,mp-1184915,0.0,,2019-01-11 13:09:31.244000,6.786615139062064,,,{'GGA': {'task_id': 'mp-1751199'}},0.1413039600000001,6.79235591,520.0,-24.62572641,-3.07821580125,{'tags': []},-24.62572641,-3.07821580125,0.1413039600000001,['bandstructure'],True,[],True,2021-05-12 10:58:27.755000,NM,8,5,mp-1184915,,In3Ge,"{'functional': 'PBE', 'labels': ['In_d', 'Ge_d'], 'pot_type': 'paw'}","{'In': 3.0, 'Ge': 1.0}",GGA,mp-1184915,"['mp-1184915', 'mp-1392202', 'mp-1751199', 'mp-1832543', 'mp-1621050']",0.0027064,"{'In': 6.0, 'Ge': 2.0}",204.1078998153357,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",2.651930672402767e-05,0.0027064,0,0.0054128,MP,data/source/MP/cleaned/cifs/MP-mp-1184915.cif,True,,data/final/MP/graphs/Ge0.3In0.7-MP-mp-1184915-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ga0.3V0.7,3,0.1,8.0,False,Ga2.4V5.6,Ga2V6,14.1,Other,True,Ga30V70,Ga-V,2,Supercon,Ga0.3V0.7,MP-mp-22568,V6Ga2,Ga-V,Ga25V75,P m -3 n,cubic,4.789645,4.789645,4.789645,data/final/MP/cifs/Ga0.3V0.7-MP-mp-22568-synth_doped.cif,data/source/MP/raw/cifs/mp-22568.cif,mp-22568,0.0,,2014-02-22 11:36:40,6.726541666276222,10.17188/1198793,"@misc{osti_1198793,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Ga (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198793"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686867'}},0.0,5.67452231,520.0,-61.95244347,-7.74405543375,{'tags': ['Gallium vanadium (1/3)']},-61.95244347,-7.74405543375,-0.1741018756249994,"['xas', 'elasticity', 'bandstructure']",True,"[635643, 635628, 635619, 635634, 104021, 635646, 635604, 635610, 635617, 635624, 635626, 635605, 635631, 635625, 635636, 635603, 104020, 635616, 635607]",True,2021-05-12 10:56:16.728000,FM,8,9,mp-22568,,V3Ga,"{'functional': 'PBE', 'labels': ['V_pv', 'Ga_d'], 'pot_type': 'paw'}","{'V': 3.0, 'Ga': 1.0}",GGA,mp-22568,"['mp-941343', 'mp-941663', 'mp-934924', 'mp-22568', 'mp-1440749', 'mp-1686867', 'mp-1804076', 'mp-1593784', 'mp-1595713']",0.09063635,"{'V': 6.0, 'Ga': 2.0}",109.87780534443452,[],FM,True,131,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.0, -0.0, -0.0]",0.0016497662965852,0.09063635,2,0.1812727,MP,data/source/MP/cleaned/cifs/MP-mp-22568.cif,True,,data/final/MP/graphs/Ga0.3V0.7-MP-mp-22568-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Al1Ni2Ti1,1,0.0,1.0,True,Al1Ni2Ti1,Al1Ni2Ti1,0.0,Other,True,Al25Ni50Ti25,Al-Ni-Ti,3,Supercon,Ni2Ti1Al1,MP-mp-7187,Ti1Al1Ni2,Al-Ni-Ti,Al25Ni50Ti25,F m -3 m,cubic,4.16387606,4.16387606,4.16387606,data/final/MP/cifs/Al1Ni2Ti1-MP-mp-7187.cif,data/source/MP/raw/cifs/mp-7187.cif,mp-7187,0.0,,2011-05-28 02:06:36,6.253223327443778,10.17188/1282081,"@misc{osti_1282081,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TiAlNi2 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1282081"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1690515'}},0.0,8.11714487,520.0,-25.69356942,-6.423392355,"{'tags': ['Titanium nickel aluminium (1/2/1)', 'Aluminium nickel titanium (1/2/1)']}",-25.69356942,-6.423392355,-0.6230570533333335,"['bandstructure', 'elasticity']",True,"[165902, 58063]",True,2021-05-12 10:56:29.056000,NM,4,9,mp-7187,,TiAlNi2,"{'functional': 'PBE', 'labels': ['Ti_pv', 'Al', 'Ni_pv'], 'pot_type': 'paw'}","{'Ti': 1.0, 'Al': 1.0, 'Ni': 2.0}",GGA,mp-7187,"['mp-991320', 'mp-993276', 'mp-7187', 'mp-1252206', 'mp-1438632', 'mp-1690515', 'mp-1791449', 'mp-994591', 'mp-1596418']",0.00013,"{'Ti': 1.0, 'Al': 1.0, 'Ni': 2.0}",51.04795927013034,[],NM,False,225,0,"[0.0, 0.0, 0.0, 0.0]",2.546624818282732e-06,0.00013,0,0.00013,MP,data/source/MP/cleaned/cifs/MP-mp-7187.cif,False,,data/final/MP/graphs/Al1Ni2Ti1-MP-mp-7187.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Co0.5Rh0.5V3,1,0.0,2.0,False,Co1Rh1V6,Co1Rh1V6,0.0,Other,True,Co12.5Rh12.5V75,Co-Rh-V,3,Supercon,Co0.5Rh0.5V3,MP-mp-1216457,V6Co1Rh1,Co-Rh-V,Co12.5Rh12.5V75,P m -3,cubic,4.722344,4.722344,4.722344,data/final/MP/cifs/Co0.5Rh0.5V3-MP-mp-1216457.cif,data/source/MP/raw/cifs/mp-1216457.cif,mp-1216457,0.0,,2019-01-12 17:57:47.389000,7.371339622201335,,,{'GGA': {'task_id': 'mp-1755280'}},0.0091916725,6.26930616,520.0,-70.9743728,-8.8717966,{'tags': []},-70.9743728,-8.8717966,-0.2497888393750003,['bandstructure'],True,[],True,2021-05-12 10:58:39.488000,NM,8,5,mp-1216457,,V6CoRh,"{'functional': 'PBE', 'labels': ['V_pv', 'Co', 'Rh_pv'], 'pot_type': 'paw'}","{'V': 6.0, 'Co': 1.0, 'Rh': 1.0}",GGA,mp-1216457,"['mp-1216457', 'mp-1393254', 'mp-1755280', 'mp-1796889', 'mp-1620040']",0.0051058,"{'V': 6.0, 'Co': 1.0, 'Rh': 1.0}",105.31078752147648,[],NM,False,200,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",4.848316226824106e-05,0.0051058,0,0.0051058,MP,data/source/MP/cleaned/cifs/MP-mp-1216457.cif,False,,data/final/MP/graphs/Co0.5Rh0.5V3-MP-mp-1216457.json,0,True,m-3,2,0,0,0,0,0,0,1,0,0,0,1.0,False
Ca0.5Ti1Y0.5O3,1,0.0,4.0,False,Ca2Ti4Y2O12,Ca2Ti4Y2O12,0.0,Oxide,True,Ca10Ti20Y10O60,Ca-Ti-Y-O,4,Supercon,Y0.5Ca0.5Ti1O3,MP-mp-1227099,Ca2Y2Ti4O12,Ca-Ti-Y-O,Ca10Ti20Y10O60,P m n 21,orthorhombic,5.3731,5.586636,7.717394,data/final/MP/cifs/Ca0.5Ti1Y0.5O3-MP-mp-1227099.cif,data/source/MP/raw/cifs/mp-1227099.cif,mp-1227099,0.0,,2019-01-13 02:58:43.978000,4.597813784801767,,,{'GGA': {'task_id': 'mp-1684282'}},0.0104752975833317,6.3906558,520.0,-171.84460141,-8.5922300705,{'tags': []},-171.84460141,-8.5922300705,-3.6093479648333338,[],False,[],True,2021-05-12 11:00:56.634000,FM,20,4,mp-1227099,oxide,CaYTi2O6,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Y_sv', 'Ti_pv', 'O'], 'pot_type': 'paw'}","{'Ca': 1.0, 'Y': 1.0, 'Ti': 2.0, 'O': 6.0}",GGA,mp-1227099,"['mp-1227099', 'mp-1374586', 'mp-1684282', 'mp-1932727']",0.986922,"{'Ca': 2.0, 'Y': 2.0, 'Ti': 4.0, 'O': 12.0}",231.6572902977105,[],FM,True,31,1,"[0.0, 0.0, 0.0, 0.0, 0.5, 0.5, 0.5, 0.5, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0085205347842208,0.986922,4,1.973844,MP,data/source/MP/cleaned/cifs/MP-mp-1227099.cif,False,,data/final/MP/graphs/Ca0.5Ti1Y0.5O3-MP-mp-1227099.json,0,True,mm2,0,0,0,6,0,0,0,1,0,0,0,1.0,False
Rh2Si2U1,1,0.0,1.0,True,Rh2Si2U1,Rh2Si2U1,1.1,Heavy_fermion,True,Rh40Si40U20,Rh-Si-U,3,Supercon,U1Rh2Si2,MP-mp-5556,U1Si2Rh2,Rh-Si-U,Rh40Si40U20,I 4/m m m,tetragonal,4.02033799805862,4.02033799805862,5.80074466,data/final/MP/cifs/Rh2Si2U1-MP-mp-5556.cif,data/source/MP/raw/cifs/mp-5556.cif,mp-5556,0.0,,2011-05-13 06:07:24,10.15927884094789,10.17188/1268900,"@misc{osti_1268900,
    author = ""Persson, Kristin"",
    title = ""Materials Data on U(SiRh)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1268900"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688182'}},0.0,9.57025639,520.0,-40.91235873,-8.182471746000001,{'tags': ['Rhodium uranium silicide (2/1/2)']},-40.91235873,-8.182471746000001,-0.8083409880000005,"['xas', 'elasticity', 'bandstructure']",True,"[657191, 108868, 57486, 650342, 650343, 659032]",True,2021-05-12 10:56:22.739000,FM,5,10,mp-5556,,U(SiRh)2,"{'functional': 'PBE', 'labels': ['U', 'Si', 'Rh_pv'], 'pot_type': 'paw'}","{'U': 1.0, 'Si': 2.0, 'Rh': 2.0}",GGA,mp-5556,"['mp-914346', 'mp-5556', 'mp-977835', 'mp-1124867', 'mp-1133336', 'mp-1439334', 'mp-1688182', 'mp-1868625', 'mp-1005319', 'mp-1591840']",1.9732489,"{'U': 1.0, 'Si': 2.0, 'Rh': 2.0}",81.72702637461501,[],FM,True,139,1,"[1.9, 0.0, 0.0, 0.0, 0.0]",0.0241443863496898,1.9732489,1,1.9732489,MP,data/source/MP/cleaned/cifs/MP-mp-5556.cif,False,,data/final/MP/graphs/Rh2Si2U1-MP-mp-5556.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B2C1Ho0.25Ni2Y0.75,3,0.0833333333333333,1.0,True,B2C1Ho0.25Ni2Y0.75,B2C1Ni2Y1,13.8,Other,True,B33.333C16.667Ho4.167Ni33.333Y12.5,B-C-Ho-Ni-Y,5,Supercon,Ho0.25Y0.75Ni2B2C1,MP-mp-6576,Y1Ni2B2C1,B-C-Ni-Y,B33.333C16.667Ni33.333Y16.667,I 4/m m m,tetragonal,3.548790000501972,3.548790000501972,5.76144136,data/final/MP/cifs/B2C1Ho0.25Ni2Y0.75-MP-mp-6576-synth_doped.cif,data/source/MP/raw/cifs/mp-6576.cif,mp-6576,0.0,,2011-05-13 05:21:43,6.099730998852292,10.17188/1281366,"@misc{osti_1281366,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281366"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688230'}},0.0,6.81083016,520.0,-43.677878,-7.279646333333333,{'tags': []},-43.677878,-7.279646333333333,-0.5109282141666659,"['xas', 'bandstructure']",True,"[75816, 89142, 83231, 79574, 41549]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6576,,YNi2B2C,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6576,"['mp-6576', 'mp-1007054', 'mp-1000583', 'mp-1439516', 'mp-1688230', 'mp-1794280', 'mp-1011792', 'mp-1597064']",0.0006603,"{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.3152437079014,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",1.010943177297096e-05,0.0006603,0,0.0006603,MP,data/source/MP/cleaned/cifs/MP-mp-6576.cif,True,,data/final/MP/graphs/B2C1Ho0.25Ni2Y0.75-MP-mp-6576-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ca0.065Cu1La1.935O4,2,0.0185714285714285,1.0,True,Ca0.065Cu1La1.935O4,Cu1La2O4,5.55,Cuprate,True,Ca0.929Cu14.286La27.643O57.142857142857146,Ca-Cu-La-O,4,Supercon,La1.935Ca0.065Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ca0.065Cu1La1.935O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ca0.065Cu1La1.935O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Bi2Ca1Cu2Sr2O8.288,2,0.0175824175824175,1.9306003861003864,False,Bi3.861Ca1.931Cu3.861Sr3.861O16,Bi4Ca2Cu4Sr4O16,90.2,Cuprate,True,Bi13.082Ca6.541Cu13.082Sr13.082O54.21245421245421,Bi-Ca-Cu-Sr-O,5,Supercon,Bi2Sr2Ca1Cu2O8.288,MP-mp-1218930,Sr4Ca2Cu4Bi4O16,Bi-Ca-Cu-Sr-O,Bi13.333Ca6.667Cu13.333Sr13.333O53.333333333333336,C c c 2,orthorhombic,5.417115,5.472898000129128,16.11398919,data/final/MP/cifs/Bi2Ca1Cu2Sr2O8.288-MP-mp-1218930-synth_doped.cif,data/source/MP/raw/cifs/mp-1218930.cif,mp-1218930,0.0,,2019-01-12 20:01:06.544000,6.266668983881059,,,,0.039252223722225,4.51768334,520.0,-173.15021002,-5.771673667333333,{'tags': []},-173.15021002,-5.771673667333333,-2.074956548222222,[],False,[],True,2021-05-12 11:00:42.526000,NM,30,3,mp-1218930,oxide,Sr2CaCu2(BiO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",GGA,mp-1218930,"['mp-1218930', 'mp-1359698', 'mp-1817714']",0.00011165,"{'Sr': 4.0, 'Ca': 2.0, 'Cu': 4.0, 'Bi': 4.0, 'O': 16.0}",470.7976286073367,[],NM,False,37,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.743014544498498e-07,0.00011165,0,0.0002233,MP,data/source/MP/cleaned/cifs/MP-mp-1218930.cif,True,,data/final/MP/graphs/Bi2Ca1Cu2Sr2O8.288-MP-mp-1218930-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Al0.308V0.692,3,0.116,8.0,False,Al2.464V5.536,Al2V6,0.0,Other,True,Al30.8V69.2,Al-V,2,Supercon,Al0.308V0.692,MP-mp-1387,Al2V6,Al-V,Al25V75,P m -3 n,cubic,4.809439,4.809439,4.809439,data/final/MP/cifs/Al0.308V0.692-MP-mp-1387-synth_doped.cif,data/source/MP/raw/cifs/mp-1387.cif,mp-1387,0.0,,2011-05-13 16:21:19,5.367846692804527,10.17188/1189788,"@misc{osti_1189788,
    author = ""Persson, Kristin"",
    title = ""Materials Data on AlV3 (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189788"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695894'}},0.0,6.44208835,520.0,-63.0685394,-7.883567425,"{'tags': ['Aluminium vanadium (1/3)', 'Aluminum vanadium (1/3)']}",-63.0685394,-7.883567425,-0.1342439149999998,"['xas', 'elasticity', 'bandstructure']",True,"[609619, 609614, 58200]",True,2021-05-12 10:56:12.755000,FM,8,9,mp-1387,,AlV3,"{'functional': 'PBE', 'labels': ['Al', 'V_pv'], 'pot_type': 'paw'}","{'Al': 1.0, 'V': 3.0}",GGA,mp-1387,"['mp-928632', 'mp-911987', 'mp-928179', 'mp-1387', 'mp-1252991', 'mp-1428170', 'mp-1695894', 'mp-1802978', 'mp-1594038']",0.17173495,"{'Al': 2.0, 'V': 6.0}",111.24570748494747,[],FM,True,131,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.0, 0.0, 0.0]",0.0030874890165669,0.17173495,2,0.3434699,MP,data/source/MP/cleaned/cifs/MP-mp-1387.cif,True,,data/final/MP/graphs/Al0.308V0.692-MP-mp-1387-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Pd9Se2,2,0.0363636363636363,0.8889444444444444,True,Pd8Se1.778,Pd8Se2,0.67,Other,True,Pd81.818Se18.182,Pd-Se,2,Supercon,Pd9Se2,MP-mp-7818,Pd8Se2,Pd-Se,Pd80Se20,P -4 21 c,tetragonal,5.314807,5.314807,5.762397,data/final/MP/cifs/Pd9Se2-MP-mp-7818-synth_doped.cif,data/source/MP/raw/cifs/mp-7818.cif,mp-7818,0.0,,2011-05-30 06:45:10,10.29633329731544,10.17188/1307580,"@misc{osti_1307580,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Pd4Se (SG:114) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1307580"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696479'}},0.0,5.07601896,520.0,-50.03404921,-5.003404921,{'tags': ['Palladium selenide (4/1)']},-50.03404921,-5.003404921,-0.2547171774687499,"['bandstructure', 'elasticity']",True,[23864],True,2021-05-12 10:56:31.128000,NM,10,8,mp-7818,,Pd4Se,"{'functional': 'PBE', 'labels': ['Pd', 'Se'], 'pot_type': 'paw'}","{'Pd': 4.0, 'Se': 1.0}",GGA,mp-7818,"['mp-913043', 'mp-7818', 'mp-929268', 'mp-930128', 'mp-1429762', 'mp-1696479', 'mp-1779253', 'mp-1601294']",9.195e-05,"{'Pd': 8.0, 'Se': 2.0}",162.7714275309073,[],NM,False,114,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.1298051678331617e-06,9.195e-05,0,0.0001839,MP,data/source/MP/cleaned/cifs/MP-mp-7818.cif,True,,data/final/MP/graphs/Pd9Se2-MP-mp-7818-synth_doped.json,0,True,-42m,0,0,0,0,6,0,0,1,0,0,0,1.0,False
B2Ho1Rh3,1,0.0,1.0,True,B2Ho1Rh3,B2Ho1Rh3,0.0,Other,True,B33.333Ho16.667Rh50,B-Ho-Rh,3,Supercon,Ho1Rh3B2,MP-mp-1025027,Ho1B2Rh3,B-Ho-Rh,B33.333Ho16.667Rh50,P 6/m m m,hexagonal,3.129264,5.427059996941941,5.427059279999999,data/final/MP/cifs/B2Ho1Rh3-MP-mp-1025027.cif,data/source/MP/raw/cifs/mp-1025027.cif,mp-1025027,0.0,,2016-09-27 06:24:39,10.30357839578025,10.17188/1355570,"@article{osti_1355570,
    author = ""Persson, Kristin"",
    title = ""Materials Data on HoB2Rh3 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1355570"",
    place = ""United States"",
    year = ""2017"",
    month = ""5""
}
",{'GGA': {'task_id': 'mp-1697067'}},0.0082234447549049,6.36399505,520.0,-44.27419584,-7.379032639999999,"{'tags': ['HoRh3B2', 'Holmium rhodium boride (1/3/2)', 'ErIr3B2']}",-44.27419584,-7.379032639999999,-0.7066799697222214,['bandstructure'],True,[614497],True,2021-05-12 10:58:09.072000,NM,6,5,mp-1025027,,HoB2Rh3,"{'functional': 'PBE', 'labels': ['Ho_3', 'B', 'Rh_pv'], 'pot_type': 'paw'}","{'Ho': 1.0, 'B': 2.0, 'Rh': 3.0}",GGA,mp-1025027,"['mp-1025027', 'mp-1434864', 'mp-1697067', 'mp-1801615', 'mp-1588506']",0.0011259,"{'Ho': 1.0, 'B': 2.0, 'Rh': 3.0}",79.81821387564696,[],NM,False,191,0,"[0, 0, 0, 0, 0, 0]",1.41058029907071e-05,0.0011259,0,0.0011259,MP,data/source/MP/cleaned/cifs/MP-mp-1025027.cif,False,,data/final/MP/graphs/B2Ho1Rh3-MP-mp-1025027.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Al0.18La0.82,3,0.1399999999999999,8.0,False,Al1.44La6.56,Al2La6,4.65,Other,True,Al18La82,Al-La,2,Supercon,Al0.18La0.82,MP-mp-1084828,La6Al2,Al-La,Al25La75,P 63/m m c,hexagonal,5.462619,7.265429996073226,7.26543004,data/final/MP/cifs/Al0.18La0.82-MP-mp-1084828-synth_doped.cif,data/source/MP/raw/cifs/mp-1084828.cif,mp-1084828,0.0,,2018-04-25 13:28:11,5.900819389809003,,,{'GGA': {'task_id': 'mp-1699786'}},0.0043635418749996,7.93832938,520.0,-38.71831372,-4.839789215,"{'tags': ['Lanthanum aluminium (3/1)', 'Lanthanum aluminide (3/1)']}",-38.71831372,-4.839789215,-0.2013899287500002,['bandstructure'],True,"[603210, 608280]",True,2021-05-12 10:58:18.470000,NM,8,6,mp-1084828,,La3Al,"{'functional': 'PBE', 'labels': ['La', 'Al'], 'pot_type': 'paw'}","{'La': 3.0, 'Al': 1.0}",GGA,mp-1084828,"['mp-1084828', 'mp-1095107', 'mp-1414408', 'mp-1699786', 'mp-1777076', 'mp-1599938']",0.00020505,"{'La': 6.0, 'Al': 2.0}",249.72049769665185,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.6422360350177154e-06,0.00020505,0,0.0004101,MP,data/source/MP/cleaned/cifs/MP-mp-1084828.cif,True,,data/final/MP/graphs/Al0.18La0.82-MP-mp-1084828-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ge1.9La1,2,0.0229885057471264,2.0,False,Ge3.8La2,Ge4La2,2.17,Other,True,Ge65.517La34.483,Ge-La,2,Supercon,Ge1.9La1,MP-mp-19761,La2Ge4,Ge-La,Ge66.667La33.333,I 41/a m d,tetragonal,4.320984000934922,4.320984000934921,8.41484573,data/final/MP/cifs/Ge1.9La1-MP-mp-19761-synth_doped.cif,data/source/MP/raw/cifs/mp-19761.cif,mp-19761,0.0,,2014-02-21 13:34:05,6.447172399329149,10.17188/1194966,"@misc{osti_1194966,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaGe2 (SG:141) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1194966"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703381'}},0.0059020154166642,6.2456377,520.0,-32.49839164,-5.416398606666667,"{'tags': ['Lanthanum germanide (1/2)', 'Germanium lanthanum (2/1)']}",-32.49839164,-5.416398606666667,-0.6890443350000002,"['xas', 'elasticity', 'bandstructure']",True,"[636796, 636784, 57072]",True,2021-05-12 10:56:14.760000,NM,6,6,mp-19761,,LaGe2,"{'functional': 'PBE', 'labels': ['La', 'Ge_d'], 'pot_type': 'paw'}","{'La': 1.0, 'Ge': 2.0}",GGA,mp-19761,"['mp-19761', 'mp-20013', 'mp-1438339', 'mp-1703381', 'mp-1780058', 'mp-1596448']",0.0002277,"{'La': 2.0, 'Ge': 4.0}",146.3900903733194,[],NM,False,141,0,"[0, 0, 0, 0, 0, 0]",3.110866308222457e-06,0.0002277,0,0.0004554,MP,data/source/MP/cleaned/cifs/MP-mp-19761.cif,True,,data/final/MP/graphs/Ge1.9La1-MP-mp-19761-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Si2U1,1,0.0,1.0,True,Si2U1,Si2U1,0.0,Heavy_fermion,True,Si66.667U33.333,Si-U,2,Supercon,Si2U1,MP-mp-980,U1Si2,Si-U,Si66.667U33.333,P 6/m m m,hexagonal,3.846914,4.023086000887019,4.02308628,data/final/MP/cifs/Si2U1-MP-mp-980.cif,data/source/MP/raw/cifs/mp-980.cif,mp-980,0.0,,2011-05-12 19:11:36,9.060034485863415,10.17188/1282246,"@misc{osti_1282246,
    author = ""Persson, Kristin"",
    title = ""Materials Data on USi2 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1282246"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686402'}},0.0238842437499995,10.78821121,520.0,-23.13288148,-7.710960493333334,"{'tags': ['Uranium silicide (1/2) - beta', 'Uranium silicide (1/2)']}",-23.13288148,-7.710960493333334,-0.2829478100000007,"['xas', 'elasticity', 'bandstructure']",True,"[31646, 652476, 652472, 52469, 106053]",True,2021-05-12 10:56:37.246000,FM,3,8,mp-980,,USi2,"{'functional': 'PBE', 'labels': ['U', 'Si'], 'pot_type': 'paw'}","{'U': 1.0, 'Si': 2.0}",GGA,mp-980,"['mp-920713', 'mp-921737', 'mp-980', 'mp-907259', 'mp-1440250', 'mp-1686402', 'mp-1793711', 'mp-1594700']",1.8299935,"{'U': 1.0, 'Si': 2.0}",53.92147730866471,[],FM,True,191,1,"[1.6, 0.0, 0.0]",0.0339381187485739,1.8299935,1,1.8299935,MP,data/source/MP/cleaned/cifs/MP-mp-980.cif,False,,data/final/MP/graphs/Si2U1-MP-mp-980.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
C1Ta0.8W0.2,1,0.0,5.0,False,C5Ta4W1,C5Ta4W1,9.92,Other,True,C50Ta40W10,C-Ta-W,3,Supercon,Ta0.8W0.2C1,MP-mp-1218023,Ta4W1C5,C-Ta-W,C50Ta40W10,R -3 m,trigonal,3.1520319864096,3.1520319864096,13.03974781,data/final/MP/cifs/C1Ta0.8W0.2-MP-mp-1218023.cif,data/source/MP/raw/cifs/mp-1218023.cif,mp-1218023,0.0,,2019-01-12 19:15:42.281000,14.46349193928727,,,{'GGA': {'task_id': 'mp-1754648'}},0.0842067070000016,8.43342723,520.0,-110.53653208,-11.053653208,{'tags': []},-110.53653208,-11.053653208,-0.4013391589999998,[],False,[],True,2021-05-12 11:00:42.526000,NM,10,4,mp-1218023,,Ta4WC5,"{'functional': 'PBE', 'labels': ['Ta_pv', 'W_pv', 'C'], 'pot_type': 'paw'}","{'Ta': 4.0, 'W': 1.0, 'C': 5.0}",GGA,mp-1218023,"['mp-1218023', 'mp-1407377', 'mp-1754648', 'mp-1802429']",0.0038004,"{'Ta': 4.0, 'W': 1.0, 'C': 5.0}",111.09895083557434,[],NM,False,166,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.420734373652695e-05,0.0038004,0,0.0038004,MP,data/source/MP/cleaned/cifs/MP-mp-1218023.cif,False,,data/final/MP/graphs/C1Ta0.8W0.2-MP-mp-1218023.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Al3V1,1,0.0,1.0,True,Al3V1,Al3V1,0.0,Other,True,Al75V25,Al-V,2,Supercon,Al3V1,MP-mp-2554,Al3V1,Al-V,Al75V25,I 4/m m m,tetragonal,3.76654800377088,3.76654800377088,4.93590348,data/final/MP/cifs/Al3V1-MP-mp-2554.cif,data/source/MP/raw/cifs/mp-2554.cif,mp-2554,0.0,,2011-05-12 18:49:57,3.714657278013145,10.17188/1200738,"@misc{osti_1200738,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Al3V (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1200738"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686535'}},0.0,8.07670278,520.0,-21.47317067,-5.3682926675,"{'tags': ['Vanadium aluminium (1/3)', 'Vanadium aluminide (1/3) - DO22', 'Aluminium vanadium (3/1)', 'Vanadium aluminide (1/3)', 'Aluminum vanadium (3/1)']}",-21.47317067,-5.3682926675,-0.2881342775000002,"['xas', 'elasticity', 'bandstructure']",True,"[609617, 167811, 609613, 58201, 151104]",True,2021-05-12 10:56:18.721000,NM,4,12,mp-2554,,Al3V,"{'functional': 'PBE', 'labels': ['Al', 'V_pv'], 'pot_type': 'paw'}","{'Al': 3.0, 'V': 1.0}",GGA,mp-2554,"['mp-911981', 'mp-928085', 'mp-928621', 'mp-2554', 'mp-1065815', 'mp-1065840', 'mp-1065881', 'mp-1440213', 'mp-1686535', 'mp-1794192', 'mp-1592421', 'mp-1065866']",2.5e-06,"{'Al': 3.0, 'V': 1.0}",58.9561919815033,[],NM,False,139,0,"[0, 0, 0, 0]",4.2404366971061174e-08,2.5e-06,0,2.5e-06,MP,data/source/MP/cleaned/cifs/MP-mp-2554.cif,False,,data/final/MP/graphs/Al3V1-MP-mp-2554.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Al1C1Y3,1,0.0,1.0,True,Al1C1Y3,Al1C1Y3,0.0,Other,True,Al20C20Y60,Al-C-Y,3,Supercon,Al1C1Y3,MP-mp-4448,Y3Al1C1,Al-C-Y,Al20C20Y60,P m -3 m,cubic,4.895271,4.895271,4.895271,data/final/MP/cifs/Al1C1Y3-MP-mp-4448.cif,data/source/MP/raw/cifs/mp-4448.cif,mp-4448,0.0762,,2011-05-12 22:57:48,4.327411797665297,10.17188/1208159,"@misc{osti_1208159,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Y3AlC (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208159"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703980'}},0.0,3.51410125,520.0,-34.46394036,-6.892788072,"{'tags': ['Yttrium aluminium carbide (3/1/1)', 'Aluminum yttrium carbide (1/3/1)']}",-34.46394036,-6.892788072,-0.4184340980000002,"['xas', 'elasticity', 'bandstructure']",True,"[606288, 43869]",True,2021-05-12 10:56:20.740000,NM,5,9,mp-4448,,Y3AlC,"{'functional': 'PBE', 'labels': ['Y_sv', 'Al', 'C'], 'pot_type': 'paw'}","{'Y': 3.0, 'Al': 1.0, 'C': 1.0}",GGA,mp-4448,"['mp-913566', 'mp-930442', 'mp-929924', 'mp-4448', 'mp-1262987', 'mp-1476137', 'mp-1703980', 'mp-1805057', 'mp-1596745']",0.0001558,"{'Y': 3.0, 'Al': 1.0, 'C': 1.0}",117.308698766826,[],NM,False,221,0,"[0, 0, 0, 0, 0]",1.3281197527361802e-06,0.0001558,0,0.0001558,MP,data/source/MP/cleaned/cifs/MP-mp-4448.cif,False,,data/final/MP/graphs/Al1C1Y3-MP-mp-4448.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
C1La3Sn1,1,0.0,1.0,True,C1La3Sn1,C1La3Sn1,0.0,Other,True,C20La60Sn20,C-La-Sn,3,Supercon,La3Sn1C1,MP-mp-1206443,La3Sn1C1,C-La-Sn,C20La60Sn20,P m -3 m,cubic,5.217808,5.217808,5.217808,data/final/MP/cifs/C1La3Sn1-MP-mp-1206443.cif,data/source/MP/raw/cifs/mp-1206443.cif,mp-1206443,0.0,,2019-01-12 09:45:11.926000,6.3991022372065824,,,{'GGA': {'task_id': 'mp-1760114'}},0.0,7.95345532,520.0,-30.49765298,-6.099530596,"{'tags': ['CaTiO3', 'perovskite', 'La3SnC']}",-30.49765298,-6.099530596,-0.4906558220000001,['bandstructure'],True,[],True,2021-05-12 10:58:37.524000,NM,5,5,mp-1206443,,La3SnC,"{'functional': 'PBE', 'labels': ['La', 'Sn_d', 'C'], 'pot_type': 'paw'}","{'La': 3.0, 'Sn': 1.0, 'C': 1.0}",GGA,mp-1206443,"['mp-1206443', 'mp-1403112', 'mp-1760114', 'mp-1779251', 'mp-1625543']",0.0039367,"{'La': 3.0, 'Sn': 1.0, 'C': 1.0}",142.05753775523797,[],NM,False,221,0,"[0, 0, 0, 0, 0]",2.7712010655730555e-05,0.0039367,0,0.0039367,MP,data/source/MP/cleaned/cifs/MP-mp-1206443.cif,False,,data/final/MP/graphs/C1La3Sn1-MP-mp-1206443.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba1Rh2,1,0.0,2.0,False,Ba2Rh4,Ba2Rh4,6.0,Other,True,Ba33.333Rh66.667,Ba-Rh,2,Supercon,Ba1Rh2,MP-mp-568430,Ba2Rh4,Ba-Rh,Ba33.333Rh66.667,F d -3 m,cubic,5.6363128,5.6363128,5.6363128,data/final/MP/cifs/Ba1Rh2-MP-mp-568430.cif,data/source/MP/raw/cifs/mp-568430.cif,mp-568430,0.0,,2015-02-18 17:52:32,9.000728160618818,10.17188/1274434,"@misc{osti_1274434,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BaRh2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1274434"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695291'}},0.0,4.31692825,520.0,-33.84048079,-5.640080131666667,{'tags': ['Barium rhodium (1/2)']},-33.84048079,-5.640080131666667,-0.090884608333333,"['xas', 'elasticity', 'bandstructure']",True,[108149],True,2021-05-12 10:56:22.739000,NM,6,8,mp-568430,,BaRh2,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Rh_pv'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Rh': 2.0}",GGA,mp-568430,"['mp-934073', 'mp-944127', 'mp-944760', 'mp-568430', 'mp-1425205', 'mp-1695291', 'mp-1790398', 'mp-1590637']",0.12146935,"{'Ba': 2.0, 'Rh': 4.0}",126.6106572861581,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",0.0019187855525536,0.12146935,0,0.2429387,MP,data/source/MP/cleaned/cifs/MP-mp-568430.cif,False,,data/final/MP/graphs/Ba1Rh2-MP-mp-568430.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
B2Mg0.8Na0.2,3,0.1333333333333333,1.0,True,B2Mg0.8Na0.2,B2Mg1,38.0,Other,True,B66.667Mg26.667Na6.667,B-Mg-Na,3,Supercon,Mg0.8Na0.2B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B2Mg0.8Na0.2-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B2Mg0.8Na0.2-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
As2Ca0.67Fe2Sr0.33,2,0.0013333333333333,3.0,False,As6Ca2.01Fe6Sr0.99,As6Ca2Fe6Sr1,22.0,Ferrite,True,As40Ca13.4Fe40Sr6.6,As-Ca-Fe-Sr,4,Supercon,Ca0.67Sr0.33Fe2As2,MP-mp-1218636,Sr1Ca2Fe6As6,As-Ca-Fe-Sr,As40Ca13.333Fe40Sr6.667,C 1 2/m 1,monoclinic,5.65299345,6.06030486,8.306952490526944,data/final/MP/cifs/As2Ca0.67Fe2Sr0.33-MP-mp-1218636-synth_doped.cif,data/source/MP/raw/cifs/mp-1218636.cif,mp-1218636,0.0,,2019-01-12 19:46:17.532000,6.142997671058096,,,,0.0116228086666678,5.57630932,520.0,-92.31986196,-6.154657464,{'tags': []},-92.31986196,-6.154657464,-0.5229605077777781,[],False,[],True,2021-05-12 11:00:42.526000,FiM,15,2,mp-1218636,,SrCa2(FeAs)6,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Ca': 2.0, 'Fe': 6.0, 'As': 6.0}",GGA,mp-1218636,"['mp-1218636', 'mp-1866184']",0.0025746,"{'Sr': 1.0, 'Ca': 2.0, 'Fe': 6.0, 'As': 6.0}",257.4405810582406,[],FiM,True,1,2,"[-0.0, -0.0, -0.0, -0.2, 0.1, 0.3, -0.0, -0.2, 0.1, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",1.0000754307719458e-05,0.0025746,5,0.0025746,MP,data/source/MP/cleaned/cifs/MP-mp-1218636.cif,True,,data/final/MP/graphs/As2Ca0.67Fe2Sr0.33-MP-mp-1218636-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
B2C1Er1Fe0.12Ni1.88,2,0.04,1.0,True,B2C1Er1Fe0.12Ni1.88,B2C1Er1Ni2,0.0,Other,True,B33.333C16.667Er16.667Fe2Ni31.333,B-C-Er-Fe-Ni,5,Supercon,Er1Ni1.88Fe0.12B2C1,MP-mp-6098,Er1Ni2B2C1,B-C-Er-Ni,B33.333C16.667Er16.667Ni33.333,I 4/m m m,tetragonal,3.5122880026935177,3.5122880026935173,5.77805085,data/final/MP/cifs/B2C1Er1Fe0.12Ni1.88-MP-mp-6098-synth_doped.cif,data/source/MP/raw/cifs/mp-6098.cif,mp-6098,0.0,,2011-05-13 04:24:02,8.212015229638553,10.17188/1277667,"@misc{osti_1277667,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ErNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277667"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700042'}},0.0,6.72687579,520.0,-41.84324782,-6.973874636666667,{'tags': []},-41.84324782,-6.973874636666667,-0.5216152347222227,"['xas', 'elasticity', 'bandstructure']",True,"[246431, 79576, 56651]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-6098,,ErNi2B2C,"{'functional': 'PBE', 'labels': ['Er_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Er': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6098,"['mp-1006980', 'mp-1000513', 'mp-6098', 'mp-1441533', 'mp-1700042', 'mp-1793903', 'mp-1011723', 'mp-1589040']",0.0020747,"{'Er': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",64.35860973581151,[],NM,False,139,0,"[0.0, -0.0, -0.0, 0.0, 0.0, 0.0]",3.2236557136900987e-05,0.0020747,0,0.0020747,MP,data/source/MP/cleaned/cifs/MP-mp-6098.cif,True,,data/final/MP/graphs/B2C1Er1Fe0.12Ni1.88-MP-mp-6098-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ba2Co1Cu2Pr1O7.33,2,0.022851866812857,0.9549959072305594,True,Ba1.91Co0.955Cu1.91Pr0.955O7,Ba2Co1Cu2Pr1O7,0.0,Cuprate,True,Ba15.004Co7.502Cu15.004Pr7.502O54.9887471867967,Ba-Co-Cu-Pr-O,5,Supercon,Pr1Ba2Cu2Co1O7.33,MP-mp-1214590,Ba2Pr1Co1Cu2O7,Ba-Co-Cu-Pr-O,Ba15.385Co7.692Cu15.385Pr7.692O53.84615384615385,P m m m,orthorhombic,3.924367,3.945862,11.95319,data/final/MP/cifs/Ba2Co1Cu2Pr1O7.33-MP-mp-1214590-synth_doped.cif,data/source/MP/raw/cifs/mp-1214590.cif,mp-1214590,0.0,,2019-01-12 16:24:29.366000,6.401740212584317,,,{'GGA+U': {'task_id': 'mp-1743256'}},0.0302664991025629,3.32999013,520.0,-80.54801208,-6.196000929230769,"{'tags': ['Ba2Cu2(Cu0.89Al0.11)YO7', 'high-Tc cuprate family', 'Ba2Cu2PrCoO7']}",-80.54801208,-6.196000929230769,-2.187208700384616,[],False,[],True,2021-05-12 11:00:37.845000,FM,13,4,mp-1214590,oxide,Ba2PrCoCu2O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Pr_3', 'Co', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Pr': 1.0, 'Co': 1.0, 'Cu': 2.0, 'O': 7.0}",GGA+U,mp-1214590,"['mp-1214590', 'mp-1400781', 'mp-1743256', 'mp-1831832']",2.4579545,"{'Ba': 2.0, 'Pr': 1.0, 'Co': 1.0, 'Cu': 2.0, 'O': 7.0}",185.09527408515603,[],FM,True,47,1,"[0.0, 0.0, 0.0, 2.2, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0132794017143256,2.4579545,1,2.4579545,MP,data/source/MP/cleaned/cifs/MP-mp-1214590.cif,True,,data/final/MP/graphs/Ba2Co1Cu2Pr1O7.33-MP-mp-1214590-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ge13Ru4Y3,1,0.0,2.0,False,Ge26Ru8Y6,Ge26Ru8Y6,2.116666667,Other,True,Ge65Ru20Y15,Ge-Ru-Y,3,Supercon,Y3Ru4Ge13,MP-mp-704462,Y6Ge26Ru8,Ge-Ru-Y,Ge65Ru20Y15,P m -3 n,cubic,9.007798,9.007798,9.007798,data/final/MP/cifs/Ge13Ru4Y3-MP-mp-704462.cif,data/source/MP/raw/cifs/mp-704462.cif,mp-704462,0.0,,2013-12-13 09:27:22,7.339746982184395,10.17188/1285724,"@misc{osti_1285724,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Y3Ge13Ru4 (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1285724"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",,0.0217381694999998,4.94244075,520.0,-250.9172689,-6.2729317225,"{'tags': ['Germanium ruthenium yttrium (13/4/3)', 'Ruthenium yttrium germanide (3/4/13)']}",-250.9172689,-6.2729317225,-0.4431150187500002,[],False,"[53900, 637773]",True,2021-05-12 11:01:44.406000,NM,40,4,mp-704462,,Y3Ge13Ru4,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ge_d', 'Ru_pv'], 'pot_type': 'paw'}","{'Y': 3.0, 'Ge': 13.0, 'Ru': 4.0}",GGA,mp-704462,"['mp-704462', 'mp-996543', 'mp-1367703', 'mp-1867659']",0.0450415,"{'Y': 6.0, 'Ge': 26.0, 'Ru': 8.0}",730.8965563118949,[],NM,False,223,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001232499992263,0.0450415,0,0.090083,MP,data/source/MP/cleaned/cifs/MP-mp-704462.cif,False,,data/final/MP/graphs/Ge13Ru4Y3-MP-mp-704462.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Cu4Tb0.1Y0.9O8,2,0.0133333333333333,1.0,True,Ba2Cu4Tb0.1Y0.9O8,Ba2Cu4Y1O8,78.0,Cuprate,True,Ba13.333Cu26.667Tb0.667Y6O53.333333333333336,Ba-Cu-Tb-Y-O,5,Supercon,Y0.9Tb0.1Ba2Cu4O8,MP-mp-6790,Ba2Y1Cu4O8,Ba-Cu-Y-O,Ba13.333Cu26.667Y6.667O53.333333333333336,C m m m,orthorhombic,3.889922,3.899603999537882,13.88942687,data/final/MP/cifs/Ba2Cu4Tb0.1Y0.9O8-MP-mp-6790-synth_doped.cif,data/source/MP/raw/cifs/mp-6790.cif,mp-6790,0.0,,2011-05-16 03:21:24,5.936250568336678,10.17188/1283441,"@misc{osti_1283441,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Y(CuO2)4 (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1283441"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686864'}},0.0,3.31391536,520.0,-91.58381472,-6.105587648,"{'tags': ['Yttrium barium copper oxide (1/2/4/8)', 'High pressure experimental phase']}",-91.58381472,-6.105587648,-2.0529924817777783,"['xas', 'bandstructure']",True,"[72261, 85273, 74251, 400273, 85277, 85275, 400280, 67632, 85272, 67631, 83920, 66613, 85279, 400277, 75689, 74259, 85278, 85280, 66603, 94265, 400276, 88873, 71417, 75712, 97052, 66605, 72258, 85281, 85274, 400279, 66604, 69698]",True,2021-05-12 10:57:34.594000,NM,15,10,mp-6790,oxide,Ba2Y(CuO2)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-6790,"['mp-1000664', 'mp-6790', 'mp-1007136', 'mp-1237713', 'mp-1440937', 'mp-1686864', 'mp-1834179', 'mp-1011883', 'mp-1590064', 'mp-1590433']",0.0004643,"{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",208.60454115924333,[],NM,False,65,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.225742533790601e-06,0.0004643,0,0.0004643,MP,data/source/MP/cleaned/cifs/MP-mp-6790.cif,True,,data/final/MP/graphs/Ba2Cu4Tb0.1Y0.9O8-MP-mp-6790-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ho1P2Pd2,1,0.0,1.0,True,Ho1P2Pd2,Ho1P2Pd2,0.0,Other,True,Ho20P40Pd40,Ho-P-Pd,3,Supercon,Ho1Pd2P2,MP-mp-1207099,Ho1P2Pd2,Ho-P-Pd,Ho20P40Pd40,I 4/m m m,tetragonal,4.086756000042112,4.086756000042112,5.73169236,data/final/MP/cifs/Ho1P2Pd2-MP-mp-1207099.cif,data/source/MP/raw/cifs/mp-1207099.cif,mp-1207099,0.0,,2019-01-12 10:16:36.271000,8.832209141060652,,,{'GGA': {'task_id': 'mp-1758960'}},0.0265878564545474,7.03773945,520.0,-30.35090712,-6.070181423999999,"{'tags': ['HoPd2P2', 'CeAl2Ga2']}",-30.35090712,-6.070181423999999,-0.9164259233333332,['bandstructure'],True,[],True,2021-05-12 10:58:39.488000,NM,5,5,mp-1207099,,Ho(PPd)2,"{'functional': 'PBE', 'labels': ['Ho_3', 'P', 'Pd'], 'pot_type': 'paw'}","{'Ho': 1.0, 'P': 2.0, 'Pd': 2.0}",GGA,mp-1207099,"['mp-1207099', 'mp-1400804', 'mp-1758960', 'mp-1781447', 'mp-1584776']",0.0003892,"{'Ho': 1.0, 'P': 2.0, 'Pd': 2.0}",82.67112413004286,[],NM,False,139,0,"[0, 0, 0, 0, 0]",4.707810666609333e-06,0.0003892,0,0.0003892,MP,data/source/MP/cleaned/cifs/MP-mp-1207099.cif,False,,data/final/MP/graphs/Ho1P2Pd2-MP-mp-1207099.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ge2Ni2Sr1,1,0.0,1.0,True,Ge2Ni2Sr1,Ge2Ni2Sr1,0.8825,Other,True,Ge40Ni40Sr20,Ge-Ni-Sr,3,Supercon,Sr1Ni2Ge2,MP-mp-3207,Sr1Ni2Ge2,Ge-Ni-Sr,Ge40Ni40Sr20,I 4/m m m,tetragonal,4.192939997960237,4.192939997960237,5.94197649,data/final/MP/cifs/Ge2Ni2Sr1-MP-mp-3207.cif,data/source/MP/raw/cifs/mp-3207.cif,mp-3207,0.0,,2011-05-13 16:03:21,6.425038586998117,10.17188/1206084,"@misc{osti_1206084,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr(NiGe)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1206084"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678141'}},0.0,5.59373347,520.0,-25.04557336,-5.009114672,"{'tags': ['Nickel strontium germanide (2/1/2)', 'Strontium nickel germanide (1/2/2)']}",-25.04557336,-5.009114672,-0.5099501673333329,"['xas', 'elasticity', 'bandstructure']",True,"[168134, 409, 637397, 165736]",True,2021-05-12 10:56:20.740000,NM,5,8,mp-3207,,Sr(NiGe)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ni_pv', 'Ge_d'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Ni': 2.0, 'Ge': 2.0}",GGA,mp-3207,"['mp-921918', 'mp-922175', 'mp-907539', 'mp-3207', 'mp-1437846', 'mp-1678141', 'mp-1783300', 'mp-1595447']",0.0027345,"{'Sr': 1.0, 'Ni': 2.0, 'Ge': 2.0}",90.5309607153759,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",3.0205136214086027e-05,0.0027345,0,0.0027345,MP,data/source/MP/cleaned/cifs/MP-mp-3207.cif,False,,data/final/MP/graphs/Ge2Ni2Sr1-MP-mp-3207.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As12La1Os4,1,0.0,1.0,True,As12La1Os4,As12La1Os4,3.2,Other,True,As70.588La5.882Os23.529,As-La-Os,3,Supercon,La1Os4As12,MP-mp-1105556,La1As12Os4,As-La-Os,As70.588La5.882Os23.529,I m -3,cubic,7.49615135166178,7.49615135,7.49615135,data/final/MP/cifs/As12La1Os4-MP-mp-1105556.cif,data/source/MP/raw/cifs/mp-1105556.cif,mp-1105556,0.0,,2018-07-19 04:47:27,9.212113270663604,,,{'GGA': {'task_id': 'mp-1670285'}},0.0,6.00926602,520.0,-112.06893226,-6.5922901329411765,"{'tags': ['LaOs4As12', 'Lanthanum osmium arsenide (1/4/12)', 'LaFe4P12']}",-112.06893226,-6.5922901329411765,-0.3714140749999999,['bandstructure'],True,[610776],True,2021-05-12 10:58:22.271000,NM,17,5,mp-1105556,,La(As3Os)4,"{'functional': 'PBE', 'labels': ['La', 'As', 'Os_pv'], 'pot_type': 'paw'}","{'La': 1.0, 'As': 12.0, 'Os': 4.0}",GGA,mp-1105556,"['mp-1105556', 'mp-1432489', 'mp-1670285', 'mp-1807489', 'mp-1605040']",0.0002069,"{'La': 1.0, 'As': 12.0, 'Os': 4.0}",324.25982867095905,[],NM,False,204,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.380685539988695e-07,0.0002069,0,0.0002069,MP,data/source/MP/cleaned/cifs/MP-mp-1105556.cif,False,,data/final/MP/graphs/As12La1Os4-MP-mp-1105556.json,0,True,m-3,2,0,0,0,0,0,0,0,0,1,0,1.0,False
Al0.03B2Mg0.97,2,0.02,1.0,True,Al0.03B2Mg0.97,B2Mg1,37.3,Other,True,Al1B66.667Mg32.333,Al-B-Mg,3,Supercon,Mg0.97Al0.03B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/Al0.03B2Mg0.97-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/Al0.03B2Mg0.97-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Pd2Sb2Sr1,1,0.0,2.0,False,Pd4Sb4Sr2,Pd4Sb4Sr2,1.25,Other,True,Pd40Sb40Sr20,Pd-Sb-Sr,3,Supercon,Sr1Pd2Sb2,MP-mp-8468,Sr2Sb4Pd4,Pd-Sb-Sr,Pd40Sb40Sr20,P 4/n m m,tetragonal,4.715026,4.715026,10.796684,data/final/MP/cifs/Pd2Sb2Sr1-MP-mp-8468.cif,data/source/MP/raw/cifs/mp-8468.cif,mp-8468,0.0,,2011-05-29 12:00:00,7.526679987587866,10.17188/1308121,"@misc{osti_1308121,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr(SbPd)2 (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1308121"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696235'}},0.0,5.83327477,520.0,-48.40794507,-4.840794507,"{'tags': ['Palladium strontium antimonide (2/1/2)', 'Strontium palladium antimonide (1/2/2) - low-temperature modification']}",-48.40794507,-4.840794507,-0.8561425963333334,"['bandstructure', 'elasticity']",True,"[604349, 61194]",True,2021-05-12 10:56:31.128000,NM,10,8,mp-8468,,Sr(SbPd)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Sb', 'Pd'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Sb': 2.0, 'Pd': 2.0}",GGA,mp-8468,"['mp-907709', 'mp-8468', 'mp-922301', 'mp-922012', 'mp-1426941', 'mp-1696235', 'mp-1777596', 'mp-1599199']",0.00598675,"{'Sr': 2.0, 'Sb': 4.0, 'Pd': 4.0}",240.02615839618167,[],NM,False,129,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.988414629474182e-05,0.00598675,0,0.0119735,MP,data/source/MP/cleaned/cifs/MP-mp-8468.cif,False,,data/final/MP/graphs/Pd2Sb2Sr1-MP-mp-8468.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ba2Cu4Eu0.25Y0.75O8,3,0.0333333333333333,1.0,True,Ba2Cu4Eu0.25Y0.75O8,Ba2Cu4Y1O8,78.0,Cuprate,True,Ba13.333Cu26.667Eu1.667Y5O53.333333333333336,Ba-Cu-Eu-Y-O,5,Supercon,Y0.75Eu0.25Ba2Cu4O8,MP-mp-6790,Ba2Y1Cu4O8,Ba-Cu-Y-O,Ba13.333Cu26.667Y6.667O53.333333333333336,C m m m,orthorhombic,3.889922,3.899603999537882,13.88942687,data/final/MP/cifs/Ba2Cu4Eu0.25Y0.75O8-MP-mp-6790-synth_doped.cif,data/source/MP/raw/cifs/mp-6790.cif,mp-6790,0.0,,2011-05-16 03:21:24,5.936250568336678,10.17188/1283441,"@misc{osti_1283441,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Y(CuO2)4 (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1283441"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686864'}},0.0,3.31391536,520.0,-91.58381472,-6.105587648,"{'tags': ['Yttrium barium copper oxide (1/2/4/8)', 'High pressure experimental phase']}",-91.58381472,-6.105587648,-2.0529924817777783,"['xas', 'bandstructure']",True,"[72261, 85273, 74251, 400273, 85277, 85275, 400280, 67632, 85272, 67631, 83920, 66613, 85279, 400277, 75689, 74259, 85278, 85280, 66603, 94265, 400276, 88873, 71417, 75712, 97052, 66605, 72258, 85281, 85274, 400279, 66604, 69698]",True,2021-05-12 10:57:34.594000,NM,15,10,mp-6790,oxide,Ba2Y(CuO2)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-6790,"['mp-1000664', 'mp-6790', 'mp-1007136', 'mp-1237713', 'mp-1440937', 'mp-1686864', 'mp-1834179', 'mp-1011883', 'mp-1590064', 'mp-1590433']",0.0004643,"{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",208.60454115924333,[],NM,False,65,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.225742533790601e-06,0.0004643,0,0.0004643,MP,data/source/MP/cleaned/cifs/MP-mp-6790.cif,True,,data/final/MP/graphs/Ba2Cu4Eu0.25Y0.75O8-MP-mp-6790-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Cu3Sn1,1,0.0,2.0,False,Cu6Sn2,Cu6Sn2,0.0,Other,True,Cu75Sn25,Cu-Sn,2,Supercon,Cu3Sn1,MP-mp-13138,Cu6Sn2,Cu-Sn,Cu75Sn25,P 63/m m c,hexagonal,4.349665,5.540460003793306,5.54045991,data/final/MP/cifs/Cu3Sn1-MP-mp-13138.cif,data/source/MP/raw/cifs/mp-13138.cif,mp-13138,0.0,,2011-06-04 08:14:21,8.88481370954905,10.17188/1189408,"@misc{osti_1189408,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Cu3Sn (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189408"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701654'}},0.0119013687500002,8.51612743,520.0,-32.61241801,-4.07655225125,{'tags': ['Copper tin (3/1)']},-32.61241801,-4.07655225125,0.0002457150000001,"['xas', 'elasticity', 'bandstructure']",True,[162569],True,2021-05-12 10:56:12.755000,NM,8,8,mp-13138,,Cu3Sn,"{'functional': 'PBE', 'labels': ['Cu_pv', 'Sn_d'], 'pot_type': 'paw'}","{'Cu': 3.0, 'Sn': 1.0}",GGA,mp-13138,"['mp-920121', 'mp-919081', 'mp-906310', 'mp-13138', 'mp-1420922', 'mp-1701654', 'mp-1925297', 'mp-1588029']",0.0004278,"{'Cu': 6.0, 'Sn': 2.0}",115.63201119737352,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",7.399335107469221e-06,0.0004278,0,0.0008556,MP,data/source/MP/cleaned/cifs/MP-mp-13138.cif,False,,data/final/MP/graphs/Cu3Sn1-MP-mp-13138.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Pd2Sn1Tm0.05Y0.95,2,0.025,1.0,True,Pd2Sn1Tm0.05Y0.95,Pd2Sn1Y1,4.12,Other,True,Pd50Sn25Tm1.25Y23.75,Pd-Sn-Tm-Y,4,Supercon,Pd2Y0.95Tm0.05Sn1,MP-mp-5538,Y1Sn1Pd2,Pd-Sn-Y,Pd50Sn25Y25,F m -3 m,cubic,4.81595014,4.81595014,4.81595014,data/final/MP/cifs/Pd2Sn1Tm0.05Y0.95-MP-mp-5538-synth_doped.cif,data/source/MP/raw/cifs/mp-5538.cif,mp-5538,0.0,,2011-05-13 01:04:13,8.839720826473608,10.17188/1267618,"@misc{osti_1267618,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YSnPd2 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1267618"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687523'}},0.0,6.33853657,520.0,-24.32859047,-6.0821476175,"{'tags': ['Palladium yttrium stannide (2/1/1)', 'Palladium tin yttrium (2/1/1)']}",-24.32859047,-6.0821476175,-0.873195970416667,"['xas', 'elasticity', 'bandstructure']",True,"[105699, 648949, 105700, 424011, 648950]",True,2021-05-12 10:56:22.739000,NM,4,12,mp-5538,,YSnPd2,"{'functional': 'PBE', 'labels': ['Y_sv', 'Sn_d', 'Pd'], 'pot_type': 'paw'}","{'Y': 1.0, 'Sn': 1.0, 'Pd': 2.0}",GGA,mp-5538,"['mp-1008093', 'mp-1001657', 'mp-5538', 'mp-1065654', 'mp-1065644', 'mp-1065683', 'mp-1439031', 'mp-1687523', 'mp-1801498', 'mp-1012418', 'mp-1593849', 'mp-1065696']",0.0001592,"{'Y': 1.0, 'Sn': 1.0, 'Pd': 2.0}",78.98251295612837,[],NM,False,225,0,"[0, 0, 0, 0]",2.015636044505563e-06,0.0001592,0,0.0001592,MP,data/source/MP/cleaned/cifs/MP-mp-5538.cif,True,,data/final/MP/graphs/Pd2Sn1Tm0.05Y0.95-MP-mp-5538-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Bi1La1,1,0.0,1.0,True,Bi1La1,Bi1La1,0.0,Other,True,Bi50La50,Bi-La,2,Supercon,Bi1La1,MP-mp-22926,La1Bi1,Bi-La,Bi50La50,F m -3 m,cubic,4.716204239999999,4.716204239999999,4.716204239999999,data/final/MP/cifs/Bi1La1-MP-mp-22926.cif,data/source/MP/raw/cifs/mp-22926.cif,mp-22926,0.0,,2014-02-21 07:23:45,7.787948508125181,10.17188/1199091,"@misc{osti_1199091,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaBi (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199091"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686546'}},0.0,6.03660757,520.0,-10.92084065,-5.460420325,{'tags': ['Bismuth lanthanum (1/1)']},-10.92084065,-5.460420325,-1.0473996175000009,"['xas', 'bandstructure']",True,"[58795, 616762, 616768, 616754]",True,2021-05-12 10:56:59.077000,NM,2,8,mp-22926,,LaBi,"{'functional': 'PBE', 'labels': ['La', 'Bi'], 'pot_type': 'paw'}","{'La': 1.0, 'Bi': 1.0}",GGA,mp-22926,"['mp-912123', 'mp-928719', 'mp-928245', 'mp-22926', 'mp-1440359', 'mp-1686546', 'mp-1800879', 'mp-1590384']",0.0017392,"{'La': 1.0, 'Bi': 1.0}",74.17589847319051,[],NM,False,225,0,"[0, 0]",2.3446969107204023e-05,0.0017392,0,0.0017392,MP,data/source/MP/cleaned/cifs/MP-mp-22926.cif,False,,data/final/MP/graphs/Bi1La1-MP-mp-22926.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Be12Nb1,1,0.0,1.0,True,Be12Nb1,Be12Nb1,0.0,Other,True,Be92.308Nb7.692,Be-Nb,2,Supercon,Be12Nb1,MP-mp-568912,Be12Nb1,Be-Nb,Be92.308Nb7.692,I 4/m m m,tetragonal,4.213037996694173,5.588288969117814,5.58828897,data/final/MP/cifs/Be12Nb1-MP-mp-568912.cif,data/source/MP/raw/cifs/mp-568912.cif,mp-568912,0.0,,2014-02-24 18:46:53,2.957777323731848,10.17188/1274803,"@misc{osti_1274803,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Be12Nb (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1274803"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697637'}},0.0,4.48906701,520.0,-56.90358523,-4.377198863846154,"{'tags': ['Beryllium niobium (12/1)', 'Niobium beryllium (1/12)']}",-56.90358523,-4.377198863846154,-0.1484096776923078,"['xas', 'elasticity', 'bandstructure']",True,"[150601, 616353]",True,2021-05-12 10:56:22.739000,NM,13,8,mp-568912,,Be12Nb,"{'functional': 'PBE', 'labels': ['Be_sv', 'Nb_pv'], 'pot_type': 'paw'}","{'Be': 12.0, 'Nb': 1.0}",GGA,mp-568912,"['mp-1007554', 'mp-1001179', 'mp-568912', 'mp-1416144', 'mp-1697637', 'mp-1923177', 'mp-1012315', 'mp-1599767']",0.003974,"{'Be': 12.0, 'Nb': 1.0}",112.87382396348512,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.5207454310094044e-05,0.003974,0,0.003974,MP,data/source/MP/cleaned/cifs/MP-mp-568912.cif,False,,data/final/MP/graphs/Be12Nb1-MP-mp-568912.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
C1Fe0.015Mg1Ni2.985,2,0.006,1.0,True,C1Fe0.015Mg1Ni2.985,C1Mg1Ni3,5.96,Other,True,C20Fe0.3Mg20Ni59.7,C-Fe-Mg-Ni,4,Supercon,Mg1C1Ni2.985Fe0.015,MP-mp-10700,Mg1Ni3C1,C-Mg-Ni,C20Mg20Ni60,P m -3 m,cubic,3.810209,3.810209,3.810209,data/final/MP/cifs/C1Fe0.015Mg1Ni2.985-MP-mp-10700-synth_doped.cif,data/source/MP/raw/cifs/mp-10700.cif,mp-10700,0.0,,2011-05-28 10:04:44,6.376007671789427,10.17188/1187303,"@misc{osti_1187303,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MgNi3C (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187303"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678621'}},0.0,6.64260176,520.0,-28.85099542,-5.770199084,{'tags': ['Magnesium nickel carbide (1/3/1)']},-28.85099542,-5.770199084,-0.1367049259999994,"['xas', 'elasticity', 'bandstructure']",True,[77152],True,2021-05-12 10:56:10.715000,NM,5,8,mp-10700,,MgNi3C,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Ni_pv', 'C'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",GGA,mp-10700,"['mp-927245', 'mp-927653', 'mp-911184', 'mp-10700', 'mp-1438083', 'mp-1678621', 'mp-1791467', 'mp-1591421']",0.0387875,"{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",55.31544309398296,[],NM,False,221,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",0.0007012056277683,0.0387875,0,0.0387875,MP,data/source/MP/cleaned/cifs/MP-mp-10700.cif,True,,data/final/MP/graphs/C1Fe0.015Mg1Ni2.985-MP-mp-10700-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
B0.15P0.85Ru1Zr1,3,0.1,4.0,False,B0.6P3.4Ru4Zr4,P4Ru4Zr4,6.4,Other,True,B5P28.333Ru33.333Zr33.333,B-P-Ru-Zr,4,Supercon,Zr1Ru1P0.85B0.15,MP-mp-22268,Zr4P4Ru4,P-Ru-Zr,P33.333Ru33.333Zr33.333,P n m a,orthorhombic,3.896771,6.476559,7.378435,data/final/MP/cifs/B0.15P0.85Ru1Zr1-MP-mp-22268-synth_doped.cif,data/source/MP/raw/cifs/mp-22268.cif,mp-22268,0.0,,2014-02-22 18:40:36,7.963823777103373,10.17188/1197495,"@misc{osti_1197495,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrPRu (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197495"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677547'}},0.0,7.91938263,520.0,-106.40582437,-8.867152030833333,"{'tags': ['Ruthenium zirconium phosphide (1/1/1)', 'Zirconium ruthenium phosphide (1/1/1)']}",-106.40582437,-8.867152030833333,-1.1220211002777785,"['xas', 'elasticity', 'bandstructure']",True,"[648038, 30727]",True,2021-05-12 10:56:16.728000,NM,12,9,mp-22268,,ZrPRu,"{'functional': 'PBE', 'labels': ['Zr_sv', 'P', 'Ru_pv'], 'pot_type': 'paw'}","{'Zr': 1.0, 'P': 1.0, 'Ru': 1.0}",GGA,mp-22268,"['mp-921696', 'mp-907212', 'mp-920689', 'mp-22268', 'mp-1102635', 'mp-1442687', 'mp-1677547', 'mp-1785321', 'mp-1602314']",3.01e-05,"{'Zr': 4.0, 'P': 4.0, 'Ru': 4.0}",186.21448765818843,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.46566233992512e-07,3.01e-05,0,0.0001204,MP,data/source/MP/cleaned/cifs/MP-mp-22268.cif,True,,data/final/MP/graphs/B0.15P0.85Ru1Zr1-MP-mp-22268-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ca1.76Cl2Cu1Na0.24O2,3,0.0685714285714285,1.0,True,Ca1.76Cl2Cu1Na0.24O2,Ca2Cl2Cu1O2,26.9,Cuprate,True,Ca25.143Cl28.571Cu14.286Na3.429O28.571428571428573,Ca-Cl-Cu-Na-O,5,Supercon,Ca1.76Na0.24Cu1Cl2O2,MP-mp-23143,Ca2Cu1Cl2O2,Ca-Cl-Cu-O,Ca28.571Cl28.571Cu14.286O28.571428571428573,I 4/m m m,tetragonal,3.88024600076171,3.880246000761709,8.12907187,data/final/MP/cifs/Ca1.76Cl2Cu1Na0.24O2-MP-mp-23143-synth_doped.cif,data/source/MP/raw/cifs/mp-23143.cif,mp-23143,0.0,,2014-02-21 09:50:06,3.554337150605878,10.17188/1199263,"@misc{osti_1199263,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ca2Cu(ClO)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199263"",
    place = ""United States"",
    year = ""2016"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700223'}},0.0191527683333321,4.19679796,520.0,-35.95348475,-5.136212107142858,"{'tags': ['Dicalcium copper dioxide dichloride', 'Dicalcium dichlorodioxocuprate']}",-35.95348475,-5.136212107142858,-2.407440427142858,"['xas', 'elasticity', 'bandstructure']",True,"[1027, 83117, 41581]",True,2021-05-12 10:56:16.728000,NM,7,8,mp-23143,oxide,Ca2Cu(ClO)2,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Cu_pv', 'Cl', 'O'], 'pot_type': 'paw'}","{'Ca': 2.0, 'Cu': 1.0, 'Cl': 2.0, 'O': 2.0}",GGA,mp-23143,"['mp-992231', 'mp-990553', 'mp-23143', 'mp-1436301', 'mp-1700223', 'mp-1803462', 'mp-993865', 'mp-1592909']",0.0134962,"{'Ca': 2.0, 'Cu': 1.0, 'Cl': 2.0, 'O': 2.0}",115.21141865211318,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001171429026557,0.0134962,0,0.0134962,MP,data/source/MP/cleaned/cifs/MP-mp-23143.cif,True,,data/final/MP/graphs/Ca1.76Cl2Cu1Na0.24O2-MP-mp-23143-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ir3Si5Tb2,1,0.0,2.0,False,Ir6Si10Tb4,Ir6Si10Tb4,0.0,Other,True,Ir30Si50Tb20,Ir-Si-Tb,3,Supercon,Tb2Ir3Si5,MP-mp-1187284,Tb4Si10Ir6,Ir-Si-Tb,Ir30Si50Tb20,I b a m,orthorhombic,5.8455919984923606,8.15406364,8.154063639654087,data/final/MP/cifs/Ir3Si5Tb2-MP-mp-1187284.cif,data/source/MP/raw/cifs/mp-1187284.cif,mp-1187284,0.0,,2019-01-11 14:58:11.468000,10.248632242316315,,,,0.0,7.96797936,520.0,-145.55942013,-7.2779710065,"{'tags': ['U2Co3Si5', 'Terbium iridium silicide (2/3/5)', 'Tb2Ir3Si5']}",-145.55942013,-7.2779710065,-0.9514116504999997,[],False,[604548],True,2021-05-12 10:59:52.436000,NM,20,3,mp-1187284,,Tb2Si5Ir3,"{'functional': 'PBE', 'labels': ['Tb_3', 'Si', 'Ir'], 'pot_type': 'paw'}","{'Tb': 2.0, 'Si': 5.0, 'Ir': 3.0}",GGA,mp-1187284,"['mp-1187284', 'mp-1377399', 'mp-1811408']",0.000547,"{'Tb': 4.0, 'Si': 10.0, 'Ir': 6.0}",335.3697014649974,[],NM,False,12,0,"[-0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",3.2620716636627384e-06,0.000547,0,0.001094,MP,data/source/MP/cleaned/cifs/MP-mp-1187284.cif,False,,data/final/MP/graphs/Ir3Si5Tb2-MP-mp-1187284.json,0,True,mmm,0,0,0,7,0,0,0,0,0,1,0,1.0,False
Ba2Ca0.8Cu2Nd0.2Tl1O7,3,0.0307692307692307,1.0,True,Ba2Ca0.8Cu2Nd0.2Tl1O7,Ba2Ca1Cu2Tl1O7,96.3,Cuprate,True,Ba15.385Ca6.154Cu15.385Nd1.538Tl7.692O53.84615384615385,Ba-Ca-Cu-Nd-Tl-O,6,Supercon,Tl1Ba2Ca0.8Nd0.2Cu2O7,MP-mp-632802,Ba2Ca1Tl1Cu2O7,Ba-Ca-Cu-Tl-O,Ba15.385Ca7.692Cu15.385Tl7.692O53.84615384615385,P 4/m m m,tetragonal,3.840502,3.840502,13.048748,data/final/MP/cifs/Ba2Ca0.8Cu2Nd0.2Tl1O7-MP-mp-632802-synth_doped.cif,data/source/MP/raw/cifs/mp-632802.cif,mp-632802,0.0,,2013-06-21 12:28:47,6.541687864051921,10.17188/1279349,"@misc{osti_1279349,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2CaTlCu2O7 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1279349"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1742071'}},0.0444125982158123,2.89241018,520.0,-71.95529719,-5.535022860769231,{'tags': ['Thallium(III) calcium barium copper oxide (1/1/2/2/7)']},-71.95529719,-5.535022860769231,-1.978767086794871,"['xas', 'bandstructure']",True,[67128],True,2021-05-12 10:57:30.779000,NM,13,10,mp-632802,oxide,Ba2CaTlCu2O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ca_sv', 'Tl_d', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Ca': 1.0, 'Tl': 1.0, 'Cu': 2.0, 'O': 7.0}",GGA,mp-632802,"['mp-699409', 'mp-632802', 'mp-732256', 'mp-743134', 'mp-1182322', 'mp-1394572', 'mp-1742071', 'mp-1785618', 'mp-1654627', 'mp-749845']",0.0282595,"{'Ba': 2.0, 'Ca': 1.0, 'Tl': 1.0, 'Cu': 2.0, 'O': 7.0}",192.461929418226,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.000146831636186,0.0282595,0,0.0282595,MP,data/source/MP/cleaned/cifs/MP-mp-632802.cif,True,,data/final/MP/graphs/Ba2Ca0.8Cu2Nd0.2Tl1O7-MP-mp-632802-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Pt3U1,1,0.0,2.0,False,Pt6U2,Pt6U2,0.523363636,Heavy_fermion,True,Pt75U25,Pt-U,2,Supercon,Pt3U1,MP-mp-30855,U2Pt6,Pt-U,Pt75U25,P 63/m m c,hexagonal,4.997603,5.777009996166576,5.7770105,data/final/MP/cifs/Pt3U1-MP-mp-30855.cif,data/source/MP/raw/cifs/mp-30855.cif,mp-30855,0.0,,2014-02-19 21:36:23,18.929034548497903,10.17188/1205211,"@misc{osti_1205211,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UPt3 (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1205211"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687777'}},0.0,9.26919984,520.0,-64.84444661,-8.10555582625,"{'tags': ['Platinum uranium (3/1)', 'Uranium platinum boride (1/3/0.11)', 'Uranium platinum (1/3)']}",-64.84444661,-8.10555582625,-0.7295225412500006,"['xas', 'bandstructure']",True,"[615213, 649804, 105833, 191938]",True,2021-05-12 10:57:04.957000,FM,8,11,mp-30855,,UPt3,"{'functional': 'PBE', 'labels': ['U', 'Pt'], 'pot_type': 'paw'}","{'U': 1.0, 'Pt': 3.0}",GGA,mp-30855,"['mp-943077', 'mp-932790', 'mp-942062', 'mp-30855', 'mp-1078485', 'mp-1079639', 'mp-1092253', 'mp-1299942', 'mp-1687777', 'mp-1924669', 'mp-1595664']",0.6726182,"{'U': 2.0, 'Pt': 6.0}",144.44372324836635,[],FM,True,187,1,"[0.0, 1.4, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0093132215768691,0.6726182,1,1.3452364,MP,data/source/MP/cleaned/cifs/MP-mp-30855.cif,False,,data/final/MP/graphs/Pt3U1-MP-mp-30855.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ce1N0.87,3,0.0695187165775401,1.0,True,Ce1N0.87,Ce1N1,0.0,Heavy_fermion,True,Ce53.476N46.524,Ce-N,2,Supercon,Ce1N0.87,MP-mp-2493,Ce1N1,Ce-N,Ce50N50,F m -3 m,cubic,3.57183677,3.57183677,3.57183677,data/final/MP/cifs/Ce1N0.87-MP-mp-2493-synth_doped.cif,data/source/MP/raw/cifs/mp-2493.cif,mp-2493,0.0,,2011-05-12 18:12:16,7.942475672762934,10.17188/1200340,"@misc{osti_1200340,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeN (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1200340"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668870'}},0.0,8.69117991,520.0,-17.26655555,-8.633277775,"{'tags': ['Cerium nitride', 'Neodymium nitride (1/1)', 'Lanthanum nitride (1/1)', 'Cerium nitride (1/1)', 'High pressure experimental phase']}",-17.26655555,-8.633277775,-1.6789857349999997,"['xas', 'elasticity', 'bandstructure']",True,"[621549, 236534, 236504, 621559, 236537, 236536, 52881, 236530, 621558, 236500, 236503, 236498, 236483, 236482, 169213, 621548, 236490, 236535, 236494, 236493, 236491, 236485, 236495, 236508, 236496, 236492, 236501, 236506, 236502, 621551, 621550, 621547, 236505, 236532, 236487, 236486, 236510, 236509, 236484, 236531, 236497, 236511, 236533, 236499, 621553, 76480, 621546, 236489, 236488, 236507, 169198]",True,2021-05-12 10:56:16.728000,FM,2,161,mp-2493,,CeN,"{'functional': 'PBE', 'labels': ['Ce', 'N'], 'pot_type': 'paw'}","{'Ce': 1.0, 'N': 1.0}",GGA,mp-2493,"['mp-1007283', 'mp-1000837', 'mp-2493', 'mp-1057142', 'mp-1057164', 'mp-1057177', 'mp-1057115', 'mp-1057128', 'mp-1057131', 'mp-1057224', 'mp-1057228', 'mp-1057231', 'mp-1057242', 'mp-1057271', 'mp-1057284', 'mp-1057612', 'mp-1057626', 'mp-1057664', 'mp-1057780', 'mp-1057804', 'mp-1057823', 'mp-1057825', 'mp-1057836', 'mp-1057837', 'mp-1057844', 'mp-1057873', 'mp-1058082', 'mp-1058088', 'mp-1057876', 'mp-1058096', 'mp-1058137', 'mp-1058142', 'mp-1058269', 'mp-1058254', 'mp-1058105', 'mp-1058298', 'mp-1058396', 'mp-1058418', 'mp-1058465', 'mp-1058821', 'mp-1058842', 'mp-1058852', 'mp-1058866', 'mp-1058869', 'mp-1058924', 'mp-1058773', 'mp-1058803', 'mp-1058824', 'mp-1058851', 'mp-1058705', 'mp-1058722', 'mp-1059021', 'mp-1058867', 'mp-1059030', 'mp-1058894', 'mp-1058931', 'mp-1059042', 'mp-1059049', 'mp-1059291', 'mp-1059081', 'mp-1059375', 'mp-1059093', 'mp-1059386', 'mp-1059308', 'mp-1059346', 'mp-1059420', 'mp-1059523', 'mp-1059539', 'mp-1059702', 'mp-1059582', 'mp-1059681', 'mp-1059760', 'mp-1060719', 'mp-1060335', 'mp-1060336', 'mp-1060786', 'mp-1060791', 'mp-1060813', 'mp-1060357', 'mp-1060358', 'mp-1060870', 'mp-1060872', 'mp-1060588', 'mp-1060606', 'mp-1060629', 'mp-1060399', 'mp-1060634', 'mp-1060901', 'mp-1060660', 'mp-1060419', 'mp-1060421', 'mp-1060664', 'mp-1060921', 'mp-1060433', 'mp-1060701', 'mp-1060928', 'mp-1060741', 'mp-1060745', 'mp-1060501', 'mp-1060507', 'mp-1060518', 'mp-1060528', 'mp-1060792', 'mp-1060539', 'mp-1060809', 'mp-1060816', 'mp-1060835', 'mp-1061115', 'mp-1061113', 'mp-1061013', 'mp-1061293', 'mp-1061168', 'mp-1061085', 'mp-1061147', 'mp-1061449', 'mp-1061488', 'mp-1061566', 'mp-1441011', 'mp-1668870', 'mp-1793351', 'mp-1012012', 'mp-1595547', 'mp-1592420', 'mp-1057874', 'mp-1060909', 'mp-1060857', 'mp-1060576', 'mp-1059340', 'mp-1059413', 'mp-1060411', 'mp-1061549', 'mp-1061203', 'mp-1060861', 'mp-1060731', 'mp-1058860', 'mp-1059074', 'mp-1057840', 'mp-1058129', 'mp-1057156', 'mp-1060491', 'mp-1060408', 'mp-1060998', 'mp-1060730', 'mp-1057266', 'mp-1057656', 'mp-1058914', 'mp-1058453', 'mp-1060779', 'mp-1059575', 'mp-1059090', 'mp-1057866', 'mp-1058920', 'mp-1057280', 'mp-1059755', 'mp-1061156', 'mp-1058139', 'mp-1057169', 'mp-1058883', 'mp-1058299', 'mp-1058770', 'mp-1060590']",0.4056478,"{'Ce': 1.0, 'N': 1.0}",32.22254306393652,[],FM,True,225,1,"[0.4, 0.0]",0.0125889443050819,0.4056478,1,0.4056478,MP,data/source/MP/cleaned/cifs/MP-mp-2493.cif,True,,data/final/MP/graphs/Ce1N0.87-MP-mp-2493-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
La1Mg1,1,0.0,1.0,True,La1Mg1,La1Mg1,0.0,Other,True,La50Mg50,La-Mg,2,Supercon,La1Mg1,MP-mp-1104,La1Mg1,La-Mg,La50Mg50,P m -3 m,cubic,3.966144,3.966144,3.966144,data/final/MP/cifs/La1Mg1-MP-mp-1104.cif,data/source/MP/raw/cifs/mp-1104.cif,mp-1104,0.0,,2011-05-12 18:28:34,4.344018621181897,10.17188/1187542,"@misc{osti_1187542,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaMg (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187542"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687906'}},0.0,5.74174658,520.0,-6.75655471,-3.378277355,"{'tags': ['Lanthanum magnesium (1/1)', 'Magnesium lanthanum (1/1)']}",-6.75655471,-3.378277355,-0.1101337774999997,"['xas', 'elasticity']",False,"[104658, 190977, 161739, 641404, 641398, 641411, 104659, 641401]",True,2021-05-12 10:56:10.715000,NM,2,9,mp-1104,,LaMg,"{'functional': 'PBE', 'labels': ['La', 'Mg_pv'], 'pot_type': 'paw'}","{'La': 1.0, 'Mg': 1.0}",GGA,mp-1104,"['mp-990505', 'mp-1104', 'mp-1057573', 'mp-1057559', 'mp-1057585', 'mp-1440758', 'mp-1687906', 'mp-1792731', 'mp-1057588']",0.0132839,"{'La': 1.0, 'Mg': 1.0}",62.38862793811191,[],NM,False,221,0,"[0, 0]",0.0002129218166678,0.0132839,0,0.0132839,MP,data/source/MP/cleaned/cifs/MP-mp-1104.cif,False,,data/final/MP/graphs/La1Mg1-MP-mp-1104.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Nb1Sc1,1,0.0,1.0,True,Nb1Sc1,Nb1Sc1,0.0,Other,True,Nb50Sc50,Nb-Sc,2,Supercon,Nb1Sc1,MP-mp-973229,Sc1Nb1,Nb-Sc,Nb50Sc50,P -6 m 2,hexagonal,3.065643999033218,3.06564436,5.072194,data/final/MP/cifs/Nb1Sc1-MP-mp-973229.cif,data/source/MP/raw/cifs/mp-973229.cif,mp-973229,0.0,,2015-09-16 06:18:53,5.54529423191982,10.17188/1314050,"@misc{osti_1314050,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ScNb (SG:187) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1314050"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1674637'}},0.1864209525000006,4.47347873,520.0,-16.06093224,-8.03046612,{'tags': []},-16.06093224,-8.03046612,0.1864209525000006,"['xas', 'elasticity', 'bandstructure']",True,[],True,2021-05-12 10:56:35.166000,NM,2,8,mp-973229,,ScNb,"{'functional': 'PBE', 'labels': ['Sc_sv', 'Nb_pv'], 'pot_type': 'paw'}","{'Sc': 1.0, 'Nb': 1.0}",GGA,mp-973229,"['mp-973302', 'mp-973287', 'mp-973229', 'mp-1432482', 'mp-1674637', 'mp-1866868', 'mp-973312', 'mp-1630272']",2.1e-06,"{'Sc': 1.0, 'Nb': 1.0}",41.28288096225346,[],NM,False,187,0,"[0, 0]",5.086854286938239e-08,2.1e-06,0,2.1e-06,MP,data/source/MP/cleaned/cifs/MP-mp-973229.cif,False,,data/final/MP/graphs/Nb1Sc1-MP-mp-973229.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Cu1La2O4.11,2,0.0132610006027727,0.9730786699107866,True,Cu0.973La1.946O4,Cu1La2O4,43.5,Cuprate,True,Cu14.065La28.129O57.80590717299579,Cu-La-O,3,Supercon,La2Cu1O4.11,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La2O4.11-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La2O4.11-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ce1In7Pt2,1,0.0,1.0,True,Ce1In7Pt2,Ce1In7Pt2,2.1,Heavy_fermion,True,Ce10In70Pt20,Ce-In-Pt,3,Supercon,Ce1Pt2In7,MP-mp-1078439,Ce1In7Pt2,Ce-In-Pt,Ce10In70Pt20,I 4/m m m,tetragonal,4.67379000219058,4.67379000219058,11.32388816,data/final/MP/cifs/Ce1In7Pt2-MP-mp-1078439.cif,data/source/MP/raw/cifs/mp-1078439.cif,mp-1078439,0.0,,2018-04-11 13:23:51,9.362793543241098,,,{'GGA': {'task_id': 'mp-1700920'}},0.0,7.7663334,520.0,-41.89401696,-4.189401696,{'tags': ['Cerium platinum indium (1/2/7)']},-41.89401696,-4.189401696,-0.4557326275000001,['bandstructure'],True,[193321],True,2021-05-12 10:58:14.654000,FM,10,5,mp-1078439,,CeIn7Pt2,"{'functional': 'PBE', 'labels': ['Ce', 'In_d', 'Pt'], 'pot_type': 'paw'}","{'Ce': 1.0, 'In': 7.0, 'Pt': 2.0}",GGA,mp-1078439,"['mp-1078439', 'mp-1504571', 'mp-1700920', 'mp-1922009', 'mp-1597376']",0.5265023,"{'Ce': 1.0, 'In': 7.0, 'Pt': 2.0}",236.5934600613059,[],FM,True,139,1,"[0.4, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.002225345957845,0.5265023,1,0.5265023,MP,data/source/MP/cleaned/cifs/MP-mp-1078439.cif,False,,data/final/MP/graphs/Ce1In7Pt2-MP-mp-1078439.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
La2Mg1,1,0.0,2.0,False,La4Mg2,La4Mg2,0.0,Other,True,La66.667Mg33.333,La-Mg,2,Supercon,La2Mg1,MP-mp-1094177,La4Mg2,La-Mg,La66.667Mg33.333,C 1 2/m 1,monoclinic,3.933467999250908,6.902137249999999,7.96828824,data/final/MP/cifs/La2Mg1-MP-mp-1094177.cif,data/source/MP/raw/cifs/mp-1094177.cif,mp-1094177,0.0,,2018-05-01 22:48:38,5.048562019165181,,,,0.0299475433333333,6.56896406,520.0,-23.20543837,-3.8675730616666666,{'tags': []},-23.20543837,-3.8675730616666666,-0.0434749749999999,[],False,[],True,2021-05-12 10:59:22.504000,NM,6,3,mp-1094177,,La2Mg,"{'functional': 'PBE', 'labels': ['La', 'Mg_pv'], 'pot_type': 'paw'}","{'La': 2.0, 'Mg': 1.0}",GGA,mp-1094177,"['mp-1094177', 'mp-1390942', 'mp-1831536']",0.03535045,"{'La': 4.0, 'Mg': 2.0}",198.73988637086708,[],NM,False,12,0,"[0, 0, 0, 0, 0, 0]",0.0003557459012936,0.03535045,0,0.0707009,MP,data/source/MP/cleaned/cifs/MP-mp-1094177.cif,False,,data/final/MP/graphs/La2Mg1-MP-mp-1094177.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
B1.92C0.08Mg1,3,0.0533333333333333,1.0,True,B1.92C0.08Mg1,B2Mg1,38.3,Other,True,B64C2.667Mg33.333,B-C-Mg,3,Supercon,Mg1B1.92C0.08,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B1.92C0.08Mg1-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B1.92C0.08Mg1-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Au1Te2,1,0.0,8.0,False,Au8Te16,Au8Te16,1.366666667,Other,True,Au33.333Te66.667,Au-Te,2,Supercon,Au1Te2,MP-mp-20123,Te16Au8,Au-Te,Au33.333Te66.667,P m a 2,orthorhombic,4.512623,8.952602,16.879993,data/final/MP/cifs/Au1Te2-MP-mp-20123.cif,data/source/MP/raw/cifs/mp-20123.cif,mp-20123,0.0,,2014-02-23 04:05:37,8.808195421643939,10.17188/1195269,"@misc{osti_1195269,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Te2Au (SG:28) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195269"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1754029'}},0.0,5.80301739,520.0,-78.64173127,-3.2767388029166664,"{'tags': ['Gold telluride (1/2)', 'Krennerite']}",-78.64173127,-3.2767388029166664,-0.3712443362499993,"['xas', 'bandstructure']",True,"[38213, 612391]",True,2021-05-12 10:56:57.051000,NM,24,9,mp-20123,,Te2Au,"{'functional': 'PBE', 'labels': ['Te', 'Au'], 'pot_type': 'paw'}","{'Te': 2.0, 'Au': 1.0}",GGA,mp-20123,"['mp-907583', 'mp-921976', 'mp-922207', 'mp-20123', 'mp-1115990', 'mp-1399861', 'mp-1754029', 'mp-1890838', 'mp-1618917']",0.0001634625,"{'Te': 16.0, 'Au': 8.0}",681.9469518943525,[],NM,False,28,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.9175978371446543e-06,0.0001634625,0,0.0013077,MP,data/source/MP/cleaned/cifs/MP-mp-20123.cif,False,,data/final/MP/graphs/Au1Te2-MP-mp-20123.json,0,True,mm2,0,0,0,6,0,0,0,1,0,0,0,1.0,False
Pd0.24Ti0.76,2,0.02,8.0,False,Pd1.92Ti6.08,Pd2Ti6,2.0,Other,True,Pd24Ti76,Pd-Ti,2,Supercon,Pd0.24Ti0.76,MP-mp-1079796,Ti6Pd2,Pd-Ti,Pd25Ti75,P m -3 n,cubic,5.062402,5.062402,5.062402,data/final/MP/cifs/Pd0.24Ti0.76-MP-mp-1079796-synth_doped.cif,data/source/MP/raw/cifs/mp-1079796.cif,mp-1079796,0.0,,2018-04-16 08:50:50,6.400084291337905,,,{'GGA': {'task_id': 'mp-1753631'}},0.0,5.87293662,520.0,-60.50496802,-7.5631210025,{'tags': ['Titanium palladium (3/1)']},-60.50496802,-7.5631210025,-0.3465315374999997,['bandstructure'],True,[167644],True,2021-05-12 10:58:16.596000,NM,8,5,mp-1079796,,Ti3Pd,"{'functional': 'PBE', 'labels': ['Ti_pv', 'Pd'], 'pot_type': 'paw'}","{'Ti': 3.0, 'Pd': 1.0}",GGA,mp-1079796,"['mp-1079796', 'mp-1389837', 'mp-1753631', 'mp-1788391', 'mp-1624029']",0.06889515,"{'Ti': 6.0, 'Pd': 2.0}",129.73880313804727,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0010620592811649,0.06889515,0,0.1377903,MP,data/source/MP/cleaned/cifs/MP-mp-1079796.cif,True,,data/final/MP/graphs/Pd0.24Ti0.76-MP-mp-1079796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
La2Sr1O4.003,2,0.0003671895718161,1.9986670413856276,False,La3.997Sr1.999O8,La4Sr2O8,0.0,Oxide,True,La28.559Sr14.28O57.161216621447956,La-Sr-O,3,Supercon,La2Sr1O4.003,MP-mp-752533,Sr2La4O8,La-Sr-O,La28.571Sr14.286O57.142857142857146,C m c m,orthorhombic,3.5816319988653307,6.24234218,11.561748,data/final/MP/cifs/La2Sr1O4.003-MP-mp-752533-synth_doped.cif,data/source/MP/raw/cifs/mp-752533.cif,mp-752533,2.8315,,2014-02-14 21:25:43,5.7592762622860905,10.17188/1288623,"@misc{osti_1288623,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SrLa2O4 (SG:63) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1288623"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1746550'}},0.0771438037499976,4.22444996,520.0,-107.18048374,-7.655748838571428,{'tags': []},-107.18048374,-7.655748838571428,-3.569270026666666,['bandstructure'],True,[],True,2021-05-12 10:58:55.498000,NM,14,7,mp-752533,oxide,SrLa2O4,"{'functional': 'PBE', 'labels': ['Sr_sv', 'La', 'O'], 'pot_type': 'paw'}","{'Sr': 1.0, 'La': 2.0, 'O': 4.0}",GGA,mp-752533,"['mp-849912', 'mp-850547', 'mp-752533', 'mp-1401981', 'mp-1746550', 'mp-1926466', 'mp-851315']",0.00071075,"{'Sr': 2.0, 'La': 4.0, 'O': 8.0}",247.62933205775724,[],NM,False,63,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.74043465766991e-06,0.00071075,0,0.0014215,MP,data/source/MP/cleaned/cifs/MP-mp-752533.cif,True,,data/final/MP/graphs/La2Sr1O4.003-MP-mp-752533-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Dy0.1Pd2Sn1Y0.9,2,0.0499999999999999,1.0,True,Dy0.1Pd2Sn1Y0.9,Pd2Sn1Y1,3.46,Other,True,Dy2.5Pd50Sn25Y22.5,Dy-Pd-Sn-Y,4,Supercon,Pd2Y0.9Dy0.1Sn1,MP-mp-5538,Y1Sn1Pd2,Pd-Sn-Y,Pd50Sn25Y25,F m -3 m,cubic,4.81595014,4.81595014,4.81595014,data/final/MP/cifs/Dy0.1Pd2Sn1Y0.9-MP-mp-5538-synth_doped.cif,data/source/MP/raw/cifs/mp-5538.cif,mp-5538,0.0,,2011-05-13 01:04:13,8.839720826473608,10.17188/1267618,"@misc{osti_1267618,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YSnPd2 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1267618"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687523'}},0.0,6.33853657,520.0,-24.32859047,-6.0821476175,"{'tags': ['Palladium yttrium stannide (2/1/1)', 'Palladium tin yttrium (2/1/1)']}",-24.32859047,-6.0821476175,-0.873195970416667,"['xas', 'elasticity', 'bandstructure']",True,"[105699, 648949, 105700, 424011, 648950]",True,2021-05-12 10:56:22.739000,NM,4,12,mp-5538,,YSnPd2,"{'functional': 'PBE', 'labels': ['Y_sv', 'Sn_d', 'Pd'], 'pot_type': 'paw'}","{'Y': 1.0, 'Sn': 1.0, 'Pd': 2.0}",GGA,mp-5538,"['mp-1008093', 'mp-1001657', 'mp-5538', 'mp-1065654', 'mp-1065644', 'mp-1065683', 'mp-1439031', 'mp-1687523', 'mp-1801498', 'mp-1012418', 'mp-1593849', 'mp-1065696']",0.0001592,"{'Y': 1.0, 'Sn': 1.0, 'Pd': 2.0}",78.98251295612837,[],NM,False,225,0,"[0, 0, 0, 0]",2.015636044505563e-06,0.0001592,0,0.0001592,MP,data/source/MP/cleaned/cifs/MP-mp-5538.cif,True,,data/final/MP/graphs/Dy0.1Pd2Sn1Y0.9-MP-mp-5538-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Sr1Ti1O3,1,0.0,2.0,False,Sr2Ti2O6,Sr2Ti2O6,0.5040416665,Oxide,True,Sr20Ti20O60,Sr-Ti-O,3,Supercon,O3Sr1Ti1,MP-mp-4651,Sr2Ti2O6,Sr-Ti-O,Sr20Ti20O60,I 4/m c m,tetragonal,5.567728004403839,5.57946045,5.567728004403839,data/final/MP/cifs/Sr1Ti1O3-MP-mp-4651.cif,data/source/MP/raw/cifs/mp-4651.cif,mp-4651,1.8583000000000005,,2011-05-13 21:40:48,4.972062125329374,10.17188/1208312,"@misc{osti_1208312,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SrTiO3 (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208312"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668161'}},0.0,3.18730183,520.0,-80.25822916,-8.025822916,"{'tags': ['Strontium titanate - LT', 'Strontium titanium trioxide', 'Strontium titanate', 'Tausonite', 'Strontium titanate(IV)', 'Strontium titanate - containing (18)O']}",-80.25822916,-8.025822916,-3.552249219,"['xas', 'bandstructure', 'diel', 'phonons', 'elasticity']",True,"[56718, 187619, 187480, 181652, 65089, 80874, 182762, 187296, 186895, 65090, 192314, 182247, 248379, 65088, 76186, 262269, 80872, 186725, 184455, 23076, 91899, 182764, 80871, 201256, 290370, 182248, 182763, 248380, 80873, 290617, 56092, 184921, 170091, 27045, 56717, 191828, 94573]",True,2021-05-12 10:56:20.740000,NM,10,11,mp-4651,oxide,SrTiO3,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ti_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Ti': 1.0, 'O': 3.0}",GGA,mp-4651,"['mp-659604', 'mp-656470', 'mp-4651', 'mp-1141919', 'mp-1178992', 'mp-1440821', 'mp-1668161', 'mp-1923854', 'mp-1589409', 'mp-1593443', 'mp-665132']",5.595e-05,"{'Sr': 2.0, 'Ti': 2.0, 'O': 6.0}",122.55854213516308,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",9.130330538412544e-07,5.595e-05,0,0.0001119,MP,data/source/MP/cleaned/cifs/MP-mp-4651.cif,False,,data/final/MP/graphs/Sr1Ti1O3-MP-mp-4651.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ba0.595Bi1K0.405O3,2,0.0286666666666666,3.0,False,Ba1.785Bi3K1.215O9,Ba2Bi3K1O9,31.2,Oxide,True,Ba11.9Bi20K8.1O60,Ba-Bi-K-O,4,Supercon,Ba0.595K0.405Bi1O3,MP-mp-1223518,K1Ba2Bi3O9,Ba-Bi-K-O,Ba13.333Bi20K6.667O60,P -3 m 1,trigonal,6.18756400330999,6.187564340000001,7.581401,data/final/MP/cifs/Ba0.595Bi1K0.405O3-MP-mp-1223518-synth_doped.cif,data/source/MP/raw/cifs/mp-1223518.cif,mp-1223518,0.0,,2019-01-12 23:54:06.965000,7.16530091201999,,,{'GGA': {'task_id': 'mp-1729135'}},0.001551682833333,3.46143017,520.0,-85.22271396,-5.681514264,{'tags': []},-85.22271396,-5.681514264,-2.0170414252000004,[],False,[],True,2021-05-12 11:00:52.054000,NM,15,4,mp-1223518,oxide,KBa2(BiO3)3,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Bi', 'O'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 2.0, 'Bi': 3.0, 'O': 9.0}",GGA,mp-1223518,"['mp-1223518', 'mp-1391182', 'mp-1729135', 'mp-1775199']",4.99e-05,"{'K': 1.0, 'Ba': 2.0, 'Bi': 3.0, 'O': 9.0}",251.37352739849624,[],NM,False,164,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.9850936777799505e-07,4.99e-05,0,4.99e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1223518.cif,True,,data/final/MP/graphs/Ba0.595Bi1K0.405O3-MP-mp-1223518-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ir0.93Te2,2,0.0318543799772468,4.0,False,Ir3.72Te8,Ir4Te8,4.7,Other,True,Ir31.741Te68.259,Ir-Te,2,Supercon,Ir0.93Te2,MP-mp-569322,Te8Ir4,Ir-Te,Ir33.333Te66.667,P n m a,orthorhombic,4.049805,5.441863,13.587474,data/final/MP/cifs/Ir0.93Te2-MP-mp-569322-synth_doped.cif,data/source/MP/raw/cifs/mp-569322.cif,mp-569322,0.0,,2014-02-16 04:48:25,9.924328423353325,10.17188/1275037,"@misc{osti_1275037,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Te2Ir (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1275037"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1746248'}},0.0123894575000003,7.60847828,520.0,-63.94410921,-5.3286757675,{'tags': ['Iridium telluride (1/2)']},-63.94410921,-5.3286757675,-0.5683316741666667,"['xas', 'bandstructure']",True,[93894],True,2021-05-12 10:57:24.969000,NM,12,7,mp-569322,,Te2Ir,"{'functional': 'PBE', 'labels': ['Te', 'Ir'], 'pot_type': 'paw'}","{'Te': 2.0, 'Ir': 1.0}",GGA,mp-569322,"['mp-927873', 'mp-927408', 'mp-569322', 'mp-911451', 'mp-1392626', 'mp-1746248', 'mp-1810340']",0.000153075,"{'Te': 8.0, 'Ir': 4.0}",299.44732816890644,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.0447669503153013e-06,0.000153075,0,0.0006123,MP,data/source/MP/cleaned/cifs/MP-mp-569322.cif,True,,data/final/MP/graphs/Ir0.93Te2-MP-mp-569322-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
In0.044Sn0.956Te1,2,0.044,1.0,True,In0.044Sn0.956Te1,Sn1Te1,1.017,Other,True,In2.2Sn47.8Te50,In-Sn-Te,3,Supercon,Sn0.956In0.044Te1,MP-mp-1883,Sn1Te1,Sn-Te,Sn50Te50,F m -3 m,cubic,4.53766968,4.53766968,4.53766968,data/final/MP/cifs/In0.044Sn0.956Te1-MP-mp-1883-synth_doped.cif,data/source/MP/raw/cifs/mp-1883.cif,mp-1883,0.6623999999999999,,2011-05-12 18:43:07,6.19081042904143,10.17188/1193534,"@misc{osti_1193534,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SnTe (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1193534"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686906'}},0.0,6.06645058,520.0,-7.72519638,-3.86259819,"{'tags': ['Tin telluride (1/1)', 'Tin telluride']}",-7.72519638,-3.86259819,-0.4971617975000004,"['eos', 'elasticity', 'bandstructure', 'xas']",True,"[52489, 652760, 652744, 652756, 652761, 600865, 652763, 652745, 652742, 604177, 600813, 652741, 601065, 652750, 652755, 652753, 652751, 652749, 652752, 600136, 652754, 652746, 652759]",True,2021-05-12 10:56:14.760000,NM,2,9,mp-1883,,SnTe,"{'functional': 'PBE', 'labels': ['Sn_d', 'Te'], 'pot_type': 'paw'}","{'Sn': 1.0, 'Te': 1.0}",GGA,mp-1883,"['mp-663289', 'mp-655511', 'mp-657302', 'mp-1883', 'mp-1440781', 'mp-1686906', 'mp-1784332', 'mp-1596407', 'mp-1596974']",0.0,"{'Sn': 1.0, 'Te': 1.0}",66.06685541129963,[],NM,False,225,0,"[0, 0]",0.0,0.0,0,0.0,MP,data/source/MP/cleaned/cifs/MP-mp-1883.cif,True,,data/final/MP/graphs/In0.044Sn0.956Te1-MP-mp-1883-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
As1Fe1Tb1O0.75,3,0.1,2.0,False,As2Fe2Tb2O1.5,As2Fe2Tb2O2,34.8,Ferrite,True,As26.667Fe26.667Tb26.667O20,As-Fe-Tb-O,4,Supercon,Tb1Fe1As1O0.75,MP-mp-1079887,Tb2Fe2As2O2,As-Fe-Tb-O,As25Fe25Tb25O25,P 4/n m m,tetragonal,3.971557,3.971557,9.096524,data/final/MP/cifs/As1Fe1Tb1O0.75-MP-mp-1079887-synth_doped.cif,data/source/MP/raw/cifs/mp-1079887.cif,mp-1079887,0.0,,2018-04-16 16:53:03,7.075630957925009,,,{'GGA+U': {'task_id': 'mp-1697746'}},0.2848640540625,4.29262424,520.0,-53.1200584,-6.6400073,{'tags': []},-53.1200584,-6.6400073,-1.69789381,['bandstructure'],True,[422004],True,2021-05-12 10:58:16.596000,FM,8,5,mp-1079887,oxide,TbFeAsO,"{'functional': 'PBE', 'labels': ['Tb_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Tb': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-1079887,"['mp-1079887', 'mp-1418181', 'mp-1697746', 'mp-1779163', 'mp-1589035']",3.7855201,"{'Tb': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",143.48188366951112,[],FM,True,129,1,"[0.0, 0.0, 3.6, 3.6, 0.0, 0.0, 0.0, 0.0]",0.0527665235942869,3.7855201,2,7.5710402,MP,data/source/MP/cleaned/cifs/MP-mp-1079887.cif,True,,data/final/MP/graphs/As1Fe1Tb1O0.75-MP-mp-1079887-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
La1Pb1.5Sn1.5,1,0.0,2.0,False,La2Pb3Sn3,La2Pb3Sn3,1.18,Other,True,La25Pb37.5Sn37.5,La-Pb-Sn,3,Supercon,La1Pb1.5Sn1.5,MP-mp-1223431,La2Sn3Pb3,La-Pb-Sn,La25Pb37.5Sn37.5,P m m m,orthorhombic,4.908024,4.962194,9.690446,data/final/MP/cifs/La1Pb1.5Sn1.5-MP-mp-1223431.cif,data/source/MP/raw/cifs/mp-1223431.cif,mp-1223431,0.0,,2019-01-12 23:49:37.078000,8.833967418950936,,,{'GGA': {'task_id': 'mp-1722660'}},0.0096015500000001,8.26372422,520.0,-37.05084726,-4.6313559075,{'tags': []},-37.05084726,-4.6313559075,-0.5015220343750002,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,8,5,mp-1223431,,La2(SnPb)3,"{'functional': 'PBE', 'labels': ['La', 'Sn_d', 'Pb_d'], 'pot_type': 'paw'}","{'La': 2.0, 'Sn': 3.0, 'Pb': 3.0}",GGA,mp-1223431,"['mp-1223431', 'mp-1408390', 'mp-1722660', 'mp-1775572', 'mp-1637210']",0.0005367,"{'La': 2.0, 'Sn': 3.0, 'Pb': 3.0}",236.00661873770773,[],NM,False,47,0,"[0, 0, 0, 0, 0, 0, 0, 0]",2.2740887644192545e-06,0.0005367,0,0.0005367,MP,data/source/MP/cleaned/cifs/MP-mp-1223431.cif,False,,data/final/MP/graphs/La1Pb1.5Sn1.5-MP-mp-1223431.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ir1La1P1,1,0.0,2.0,False,Ir2La2P2,Ir2La2P2,5.3,Other,True,Ir33.333La33.333P33.333,Ir-La-P,3,Supercon,La1Ir1P1,MP-mp-12919,La2P2Ir2,Ir-La-P,Ir33.333La33.333P33.333,I 41 m d,tetragonal,4.170870001649917,4.170870001649918,7.77393014,data/final/MP/cifs/Ir1La1P1-MP-mp-12919.cif,data/source/MP/raw/cifs/mp-12919.cif,mp-12919,0.0,,2011-05-28 05:44:58,9.61067162625512,10.17188/1189266,"@misc{osti_1189266,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaPIr (SG:109) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189266"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700957'}},0.0,8.81125393,520.0,-45.54614823,-7.591024705,{'tags': ['Lanthanum iridium phosphide (1/1/1)']},-45.54614823,-7.591024705,-1.1951113611111122,"['xas', 'bandstructure']",True,"[193889, 414514]",True,2021-05-12 10:56:53.126000,NM,6,12,mp-12919,,LaPIr,"{'functional': 'PBE', 'labels': ['La', 'P', 'Ir'], 'pot_type': 'paw'}","{'La': 1.0, 'P': 1.0, 'Ir': 1.0}",GGA,mp-12919,"['mp-919836', 'mp-918835', 'mp-905889', 'mp-12919', 'mp-1070842', 'mp-1070877', 'mp-1070947', 'mp-1426778', 'mp-1700957', 'mp-1928483', 'mp-1591286', 'mp-1070942']",0.00064075,"{'La': 2.0, 'P': 2.0, 'Ir': 2.0}",125.1265182054605,[],NM,False,109,0,"[0, 0, 0, 0, 0, 0]",1.0241633974788212e-05,0.00064075,0,0.0012815,MP,data/source/MP/cleaned/cifs/MP-mp-12919.cif,False,,data/final/MP/graphs/Ir1La1P1-MP-mp-12919.json,0,True,4mm,0,0,0,0,5,0,0,0,0,1,0,1.0,False
Rh3Si5Tb2,1,0.0,2.0,False,Rh6Si10Tb4,Rh6Si10Tb4,0.0,Other,True,Rh30Si50Tb20,Rh-Si-Tb,3,Supercon,Tb2Rh3Si5,MP-mp-12879,Tb4Si10Rh6,Rh-Si-Tb,Rh30Si50Tb20,C 1 2/c 1,monoclinic,5.7163673,8.12734807,8.12734807,data/final/MP/cifs/Rh3Si5Tb2-MP-mp-12879.cif,data/source/MP/raw/cifs/mp-12879.cif,mp-12879,0.0,,2011-06-08 02:42:38,7.676839059474942,10.17188/1189240,"@misc{osti_1189240,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Tb2Si5Rh3 (SG:15) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189240"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668766'}},0.0071393154999999,7.47173572,520.0,-136.53262825,-6.826631412499999,{'tags': ['Terbium rhodium silicide (2/3/5)']},-136.53262825,-6.826631412499999,-0.9423088214999986,"['xas', 'bandstructure']",True,[154034],True,2021-05-12 10:56:53.126000,NM,20,9,mp-12879,,Tb2Si5Rh3,"{'functional': 'PBE', 'labels': ['Tb_3', 'Si', 'Rh_pv'], 'pot_type': 'paw'}","{'Tb': 2.0, 'Si': 5.0, 'Rh': 3.0}",GGA,mp-12879,"['mp-918767', 'mp-919790', 'mp-905788', 'mp-12879', 'mp-1143685', 'mp-1475787', 'mp-1668766', 'mp-1808749', 'mp-1608851']",0.0005278,"{'Tb': 4.0, 'Si': 10.0, 'Rh': 6.0}",331.80965586433865,[],NM,False,15,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.1813420174595075e-06,0.0005278,0,0.0010556,MP,data/source/MP/cleaned/cifs/MP-mp-12879.cif,False,,data/final/MP/graphs/Rh3Si5Tb2-MP-mp-12879.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
Au0.332Te0.668,2,0.0026666666666667,3.0,False,Au0.996Te2.004,Au1Te2,1.89,Other,True,Au33.2Te66.8,Au-Te,2,Supercon,Au0.332Te0.668,MP-mp-567525,Te2Au1,Au-Te,Au33.333Te66.667,C 1 2/m 1,monoclinic,4.228509889999999,4.228509889999999,5.15701111,data/final/MP/cifs/Au0.332Te0.668-MP-mp-567525-synth_doped.cif,data/source/MP/raw/cifs/mp-567525.cif,mp-567525,0.0,,2014-02-16 11:21:24,9.349466095623004,10.17188/1272560,"@misc{osti_1272560,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Te2Au (SG:12) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1272560"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668681'}},0.0177770462499995,6.52239204,520.0,-9.77688527,-3.2589617566666664,"{'tags': ['Gold telluride (1/2)', 'Gold ditelluride', 'Calaverite, average structure', 'High pressure experimental phase', 'Calaverite']}",-9.77688527,-3.2589617566666664,-0.3534672899999993,"['xas', 'bandstructure']",True,"[64681, 64682, 72435, 659325, 151373, 72434, 72437, 66625, 66626, 612390, 65105, 659328, 65104, 659326, 72438, 72436, 659327, 72439]",True,2021-05-12 10:57:23.123000,NM,3,7,mp-567525,,Te2Au,"{'functional': 'PBE', 'labels': ['Te', 'Au'], 'pot_type': 'paw'}","{'Te': 2.0, 'Au': 1.0}",GGA,mp-567525,"['mp-567525', 'mp-1441005', 'mp-1668681', 'mp-1799624', 'mp-1934226', 'mp-1595493', 'mp-1592789']",0.0002727,"{'Te': 2.0, 'Au': 1.0}",80.30835608746618,[],NM,False,12,0,"[0, 0, 0]",3.3956615884777227e-06,0.0002727,0,0.0002727,MP,data/source/MP/cleaned/cifs/MP-mp-567525.cif,True,,data/final/MP/graphs/Au0.332Te0.668-MP-mp-567525-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
C3Er0.2Th1.8,3,0.0799999999999999,4.0,False,C12Er0.8Th7.2,C12Th8,8.2,Other,True,C60Er4Th36,C-Er-Th,3,Supercon,C3Er0.2Th1.8,MP-mp-1188514,Th8C12,C-Th,C60Th40,I -4 3 d,cubic,7.414620251643706,7.41462025,7.41462025,data/final/MP/cifs/C3Er0.2Th1.8-MP-mp-1188514-synth_doped.cif,data/source/MP/raw/cifs/mp-1188514.cif,mp-1188514,0.0,,2019-01-11 19:30:01.530000,10.585910862659652,,,{'GGA': {'task_id': 'mp-1669546'}},0.0,8.12401413,520.0,-175.32363419,-8.7661817095,"{'tags': ['Pu2C3', 'Th2C3 hp', 'Thorium carbide (2/3)']}",-175.32363419,-8.7661817095,-0.2645699894999992,['bandstructure'],True,[618903],True,2021-05-12 10:58:33.577000,NM,20,5,mp-1188514,,Th2C3,"{'functional': 'PBE', 'labels': ['Th', 'C'], 'pot_type': 'paw'}","{'Th': 2.0, 'C': 3.0}",GGA,mp-1188514,"['mp-1188514', 'mp-1415692', 'mp-1669546', 'mp-1811506', 'mp-1605961']",0.000101475,"{'Th': 8.0, 'C': 12.0}",313.7941543668512,[],NM,False,220,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.2935231404134748e-06,0.000101475,0,0.0004059,MP,data/source/MP/cleaned/cifs/MP-mp-1188514.cif,True,,data/final/MP/graphs/C3Er0.2Th1.8-MP-mp-1188514-synth_doped.json,0,True,-43m,5,0,0,0,0,0,0,0,0,1,0,1.0,False
Ga22Nb78,3,0.06,0.0769160839160839,False,Ga1.692Nb6,Ga2Nb6,15.6,Other,True,Ga22Nb78,Ga-Nb,2,Supercon,Ga22Nb78,MP-mp-2670,Nb6Ga2,Ga-Nb,Ga25Nb75,P m -3 n,cubic,5.189021,5.189021,5.189021,data/final/MP/cifs/Ga22Nb78-MP-mp-2670-synth_doped.cif,data/source/MP/raw/cifs/mp-2670.cif,mp-2670,0.0,,2011-05-14 07:55:50,8.28234811962253,10.17188/1201220,"@misc{osti_1201220,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Ga (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201220"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686575'}},0.0550303606249986,4.96610647,520.0,-68.03986833,-8.50498354125,"{'tags': ['Gallium niobium (1/3)', 'Niobium gallide (3/1)']}",-68.03986833,-8.50498354125,-0.1719807556250003,"['xas', 'elasticity', 'bandstructure']",True,"[634772, 634745, 634746, 634774, 634731, 634748, 634762, 634767, 108484, 634734, 634761, 103831]",True,2021-05-12 10:56:18.721000,NM,8,9,mp-2670,,Nb3Ga,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Ga_d'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Ga': 1.0}",GGA,mp-2670,"['mp-928915', 'mp-912435', 'mp-929292', 'mp-2670', 'mp-1078851', 'mp-1440107', 'mp-1686575', 'mp-1781117', 'mp-1594502']",0.0001134,"{'Nb': 6.0, 'Ga': 2.0}",139.71926259628808,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.6232550600794926e-06,0.0001134,0,0.0002268,MP,data/source/MP/cleaned/cifs/MP-mp-2670.cif,True,,data/final/MP/graphs/Ga22Nb78-MP-mp-2670-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ag1Zn3,1,0.0,2.0,False,Ag2Zn6,Ag2Zn6,0.0,Other,True,Ag25Zn75,Ag-Zn,2,Supercon,Ag1Zn3,MP-mp-1187969,Zn6Ag2,Ag-Zn,Ag25Zn75,P 63/m m c,hexagonal,4.27214,5.829159996840743,5.82915944,data/final/MP/cifs/Ag1Zn3-MP-mp-1187969.cif,data/source/MP/raw/cifs/mp-1187969.cif,mp-1187969,0.0,,2019-01-11 15:29:23.844000,8.033423332603109,,,{'GGA': {'task_id': 'mp-1752144'}},0.0021005634999997,3.2406242,520.0,-13.55316941,-1.69414617625,{'tags': []},-13.55316941,-1.69414617625,-0.0411994679166667,['bandstructure'],True,[],True,2021-05-12 10:58:31.620000,NM,8,5,mp-1187969,,Zn3Ag,"{'functional': 'PBE', 'labels': ['Zn', 'Ag'], 'pot_type': 'paw'}","{'Zn': 3.0, 'Ag': 1.0}",GGA,mp-1187969,"['mp-1187969', 'mp-1323557', 'mp-1752144', 'mp-1930056', 'mp-1618432']",0.0004962,"{'Zn': 6.0, 'Ag': 2.0}",125.71526201443568,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",7.894029603868181e-06,0.0004962,0,0.0009924,MP,data/source/MP/cleaned/cifs/MP-mp-1187969.cif,False,,data/final/MP/graphs/Ag1Zn3-MP-mp-1187969.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ga0.8Ge0.2V3,3,0.0999999999999999,2.0,False,Ga1.6Ge0.4V6,Ga2V6,13.6,Other,True,Ga20Ge5V75,Ga-Ge-V,3,Supercon,Ga0.8Ge0.2V3,MP-mp-22568,V6Ga2,Ga-V,Ga25V75,P m -3 n,cubic,4.789645,4.789645,4.789645,data/final/MP/cifs/Ga0.8Ge0.2V3-MP-mp-22568-synth_doped.cif,data/source/MP/raw/cifs/mp-22568.cif,mp-22568,0.0,,2014-02-22 11:36:40,6.726541666276222,10.17188/1198793,"@misc{osti_1198793,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Ga (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198793"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686867'}},0.0,5.67452231,520.0,-61.95244347,-7.74405543375,{'tags': ['Gallium vanadium (1/3)']},-61.95244347,-7.74405543375,-0.1741018756249994,"['xas', 'elasticity', 'bandstructure']",True,"[635643, 635628, 635619, 635634, 104021, 635646, 635604, 635610, 635617, 635624, 635626, 635605, 635631, 635625, 635636, 635603, 104020, 635616, 635607]",True,2021-05-12 10:56:16.728000,FM,8,9,mp-22568,,V3Ga,"{'functional': 'PBE', 'labels': ['V_pv', 'Ga_d'], 'pot_type': 'paw'}","{'V': 3.0, 'Ga': 1.0}",GGA,mp-22568,"['mp-941343', 'mp-941663', 'mp-934924', 'mp-22568', 'mp-1440749', 'mp-1686867', 'mp-1804076', 'mp-1593784', 'mp-1595713']",0.09063635,"{'V': 6.0, 'Ga': 2.0}",109.87780534443452,[],FM,True,131,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.0, -0.0, -0.0]",0.0016497662965852,0.09063635,2,0.1812727,MP,data/source/MP/cleaned/cifs/MP-mp-22568.cif,True,,data/final/MP/graphs/Ga0.8Ge0.2V3-MP-mp-22568-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Cu1La2O4.18,2,0.0214882610425785,0.9569792663476876,True,Cu0.957La1.914O4,Cu1La2O4,0.0,Cuprate,True,Cu13.928La27.855O58.21727019498607,Cu-La-O,3,Supercon,La2Cu1O4.18,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La2O4.18-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La2O4.18-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
In0.4Sn0.6Te1,3,0.0999999999999999,2.0,False,In0.8Sn1.2Te2,In1Sn1Te2,4.51,Other,True,In20Sn30Te50,In-Sn-Te,3,Supercon,Sn0.6In0.4Te1,MP-mp-1223695,In1Sn1Te2,In-Sn-Te,In25Sn25Te50,R -3 m,trigonal,4.491411991560907,4.491411991560907,7.74007114,data/final/MP/cifs/In0.4Sn0.6Te1-MP-mp-1223695-synth_doped.cif,data/source/MP/raw/cifs/mp-1223695.cif,mp-1223695,0.0,,2019-01-13 00:03:17.400000,6.36982665353929,,,{'GGA': {'task_id': 'mp-1759626'}},0.0,6.13876223,520.0,-14.23566962,-3.558917405,{'tags': []},-14.23566962,-3.558917405,-0.5079530437499997,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,4,5,mp-1223695,,InSnTe2,"{'functional': 'PBE', 'labels': ['In_d', 'Sn_d', 'Te'], 'pot_type': 'paw'}","{'In': 1.0, 'Sn': 1.0, 'Te': 2.0}",GGA,mp-1223695,"['mp-1223695', 'mp-1442704', 'mp-1759626', 'mp-1790023', 'mp-1627352']",0.0015569,"{'In': 1.0, 'Sn': 1.0, 'Te': 2.0}",127.40565498597348,[],NM,False,166,0,"[0, 0, 0, 0]",1.2220022731105652e-05,0.0015569,0,0.0015569,MP,data/source/MP/cleaned/cifs/MP-mp-1223695.cif,True,,data/final/MP/graphs/In0.4Sn0.6Te1-MP-mp-1223695-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Fe3Si5Tb2,1,0.0,4.0,False,Fe12Si20Tb8,Fe12Si20Tb8,0.0,Other,True,Fe30Si50Tb20,Fe-Si-Tb,3,Supercon,Tb2Fe3Si5,MP-mp-22468,Tb8Fe12Si20,Fe-Si-Tb,Fe30Si50Tb20,P 4/m n c,tetragonal,5.507792,10.39271,10.39271,data/final/MP/cifs/Fe3Si5Tb2-MP-mp-22468.cif,data/source/MP/raw/cifs/mp-22468.cif,mp-22468,0.0,,2014-02-19 15:22:34,6.987449135929459,10.17188/1198337,"@misc{osti_1198337,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Tb2Fe3Si5 (SG:128) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198337"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1729561'}},0.0,7.33807577,520.0,-274.88167157,-6.87204178925,"{'tags': ['Terbium iron silicide (2/3/5)', 'Iron terbium silicide (3/2/5)']}",-274.88167157,-6.87204178925,-0.6560090242499989,['xas'],False,"[633581, 53549, 53550]",True,2021-05-12 10:56:59.077000,NM,40,8,mp-22468,,Tb2Fe3Si5,"{'functional': 'PBE', 'labels': ['Tb_3', 'Fe_pv', 'Si'], 'pot_type': 'paw'}","{'Tb': 2.0, 'Fe': 3.0, 'Si': 5.0}",GGA,mp-22468,"['mp-996520', 'mp-22468', 'mp-1156120', 'mp-1196226', 'mp-1258599', 'mp-1400701', 'mp-1729561', 'mp-1937491']",0.001762,"{'Tb': 8.0, 'Fe': 12.0, 'Si': 20.0}",594.8879179101048,[],NM,False,128,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",1.1847609924169017e-05,0.001762,0,0.007048,MP,data/source/MP/cleaned/cifs/MP-mp-22468.cif,False,,data/final/MP/graphs/Fe3Si5Tb2-MP-mp-22468.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ga6Sm1,1,0.0,2.0,False,Ga12Sm2,Ga12Sm2,0.0,Other,True,Ga85.714Sm14.286,Ga-Sm,2,Supercon,Ga6Sm1,MP-mp-1104451,Sm2Ga12,Ga-Sm,Ga85.714Sm14.286,P 4/n b m,tetragonal,6.056946,6.056946,7.618883,data/final/MP/cifs/Ga6Sm1-MP-mp-1104451.cif,data/source/MP/raw/cifs/mp-1104451.cif,mp-1104451,0.0,,2018-07-18 22:04:22,6.757127071551144,,,{'GGA': {'task_id': 'mp-1669841'}},0.0,3.75230065,520.0,-50.41244923,-3.600889230714286,{'tags': ['Samarium gallide (1/6)']},-50.41244923,-3.600889230714286,-0.3312946207142855,['bandstructure'],True,[635434],True,2021-05-12 10:58:20.361000,NM,14,4,mp-1104451,,SmGa6,"{'functional': 'PBE', 'labels': ['Sm_3', 'Ga_d'], 'pot_type': 'paw'}","{'Sm': 1.0, 'Ga': 6.0}",GGA,mp-1104451,"['mp-1104451', 'mp-1436835', 'mp-1669841', 'mp-1600114']",1.635e-05,"{'Sm': 2.0, 'Ga': 12.0}",279.510873807056,[],NM,False,125,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.169900818333549e-07,1.635e-05,0,3.27e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1104451.cif,False,,data/final/MP/graphs/Ga6Sm1-MP-mp-1104451.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ce1Ge0.03Pt3Si0.97,2,0.012,1.0,True,Ce1Ge0.03Pt3Si0.97,Ce1Pt3Si1,0.63,Heavy_fermion,True,Ce20Ge0.6Pt60Si19.4,Ce-Ge-Pt-Si,4,Supercon,Ce1Pt3Si0.97Ge0.03,MP-mp-1207119,Ce1Si1Pt3,Ce-Pt-Si,Ce20Pt60Si20,P 4 m m,tetragonal,4.067884,4.067884,5.552623,data/final/MP/cifs/Ce1Ge0.03Pt3Si0.97-MP-mp-1207119-synth_doped.cif,data/source/MP/raw/cifs/mp-1207119.cif,mp-1207119,0.0,,2019-01-12 10:17:34.047000,13.616649050512317,,,,0.0,7.99187805,520.0,-34.84666915,-6.969333829999999,"{'tags': ['CePt3Si', 'CePt3B']}",-34.84666915,-6.969333829999999,-1.0409085689999995,[],False,[],True,2021-05-12 11:00:19.396000,NM,5,2,mp-1207119,,CeSiPt3,"{'functional': 'PBE', 'labels': ['Ce', 'Si', 'Pt'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Si': 1.0, 'Pt': 3.0}",GGA,mp-1207119,"['mp-1207119', 'mp-1923489']",0.0099182,"{'Ce': 1.0, 'Si': 1.0, 'Pt': 3.0}",91.88302988314366,[],NM,False,99,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",0.0001079437629844,0.0099182,0,0.0099182,MP,data/source/MP/cleaned/cifs/MP-mp-1207119.cif,True,,data/final/MP/graphs/Ce1Ge0.03Pt3Si0.97-MP-mp-1207119-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
Lu1S1,1,0.0,1.0,True,Lu1S1,Lu1S1,1.1,Other,True,Lu50S50,Lu-S,2,Supercon,Lu1S1,MP-mp-656,Lu1S1,Lu-S,Lu50S50,F m -3 m,cubic,3.80744899,3.80744899,3.80744899,data/final/MP/cifs/Lu1S1-MP-mp-656.cif,data/source/MP/raw/cifs/mp-656.cif,mp-656,0.0,,2011-05-12 17:29:55,8.808445912635673,10.17188/1281322,"@misc{osti_1281322,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LuS (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281322"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1670469'}},0.0,6.90747705,520.0,-12.40094764,-6.20047382,"{'tags': ['Lutetium sulfide (1/1)', 'Lutetium sulfide (3.94/4.06)']}",-12.40094764,-6.20047382,-2.1232736265625,"['xas', 'bandstructure']",True,"[642561, 642567, 44917, 642575, 659893]",True,2021-05-12 10:57:32.679000,NM,2,9,mp-656,,LuS,"{'functional': 'PBE', 'labels': ['Lu_3', 'S'], 'pot_type': 'paw'}","{'Lu': 1.0, 'S': 1.0}",GGA,mp-656,"['mp-992926', 'mp-990955', 'mp-656', 'mp-19831', 'mp-1442130', 'mp-1670469', 'mp-1783849', 'mp-994224', 'mp-1589726']",0.0008089,"{'Lu': 1.0, 'S': 1.0}",39.028987343065104,[],NM,False,225,0,"[0, 0]",2.072562100804109e-05,0.0008089,0,0.0008089,MP,data/source/MP/cleaned/cifs/MP-mp-656.cif,False,,data/final/MP/graphs/Lu1S1-MP-mp-656.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Er0.6Pd2Sn1Y0.4,2,0.0499999999999999,2.0,False,Er1.2Pd4Sn2Y0.8,Er1Pd4Sn2Y1,2.59,Other,True,Er15Pd50Sn25Y10,Er-Pd-Sn-Y,4,Supercon,Er0.6Y0.4Pd2Sn1,MP-mp-1215927,Y1Er1Sn2Pd4,Er-Pd-Sn-Y,Er12.5Pd50Sn25Y12.5,R -3 m,trigonal,4.808699938678648,4.808699938678648,8.28866616,data/final/MP/cifs/Er0.6Pd2Sn1Y0.4-MP-mp-1215927-synth_doped.cif,data/source/MP/raw/cifs/mp-1215927.cif,mp-1215927,0.0,,2019-01-12 17:31:35.587000,9.760223968368964,,,{'GGA': {'task_id': 'mp-1752553'}},0.0019414149999992,6.22720604,520.0,-46.81531429,-5.85191428625,{'tags': []},-46.81531429,-5.85191428625,-0.8803066770833343,['bandstructure'],True,[],True,2021-05-12 10:58:39.488000,NM,8,5,mp-1215927,,YEr(SnPd2)2,"{'functional': 'PBE', 'labels': ['Y_sv', 'Er_3', 'Sn_d', 'Pd'], 'pot_type': 'paw'}","{'Y': 1.0, 'Er': 1.0, 'Sn': 2.0, 'Pd': 4.0}",GGA,mp-1215927,"['mp-1215927', 'mp-1402669', 'mp-1752553', 'mp-1779486', 'mp-1618844']",0.0007625,"{'Y': 1.0, 'Er': 1.0, 'Sn': 2.0, 'Pd': 4.0}",156.39755818352177,[],NM,False,166,0,"[0, 0, 0, 0, 0, 0, 0, 0]",4.87539581088126e-06,0.0007625,0,0.0007625,MP,data/source/MP/cleaned/cifs/MP-mp-1215927.cif,True,,data/final/MP/graphs/Er0.6Pd2Sn1Y0.4-MP-mp-1215927-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Sr4V3O9.73,3,0.0781829049611476,0.25,False,Sr1V0.75O2.4325,Sr1V1O3,0.0,Oxide,True,Sr23.909V17.932O58.15899581589958,Sr-V-O,3,Supercon,Sr4V3O9.73,MP-mp-18717,Sr1V1O3,Sr-V-O,Sr20V20O60,P m -3 m,cubic,3.900891,3.900891,3.900891,data/final/MP/cifs/Sr4V3O9.73-MP-mp-18717-synth_doped.cif,data/source/MP/raw/cifs/mp-18717.cif,mp-18717,0.0,,2014-02-15 00:19:39,5.21885807260035,10.17188/1193364,"@misc{osti_1193364,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SrVO3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1193364"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",,0.0391016768603389,4.67096136,520.0,-36.25355595,-7.25071119,{'tags': ['Strontium vanadate(IV)']},-36.25355595,-7.25071119,-2.8794546823333342,"['xas', 'elasticity']",False,"[108826, 96291, 88982]",True,2021-05-12 10:56:14.760000,FM,5,2,mp-18717,oxide,SrVO3,"{'functional': 'PBE', 'labels': ['Sr_sv', 'V_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 1.0, 'V': 1.0, 'O': 3.0}",GGA+U,mp-18717,"['mp-18717', 'mp-1794484']",0.999467,"{'Sr': 1.0, 'V': 1.0, 'O': 3.0}",59.35966561911505,[],FM,True,221,1,"[0.0, 1.1, 0.0, 0.0, 0.0]",0.0168374769226825,0.999467,1,0.999467,MP,data/source/MP/cleaned/cifs/MP-mp-18717.cif,True,,data/final/MP/graphs/Sr4V3O9.73-MP-mp-18717-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
C2Gd1,3,0.1333333333333334,6.0,False,C12Gd6,C12Gd8,0.0,Carbon,True,C66.667Gd33.333,C-Gd,2,Supercon,C2Gd1,MP-mp-1189998,Gd8C12,C-Gd,C60Gd40,I -4 3 d,cubic,7.233040711603452,7.23304071,7.233040710000001,data/final/MP/cifs/C2Gd1-MP-mp-1189998-synth_doped.cif,data/source/MP/raw/cifs/mp-1189998.cif,mp-1189998,0.0,,2019-01-11 20:37:02.399000,7.992746631496947,,,{'GGA': {'task_id': 'mp-1708587'}},0.0,4.89909349,520.0,-227.94420282,-11.397210141,"{'tags': ['Gadolinium carbide (2/3)', 'Pu2C3', 'Gd2C3 rt']}",-227.94420282,-11.397210141,-0.2306928249999984,['bandstructure'],True,"[109323, 602774]",True,2021-05-12 10:58:33.577000,FM,20,5,mp-1189998,,Gd2C3,"{'functional': 'PBE', 'labels': ['Gd', 'C'], 'pot_type': 'paw'}","{'Gd': 2.0, 'C': 3.0}",GGA,mp-1189998,"['mp-1189998', 'mp-1431508', 'mp-1708587', 'mp-1806515', 'mp-1608157']",13.9415254,"{'Gd': 8.0, 'C': 12.0}",291.3002365687764,[],FM,True,43,1,"[6.9, 7.0, 7.0, 6.9, 7.0, 6.9, 7.0, 6.9, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.1914385729887093,13.9415254,8,55.7661016,MP,data/source/MP/cleaned/cifs/MP-mp-1189998.cif,True,,data/final/MP/graphs/C2Gd1-MP-mp-1189998-synth_doped.json,0,True,-43m,5,0,0,0,0,0,0,0,0,1,0,1.0,False
Nd0.25Os4Pr0.75Sb12,3,0.0294117647058823,1.0,True,Nd0.25Os4Pr0.75Sb12,Os4Pr1Sb12,1.48,Heavy_fermion,True,Nd1.471Os23.529Pr4.412Sb70.588,Nd-Os-Pr-Sb,4,Supercon,Pr0.75Nd0.25Os4Sb12,MP-mp-4251,Pr1Sb12Os4,Os-Pr-Sb,Os23.529Pr5.882Sb70.588,I m -3,cubic,8.16020751180899,8.16020751,8.16020751,data/final/MP/cifs/Nd0.25Os4Pr0.75Sb12-MP-mp-4251-synth_doped.cif,data/source/MP/raw/cifs/mp-4251.cif,mp-4251,0.0,,2011-05-15 09:44:04,9.380402650313032,10.17188/1208003,"@misc{osti_1208003,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Pr(Sb3Os)4 (SG:204) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208003"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700242'}},0.0086126564705901,7.28147826,520.0,-102.089288,-6.005252235294117,{'tags': ['Praseodymium osmium antimonide (1/4/12)']},-102.089288,-6.005252235294117,-0.1677005267647063,"['xas', 'elasticity', 'bandstructure']",True,"[155178, 155187, 165911, 155182, 155185, 155181, 647731, 155183, 155188, 155180, 155179, 165910, 155184, 155186, 183087]",True,2021-05-12 10:56:20.740000,NM,17,9,mp-4251,,Pr(Sb3Os)4,"{'functional': 'PBE', 'labels': ['Pr_3', 'Sb', 'Os_pv'], 'pot_type': 'paw'}","{'Pr': 1.0, 'Sb': 12.0, 'Os': 4.0}",GGA,mp-4251,"['mp-1000443', 'mp-1006919', 'mp-4251', 'mp-1188290', 'mp-1430112', 'mp-1700242', 'mp-1817791', 'mp-1011635', 'mp-1609307']",0.0526026,"{'Pr': 1.0, 'Sb': 12.0, 'Os': 4.0}",418.2940787754696,[],NM,False,204,0,"[-0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.000125755067234,0.0526026,0,0.0526026,MP,data/source/MP/cleaned/cifs/MP-mp-4251.cif,True,,data/final/MP/graphs/Nd0.25Os4Pr0.75Sb12-MP-mp-4251-synth_doped.json,0,True,m-3,2,0,0,0,0,0,0,0,0,1,0,1.0,False
La0.8Os4Pr0.2Sb12,3,0.0235294117647058,1.0,True,La0.8Os4Pr0.2Sb12,La1Os4Sb12,0.9865,Other,True,La4.706Os23.529Pr1.176Sb70.588,La-Os-Pr-Sb,4,Supercon,Pr0.2La0.8Os4Sb12,MP-mp-1106066,La1Sb12Os4,La-Os-Sb,La5.882Os23.529Sb70.588,I m -3,cubic,8.169493031811049,8.16949303,8.16949303,data/final/MP/cifs/La0.8Os4Pr0.2Sb12-MP-mp-1106066-synth_doped.cif,data/source/MP/raw/cifs/mp-1106066.cif,mp-1106066,0.0,,2018-07-19 07:39:03,9.340532263900675,,,{'GGA': {'task_id': 'mp-1668888'}},0.0,7.58379109,520.0,-102.78670558,-6.04627679882353,"{'tags': ['LaOs4Sb12', 'Lanthanum osmium antimonide (1/4/12)', 'LaFe4P12']}",-102.78670558,-6.04627679882353,-0.1996010926470591,['bandstructure'],True,"[183085, 641617]",True,2021-05-12 10:58:22.271000,NM,17,6,mp-1106066,,La(Sb3Os)4,"{'functional': 'PBE', 'labels': ['La', 'Sb', 'Os_pv'], 'pot_type': 'paw'}","{'La': 1.0, 'Sb': 12.0, 'Os': 4.0}",GGA,mp-1106066,"['mp-1106066', 'mp-1190143', 'mp-1436423', 'mp-1668888', 'mp-1822649', 'mp-1607939']",0.0172651,"{'La': 1.0, 'Sb': 12.0, 'Os': 4.0}",419.7236384696232,[],NM,False,204,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",4.113444756876502e-05,0.0172651,0,0.0172651,MP,data/source/MP/cleaned/cifs/MP-mp-1106066.cif,True,,data/final/MP/graphs/La0.8Os4Pr0.2Sb12-MP-mp-1106066-synth_doped.json,0,True,m-3,2,0,0,0,0,0,0,0,0,1,0,1.0,False
Bi1Zr3,1,0.0,4.0,False,Bi4Zr12,Bi4Zr12,2.84,Other,True,Bi25Zr75,Bi-Zr,2,Supercon,Bi1Zr3,MP-mp-1207416,Zr12Bi4,Bi-Zr,Bi25Zr75,I -4,tetragonal,5.875515,8.67222168,8.67222134162444,data/final/MP/cifs/Bi1Zr3-MP-mp-1207416.cif,data/source/MP/raw/cifs/mp-1207416.cif,mp-1207416,0.0,,2019-01-12 10:31:50.928000,8.195460348294507,,,,0.0,5.25245291,520.0,-122.05325839,-7.628328649375,"{'tags': ['Zr3Bi', 'Ni3P']}",-122.05325839,-7.628328649375,-0.2450445993750003,[],False,[],True,2021-05-12 11:00:19.396000,NM,16,2,mp-1207416,,Zr3Bi,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Bi'], 'pot_type': 'paw'}","{'Zr': 3.0, 'Bi': 1.0}",GGA,mp-1207416,"['mp-1207416', 'mp-1840027']",0.000559875,"{'Zr': 12.0, 'Bi': 4.0}",391.174202169149,[],NM,False,82,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.72507079347633e-06,0.000559875,0,0.0022395,MP,data/source/MP/cleaned/cifs/MP-mp-1207416.cif,False,,data/final/MP/graphs/Bi1Zr3-MP-mp-1207416.json,0,True,-4,0,0,0,0,2,0,0,0,0,1,0,1.0,False
Fe0.98Mn0.02Se0.5Te0.5,2,0.02,2.0,False,Fe1.96Mn0.04Se1Te1,Fe2Se1Te1,14.4,Ferrite,True,Fe49Mn1Se25Te25,Fe-Mn-Se-Te,4,Supercon,Fe0.98Mn0.02Se0.5Te0.5,MP-mp-1225136,Fe2Te1Se1,Fe-Se-Te,Fe50Se25Te25,P 4 m m,tetragonal,3.755398,3.755398,5.937717,data/final/MP/cifs/Fe0.98Mn0.02Se0.5Te0.5-MP-mp-1225136-synth_doped.cif,data/source/MP/raw/cifs/mp-1225136.cif,mp-1225136,0.0,,2019-01-13 01:17:25.998000,6.310824077785493,,,{'GGA': {'task_id': 'mp-1764167'}},0.0802741556250001,4.86336573,520.0,-24.0729629,-6.018240725,{'tags': []},-24.0729629,-6.018240725,-0.3469333980859375,['bandstructure'],True,[],True,2021-05-12 10:58:45.495000,FM,4,5,mp-1225136,,Fe2TeSe,"{'functional': 'PBE', 'labels': ['Fe_pv', 'Te', 'Se'], 'pot_type': 'paw'}","{'Fe': 2.0, 'Te': 1.0, 'Se': 1.0}",GGA,mp-1225136,"['mp-1225136', 'mp-1425562', 'mp-1764167', 'mp-1784460', 'mp-1615275']",0.1061773,"{'Fe': 2.0, 'Te': 1.0, 'Se': 1.0}",83.73970680084179,[],FM,True,99,1,"[0.1, 0.1, -0.0, -0.0]",0.0012679444920021,0.1061773,2,0.1061773,MP,data/source/MP/cleaned/cifs/MP-mp-1225136.cif,True,,data/final/MP/graphs/Fe0.98Mn0.02Se0.5Te0.5-MP-mp-1225136-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
C0.987Ta1,2,0.0065425264217413,1.0,True,C0.987Ta1,C1Ta1,9.7,Other,True,C49.673Ta50.327,C-Ta,2,Supercon,C0.987Ta1,MP-mp-1086,Ta1C1,C-Ta,C50Ta50,F m -3 m,cubic,3.16930633,3.1693063299999995,3.1693063299999995,data/final/MP/cifs/C0.987Ta1-MP-mp-1086-synth_doped.cif,data/source/MP/raw/cifs/mp-1086.cif,mp-1086,0.0,,2011-05-12 17:28:32,14.234280973849424,10.17188/1187404,"@misc{osti_1187404,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TaC (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187404"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686613'}},0.0,8.2505789,520.0,-22.23710222,-11.11855111,"{'tags': ['Tantalum carbide (1/1)', 'Tantalum(IV) carbide']}",-22.23710222,-11.11855111,-0.5762719450000002,"['xas', 'elasticity', 'bandstructure']",True,"[618845, 618833, 53974, 618820, 618830, 159875, 618843, 618846, 618823, 618841, 77406, 618844, 618825, 159878, 159877, 618828, 618831, 618848, 44497, 618838, 26956, 155163, 43525, 618839, 618835, 185979, 38239, 618829, 618837, 618832, 159879, 159876, 180601, 601144, 618847, 618818, 618836]",True,2021-05-12 10:56:10.715000,NM,2,14,mp-1086,,TaC,"{'functional': 'PBE', 'labels': ['Ta_pv', 'C'], 'pot_type': 'paw'}","{'Ta': 1.0, 'C': 1.0}",GGA,mp-1086,"['mp-992237', 'mp-990522', 'mp-1086', 'mp-1059363', 'mp-1059373', 'mp-1059393', 'mp-1237232', 'mp-1440573', 'mp-1686613', 'mp-1792077', 'mp-993854', 'mp-1596236', 'mp-1595188', 'mp-1059385']",0.0001919,"{'Ta': 1.0, 'C': 1.0}",22.51011209588414,[],NM,False,225,0,"[0, 0]",8.525057502271965e-06,0.0001919,0,0.0001919,MP,data/source/MP/cleaned/cifs/MP-mp-1086.cif,True,,data/final/MP/graphs/C0.987Ta1-MP-mp-1086-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ba1Cu0.2Si1.8,3,0.1333333333333333,4.0,False,Ba4Cu0.8Si7.2,Ba4Si8,3.02,Other,True,Ba33.333Cu6.667Si60,Ba-Cu-Si,3,Supercon,Ba1Cu0.2Si1.8,MP-mp-7275,Ba4Si8,Ba-Si,Ba33.333Si66.667,P 43 3 2,cubic,6.771439,6.771439,6.771439,data/final/MP/cifs/Ba1Cu0.2Si1.8-MP-mp-7275-synth_doped.cif,data/source/MP/raw/cifs/mp-7275.cif,mp-7275,0.0153999999999996,,2011-05-29 01:48:04,4.139450158250275,10.17188/1287630,"@misc{osti_1287630,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BaSi2 (SG:212) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1287630"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1670265'}},0.0134410304166667,5.20254346,520.0,-55.23987066,-4.603322555,{'tags': ['Barium silicide (1/2)']},-55.23987066,-4.603322555,-0.2994562650000005,"['bandstructure', 'elasticity']",True,"[2218, 602228]",True,2021-05-12 10:56:29.056000,NM,12,11,mp-7275,,BaSi2,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Si'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Si': 2.0}",GGA,mp-7275,"['mp-908584', 'mp-923646', 'mp-922864', 'mp-7275', 'mp-1125089', 'mp-1145782', 'mp-1255475', 'mp-1432707', 'mp-1670265', 'mp-1808748', 'mp-1599442']",0.0,"{'Ba': 4.0, 'Si': 8.0}",310.48663568862327,[],NM,False,212,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0,0.0,0,0.0,MP,data/source/MP/cleaned/cifs/MP-mp-7275.cif,True,,data/final/MP/graphs/Ba1Cu0.2Si1.8-MP-mp-7275-synth_doped.json,0,True,432,4,0,0,0,0,0,0,1,0,0,0,1.0,False
Au0.242Nb0.758,2,0.016,8.0,False,Au1.936Nb6.064,Au2Nb6,10.56,Other,True,Au24.2Nb75.8,Au-Nb,2,Supercon,Au0.242Nb0.758,MP-mp-2752,Nb6Au2,Au-Nb,Au25Nb75,P m -3 n,cubic,5.256336,5.256336,5.256336,data/final/MP/cifs/Au0.242Nb0.758-MP-mp-2752-synth_doped.cif,data/source/MP/raw/cifs/mp-2752.cif,mp-2752,0.0,,2011-05-14 04:00:34,10.878019698243486,10.17188/1201733,"@misc{osti_1201733,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Au (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201733"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677627'}},0.0265571000000033,5.43391329,520.0,-67.6805768,-8.4600721,{'tags': ['Gold niobium (1/3)']},-67.6805768,-8.4600721,-0.0656229350000003,"['xas', 'elasticity', 'bandstructure']",True,"[612199, 58557, 612192, 612186, 612203, 612188, 612198, 612185]",True,2021-05-12 10:56:18.721000,FM,8,8,mp-2752,,Nb3Au,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Au'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Au': 1.0}",GGA,mp-2752,"['mp-941043', 'mp-934500', 'mp-940884', 'mp-2752', 'mp-1437534', 'mp-1677627', 'mp-1787383', 'mp-1591584']",0.84123765,"{'Nb': 6.0, 'Au': 2.0}",145.22766553647008,[],FM,True,223,1,"[0.2, 0.2, 0.2, 0.2, 0.2, 0.2, 0.0, 0.0]",0.0115850881013954,0.84123765,6,1.6824753,MP,data/source/MP/cleaned/cifs/MP-mp-2752.cif,True,,data/final/MP/graphs/Au0.242Nb0.758-MP-mp-2752-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ge2Pt2Th1,1,0.0,2.0,False,Ge4Pt4Th2,Ge4Pt4Th2,1.1,Other,True,Ge40Pt40Th20,Ge-Pt-Th,3,Supercon,Th1Pt2Ge2,MP-mp-1078793,Th2Ge4Pt4,Ge-Pt-Th,Ge40Pt40Th20,P 4/n m m,tetragonal,4.367496,4.367496,10.190208,data/final/MP/cifs/Ge2Pt2Th1-MP-mp-1078793.cif,data/source/MP/raw/cifs/mp-1078793.cif,mp-1078793,0.0,,2018-04-13 00:54:41,13.112983313371318,,,{'GGA': {'task_id': 'mp-1704303'}},0.0,6.94331732,520.0,-66.80798821,-6.680798821000001,{'tags': ['Platinum thorium germanide (2/1/2)']},-66.80798821,-6.680798821000001,-0.9204529450000004,['bandstructure'],True,[637658],True,2021-05-12 10:58:16.596000,NM,10,5,mp-1078793,,Th(GePt)2,"{'functional': 'PBE', 'labels': ['Th', 'Ge_d', 'Pt'], 'pot_type': 'paw'}","{'Th': 1.0, 'Ge': 2.0, 'Pt': 2.0}",GGA,mp-1078793,"['mp-1078793', 'mp-1432014', 'mp-1704303', 'mp-1784936', 'mp-1598479']",0.00016345,"{'Th': 2.0, 'Ge': 4.0, 'Pt': 4.0}",194.37843475349555,[],NM,False,129,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.6817709249205757e-06,0.00016345,0,0.0003269,MP,data/source/MP/cleaned/cifs/MP-mp-1078793.cif,False,,data/final/MP/graphs/Ge2Pt2Th1-MP-mp-1078793.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ba1Si2,1,0.0,8.0,False,Ba8Si16,Ba8Si16,5.3,Other,True,Ba33.333Si66.667,Ba-Si,2,Supercon,Ba1Si2,MP-mp-1477,Ba8Si16,Ba-Si,Ba33.333Si66.667,P n m a,orthorhombic,6.77785,9.009468,11.602143,data/final/MP/cifs/Ba1Si2-MP-mp-1477.cif,data/source/MP/raw/cifs/mp-1477.cif,mp-1477,0.7909999999999999,,2011-05-15 23:39:31,3.628158493276176,10.17188/1190885,"@misc{osti_1190885,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BaSi2 (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1190885"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1767743'}},0.0,3.41998799,520.0,-110.80232605,-4.616763585416667,"{'tags': ['Dibarium tetrasilicide', 'Barium silicide (1/2)']}",-110.80232605,-4.616763585416667,-0.3128972954166673,"['diel', 'xas', 'elasticity', 'bandstructure']",True,"[409973, 15126, 157611, 185375, 183151, 616143, 94260, 191761, 168407]",True,2021-05-12 10:56:12.755000,NM,24,17,mp-1477,,BaSi2,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Si'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Si': 2.0}",GGA,mp-1477,"['mp-679569', 'mp-664662', 'mp-571012', 'mp-1477', 'mp-1124948', 'mp-1138324', 'mp-1140312', 'mp-1191121', 'mp-1191407', 'mp-1191591', 'mp-1191798', 'mp-1261824', 'mp-1504834', 'mp-1767743', 'mp-1884961', 'mp-1612419', 'mp-700624']",0.0005222625,"{'Ba': 8.0, 'Si': 16.0}",708.4828050470915,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.897249686564079e-06,0.0005222625,0,0.0041781,MP,data/source/MP/cleaned/cifs/MP-mp-1477.cif,False,,data/final/MP/graphs/Ba1Si2-MP-mp-1477.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ca1.843Cl2Cu1Na0.157O2,3,0.0448571428571428,1.0,True,Ca1.843Cl2Cu1Na0.157O2,Ca2Cl2Cu1O2,25.0,Cuprate,True,Ca26.329Cl28.571Cu14.286Na2.243O28.571428571428573,Ca-Cl-Cu-Na-O,5,Supercon,Ca1.843Na0.157Cu1Cl2O2,MP-mp-23143,Ca2Cu1Cl2O2,Ca-Cl-Cu-O,Ca28.571Cl28.571Cu14.286O28.571428571428573,I 4/m m m,tetragonal,3.88024600076171,3.880246000761709,8.12907187,data/final/MP/cifs/Ca1.843Cl2Cu1Na0.157O2-MP-mp-23143-synth_doped.cif,data/source/MP/raw/cifs/mp-23143.cif,mp-23143,0.0,,2014-02-21 09:50:06,3.554337150605878,10.17188/1199263,"@misc{osti_1199263,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ca2Cu(ClO)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199263"",
    place = ""United States"",
    year = ""2016"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700223'}},0.0191527683333321,4.19679796,520.0,-35.95348475,-5.136212107142858,"{'tags': ['Dicalcium copper dioxide dichloride', 'Dicalcium dichlorodioxocuprate']}",-35.95348475,-5.136212107142858,-2.407440427142858,"['xas', 'elasticity', 'bandstructure']",True,"[1027, 83117, 41581]",True,2021-05-12 10:56:16.728000,NM,7,8,mp-23143,oxide,Ca2Cu(ClO)2,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Cu_pv', 'Cl', 'O'], 'pot_type': 'paw'}","{'Ca': 2.0, 'Cu': 1.0, 'Cl': 2.0, 'O': 2.0}",GGA,mp-23143,"['mp-992231', 'mp-990553', 'mp-23143', 'mp-1436301', 'mp-1700223', 'mp-1803462', 'mp-993865', 'mp-1592909']",0.0134962,"{'Ca': 2.0, 'Cu': 1.0, 'Cl': 2.0, 'O': 2.0}",115.21141865211318,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001171429026557,0.0134962,0,0.0134962,MP,data/source/MP/cleaned/cifs/MP-mp-23143.cif,True,,data/final/MP/graphs/Ca1.843Cl2Cu1Na0.157O2-MP-mp-23143-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ru0.995Sr2Ti0.005O4,2,0.0014285714285714,1.0,True,Ru0.995Sr2Ti0.005O4,Ru1Sr2O4,0.0,Oxide,True,Ru14.214Sr28.571Ti0.071O57.142857142857146,Ru-Sr-Ti-O,4,Supercon,Sr2Ru0.995Ti0.005O4,MP-mp-4596,Sr2Ru1O4,Ru-Sr-O,Ru14.286Sr28.571O57.142857142857146,I 4/m m m,tetragonal,3.90349200031108,3.90349200031108,7.01667232,data/final/MP/cifs/Ru0.995Sr2Ti0.005O4-MP-mp-4596-synth_doped.cif,data/source/MP/raw/cifs/mp-4596.cif,mp-4596,0.0,,2011-05-13 08:08:22,5.748954439320184,10.17188/1208277,"@misc{osti_1208277,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr2RuO4 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208277"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668168'}},0.0,4.0615071,520.0,-47.01379905,-6.716257007142858,"{'tags': ['Distrontium ruthenium(IV) oxide', 'Distrontium ruthenate(IV)']}",-47.01379905,-6.716257007142858,-2.473796924047619,"['xas', 'bandstructure']",True,"[84484, 94191, 41609, 41610, 78630, 78285, 94194, 78631, 94193, 41607, 33802, 78629, 94184, 75151, 82898, 41604, 94200, 78286, 157401, 94189, 83110, 75152, 94188, 94197, 94199, 94185, 188554, 83109, 94198, 90737, 94192, 94195, 83111, 41606, 94186, 41608, 41605, 73395, 94187, 94196, 73394, 94190]",True,2021-05-12 10:57:08.928000,FM,7,10,mp-4596,oxide,Sr2RuO4,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ru_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ru': 1.0, 'O': 4.0}",GGA,mp-4596,"['mp-921970', 'mp-922219', 'mp-907609', 'mp-4596', 'mp-1078075', 'mp-1440912', 'mp-1668168', 'mp-1797475', 'mp-1594347', 'mp-1595037']",1.6420578,"{'Sr': 2.0, 'Ru': 1.0, 'O': 4.0}",98.29510225301225,[],FM,True,139,1,"[0.0, 0.0, 1.1, 0.0, 0.0, 0.0, 0.0]",0.0167053877798848,1.6420578,1,1.6420578,MP,data/source/MP/cleaned/cifs/MP-mp-4596.cif,True,,data/final/MP/graphs/Ru0.995Sr2Ti0.005O4-MP-mp-4596-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Fe1U6,1,0.0,2.0,False,Fe2U12,Fe2U12,3.88875,Heavy_fermion,True,Fe14.286U85.714,Fe-U,2,Supercon,Fe1U6,MP-mp-21108,U12Fe2,Fe-U,Fe14.286U85.714,I 4/m c m,tetragonal,5.253242000907672,7.6369545005846255,7.6369545,data/final/MP/cifs/Fe1U6-MP-mp-21108.cif,data/source/MP/raw/cifs/mp-21108.cif,mp-21108,0.0,,2014-02-19 11:56:24,18.24423563918276,10.17188/1196387,"@misc{osti_1196387,
    author = ""Persson, Kristin"",
    title = ""Materials Data on U6Fe (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196387"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695170'}},0.0163147910714283,13.83249918,520.0,-152.51387764,-10.893848402857143,{'tags': ['Iron uranium (1/6)']},-152.51387764,-10.893848402857143,-0.0054957585714297,"['xas', 'bandstructure']",True,"[103675, 103674, 103678, 103676, 103677, 150485, 103673]",True,2021-05-12 10:56:57.051000,NM,14,8,mp-21108,,U6Fe,"{'functional': 'PBE', 'labels': ['U', 'Fe_pv'], 'pot_type': 'paw'}","{'U': 6.0, 'Fe': 1.0}",GGA,mp-21108,"['mp-919573', 'mp-905336', 'mp-918548', 'mp-21108', 'mp-1426891', 'mp-1695170', 'mp-1925522', 'mp-1597921']",0.16630455,"{'U': 12.0, 'Fe': 2.0}",270.1423810919332,[],NM,False,140,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0012312362786452,0.16630455,0,0.3326091,MP,data/source/MP/cleaned/cifs/MP-mp-21108.cif,False,,data/final/MP/graphs/Fe1U6-MP-mp-21108.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Bi2Ca0.7Cu2Gd0.3Sr2O8,3,0.04,2.0,False,Bi4Ca1.4Cu4Gd0.6Sr4O16,Bi4Ca2Cu4Sr4O16,48.0,Cuprate,True,Bi13.333Ca4.667Cu13.333Gd2Sr13.333O53.333333333333336,Bi-Ca-Cu-Gd-Sr-O,6,Supercon,Bi2Sr2Ca0.7Gd0.3Cu2O8,MP-mp-1218930,Sr4Ca2Cu4Bi4O16,Bi-Ca-Cu-Sr-O,Bi13.333Ca6.667Cu13.333Sr13.333O53.333333333333336,C c c 2,orthorhombic,5.417115,5.472898000129128,16.11398919,data/final/MP/cifs/Bi2Ca0.7Cu2Gd0.3Sr2O8-MP-mp-1218930-synth_doped.cif,data/source/MP/raw/cifs/mp-1218930.cif,mp-1218930,0.0,,2019-01-12 20:01:06.544000,6.266668983881059,,,,0.039252223722225,4.51768334,520.0,-173.15021002,-5.771673667333333,{'tags': []},-173.15021002,-5.771673667333333,-2.074956548222222,[],False,[],True,2021-05-12 11:00:42.526000,NM,30,3,mp-1218930,oxide,Sr2CaCu2(BiO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",GGA,mp-1218930,"['mp-1218930', 'mp-1359698', 'mp-1817714']",0.00011165,"{'Sr': 4.0, 'Ca': 2.0, 'Cu': 4.0, 'Bi': 4.0, 'O': 16.0}",470.7976286073367,[],NM,False,37,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.743014544498498e-07,0.00011165,0,0.0002233,MP,data/source/MP/cleaned/cifs/MP-mp-1218930.cif,True,,data/final/MP/graphs/Bi2Ca0.7Cu2Gd0.3Sr2O8-MP-mp-1218930-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Cu2Y2O5,1,0.0,4.0,False,Cu8Y8O20,Cu8Y8O20,0.0,Cuprate,True,Cu22.222Y22.222O55.55555555555556,Cu-Y-O,3,Supercon,Y2Cu2O5,MP-mp-510475,Y8Cu8O20,Cu-Y-O,Cu22.222Y22.222O55.55555555555556,P n m a,orthorhombic,6.265589,7.193043,11.246125,data/final/MP/cifs/Cu2Y2O5-MP-mp-510475.cif,data/source/MP/raw/cifs/mp-510475.cif,mp-510475,0.0719000000000003,,2014-02-25 21:09:39,5.044060924119679,10.17188/1262967,"@misc{osti_1262967,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Y2Cu2O5 (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1262967"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1742750'}},0.0403202018055566,2.84477169,520.0,-262.79623573,-7.2998954369444435,"{'tags': ['Diyttrium dicopper oxide', 'Delafossite', 'Yttrium copper oxide (1/1/2.5)']}",-262.79623573,-7.2998954369444435,-2.5847664823148144,"['xas', 'bandstructure']",True,"[171704, 51445, 171703]",True,2021-05-12 10:57:08.928000,FiM,36,7,mp-510475,oxide,Y2Cu2O5,"{'functional': 'PBE', 'labels': ['Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Y': 2.0, 'Cu': 2.0, 'O': 5.0}",GGA,mp-510475,"['mp-911384', 'mp-927964', 'mp-927436', 'mp-510475', 'mp-1398738', 'mp-1742750', 'mp-1826463']",0.0003444,"{'Y': 8.0, 'Cu': 8.0, 'O': 20.0}",506.8476838219266,[],FiM,True,62,2,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.1, -0.1, -0.1, -0.1, 0.1, 0.1, 0.1, 0.1, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",2.7179763151171847e-06,0.0003444,8,0.0013776,MP,data/source/MP/cleaned/cifs/MP-mp-510475.cif,False,,data/final/MP/graphs/Cu2Y2O5-MP-mp-510475.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Be13Th0.046U0.954,2,0.0065714285714285,2.0,False,Be26Th0.092U1.908,Be26U2,0.415,Heavy_fermion,True,Be92.857Th0.329U6.814,Be-Th-U,3,Supercon,U0.9535Th0.0465Be13,MP-mp-1163,U2Be26,Be-U,Be92.857U7.143,F m -3 c,cubic,7.174675929999999,7.174675929999999,7.174675929999999,data/final/MP/cifs/Be13Th0.046U0.954-MP-mp-1163-synth_doped.cif,data/source/MP/raw/cifs/mp-1163.cif,mp-1163,0.0,,2011-05-15 13:39:09,4.516943134220159,10.17188/1188115,"@misc{osti_1188115,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UBe13 (SG:226) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188115"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1676276'}},0.0,5.60901004,520.0,-121.44122023,-4.337186436785714,"{'tags': ['Uranium beryllium (1/13)', 'Beryllium uranium (13/1)']}",-121.44122023,-4.337186436785714,-0.0583452042857146,"['xas', 'bandstructure']",True,"[616470, 58748, 616481, 58747, 58749, 659562, 107528, 600563, 58750, 616488, 58751]",True,2021-05-12 10:56:51.169000,NM,28,8,mp-1163,,UBe13,"{'functional': 'PBE', 'labels': ['U', 'Be_sv'], 'pot_type': 'paw'}","{'U': 1.0, 'Be': 13.0}",GGA,mp-1163,"['mp-1163', 'mp-906858', 'mp-920459', 'mp-921486', 'mp-1381018', 'mp-1676276', 'mp-1775695', 'mp-1603627']",0.0460573,"{'U': 2.0, 'Be': 26.0}",261.15110606061,[],NM,False,226,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0003527252914587,0.0460573,0,0.0921146,MP,data/source/MP/cleaned/cifs/MP-mp-1163.cif,True,,data/final/MP/graphs/Be13Th0.046U0.954-MP-mp-1163-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ga0.25Si0.75V3,3,0.125,2.0,False,Ga0.5Si1.5V6,Si2V6,18.6,Other,True,Ga6.25Si18.75V75,Ga-Si-V,3,Supercon,Ga0.25Si0.75V3,MP-mp-2567,V6Si2,Si-V,Si25V75,P m -3 n,cubic,4.702381,4.702381,4.702381,data/final/MP/cifs/Ga0.25Si0.75V3-MP-mp-2567-synth_doped.cif,data/source/MP/raw/cifs/mp-2567.cif,mp-2567,0.0,,2011-05-13 19:15:43,5.778142190030859,10.17188/1200874,"@misc{osti_1200874,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Si (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1200874"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668672'}},0.0,7.30599425,520.0,-69.05773321,-8.63221665125,{'tags': ['Vanadium silicide (3/1)']},-69.05773321,-8.63221665125,-0.4452085937499994,"['xas', 'elasticity', 'bandstructure']",True,"[652491, 87328, 652522, 652502, 652510, 652520, 600518, 186003, 652507, 652513, 652497, 601150, 652514, 652487, 22412, 652509, 652529, 652532, 652499, 652539, 652537, 652533, 652512, 652538, 652490, 652493, 652494, 652511, 652519, 87329, 652526, 652500]",True,2021-05-12 10:56:18.721000,FM,8,13,mp-2567,,V3Si,"{'functional': 'PBE', 'labels': ['V_pv', 'Si'], 'pot_type': 'paw'}","{'V': 3.0, 'Si': 1.0}",GGA,mp-2567,"['mp-920081', 'mp-906309', 'mp-919083', 'mp-2567', 'mp-1078474', 'mp-1078852', 'mp-1138781', 'mp-1145907', 'mp-1440678', 'mp-1668672', 'mp-1795955', 'mp-1593554', 'mp-1596575']",0.8382519,"{'V': 6.0, 'Si': 2.0}",103.98086881866836,[],FM,True,131,1,"[0.2, 0.3, 0.3, 0.2, 0.3, 0.3, 0.0, 0.0]",0.0161231947669493,0.8382519,6,1.6765038,MP,data/source/MP/cleaned/cifs/MP-mp-2567.cif,True,,data/final/MP/graphs/Ga0.25Si0.75V3-MP-mp-2567-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
B2C1Gd0.05Ni2Y0.95,2,0.0166666666666666,1.0,True,B2C1Gd0.05Ni2Y0.95,B2C1Ni2Y1,13.5,Other,True,B33.333C16.667Gd0.833Ni33.333Y15.833,B-C-Gd-Ni-Y,5,Supercon,Y0.95Gd0.05Ni2B2C1,MP-mp-6576,Y1Ni2B2C1,B-C-Ni-Y,B33.333C16.667Ni33.333Y16.667,I 4/m m m,tetragonal,3.548790000501972,3.548790000501972,5.76144136,data/final/MP/cifs/B2C1Gd0.05Ni2Y0.95-MP-mp-6576-synth_doped.cif,data/source/MP/raw/cifs/mp-6576.cif,mp-6576,0.0,,2011-05-13 05:21:43,6.099730998852292,10.17188/1281366,"@misc{osti_1281366,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281366"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688230'}},0.0,6.81083016,520.0,-43.677878,-7.279646333333333,{'tags': []},-43.677878,-7.279646333333333,-0.5109282141666659,"['xas', 'bandstructure']",True,"[75816, 89142, 83231, 79574, 41549]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6576,,YNi2B2C,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6576,"['mp-6576', 'mp-1007054', 'mp-1000583', 'mp-1439516', 'mp-1688230', 'mp-1794280', 'mp-1011792', 'mp-1597064']",0.0006603,"{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.3152437079014,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",1.010943177297096e-05,0.0006603,0,0.0006603,MP,data/source/MP/cleaned/cifs/MP-mp-6576.cif,True,,data/final/MP/graphs/B2C1Gd0.05Ni2Y0.95-MP-mp-6576-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Nb3Rh0.95Ru0.05,2,0.025,2.0,False,Nb6Rh1.9Ru0.1,Nb6Rh2,2.42,Other,True,Nb75Rh23.75Ru1.25,Nb-Rh-Ru,3,Supercon,Nb3Rh0.95Ru0.05,MP-mp-1545,Nb6Rh2,Nb-Rh,Nb75Rh25,P m -3 n,cubic,5.186072,5.186072,5.186072,data/final/MP/cifs/Nb3Rh0.95Ru0.05-MP-mp-1545-synth_doped.cif,data/source/MP/raw/cifs/mp-1545.cif,mp-1545,0.0,,2011-05-14 11:20:25,9.086567873234834,10.17188/1191190,"@misc{osti_1191190,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Rh (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191190"",
    place = ""United States"",
    year = ""2015"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700041'}},0.0,5.48706495,520.0,-77.37430008,-9.67178751,{'tags': ['Niobium rhodium (3/1)']},-77.37430008,-9.67178751,-0.2547317625000005,"['xas', 'elasticity', 'bandstructure']",True,"[105216, 645269]",True,2021-05-12 10:56:12.755000,NM,8,8,mp-1545,,Nb3Rh,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Rh_pv'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Rh': 1.0}",GGA,mp-1545,"['mp-942004', 'mp-943019', 'mp-935201', 'mp-1545', 'mp-1433570', 'mp-1700041', 'mp-1786474', 'mp-1591392']",0.00021655,"{'Nb': 6.0, 'Rh': 2.0}",139.48118416938905,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",3.1050783127424102e-06,0.00021655,0,0.0004331,MP,data/source/MP/cleaned/cifs/MP-mp-1545.cif,True,,data/final/MP/graphs/Nb3Rh0.95Ru0.05-MP-mp-1545-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba0.9Na0.1Sb2Ti2O1,2,0.0333333333333333,1.0,True,Ba0.9Na0.1Sb2Ti2O1,Ba1Sb2Ti2O1,4.24,Oxide,True,Ba15Na1.667Sb33.333Ti33.333O16.666666666666668,Ba-Na-Sb-Ti-O,5,Supercon,Ba0.9Na0.1Ti2Sb2O1,MP-mp-1070806,Ba1Ti2Sb2O1,Ba-Sb-Ti-O,Ba16.667Sb33.333Ti33.333O16.666666666666668,P 4/m m m,tetragonal,4.113474,4.113474,8.312382,data/final/MP/cifs/Ba0.9Na0.1Sb2Ti2O1-MP-mp-1070806-synth_doped.cif,data/source/MP/raw/cifs/mp-1070806.cif,mp-1070806,0.0,,2018-03-22 04:02:04,5.8154485533321445,,,{'GGA': {'task_id': 'mp-1702174'}},0.0,5.89751533,520.0,-39.14932631,-6.524887718333333,{'tags': []},-39.14932631,-6.524887718333333,-1.5507346602777776,['bandstructure'],True,"[430061, 237789, 430060]",True,2021-05-12 10:58:14.654000,NM,6,16,mp-1070806,oxide,BaTi2Sb2O,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ti_pv', 'Sb', 'O'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Ti': 2.0, 'Sb': 2.0, 'O': 1.0}",GGA,mp-1070806,"['mp-1071055', 'mp-1071068', 'mp-1071083', 'mp-1071088', 'mp-1070806', 'mp-1071124', 'mp-1070846', 'mp-1070900', 'mp-1071137', 'mp-1423542', 'mp-1702174', 'mp-1785425', 'mp-1588663', 'mp-1070899', 'mp-1071129', 'mp-1071119']",0.001055,"{'Ba': 1.0, 'Ti': 2.0, 'Sb': 2.0, 'O': 1.0}",140.65105900950408,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0]",7.500832254158225e-06,0.001055,0,0.001055,MP,data/source/MP/cleaned/cifs/MP-mp-1070806.cif,True,,data/final/MP/graphs/Ba0.9Na0.1Sb2Ti2O1-MP-mp-1070806-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ba2Cu4Sm1O8,1,0.0,1.0,True,Ba2Cu4Sm1O8,Ba2Cu4Sm1O8,69.3,Cuprate,True,Ba13.333Cu26.667Sm6.667O53.333333333333336,Ba-Cu-Sm-O,4,Supercon,Sm1Ba2Cu4O8,MP-mp-1214577,Ba2Sm1Cu4O8,Ba-Cu-Sm-O,Ba13.333Cu26.667Sm6.667O53.333333333333336,C m m m,orthorhombic,3.905849999937028,3.928566,13.95306247,data/final/MP/cifs/Ba2Cu4Sm1O8-MP-mp-1214577.cif,data/source/MP/raw/cifs/mp-1214577.cif,mp-1214577,0.0,,2019-01-12 16:23:50.941000,6.322714169670792,,,{'GGA': {'task_id': 'mp-1738857'}},0.0,3.15239895,520.0,-89.70451933,-5.980301288666666,"{'tags': ['Ba2Cu4YO8', 'high-Tc cuprate family', 'Ba2Cu4SmO8']}",-89.70451933,-5.980301288666666,-2.0442317876666665,[],False,[],True,2021-05-12 11:00:35.508000,NM,15,4,mp-1214577,oxide,Ba2Sm(CuO2)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Sm_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Sm': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-1214577,"['mp-1214577', 'mp-1389048', 'mp-1738857', 'mp-1828930']",0.0009586,"{'Ba': 2.0, 'Sm': 1.0, 'Cu': 4.0, 'O': 8.0}",211.993743023126,[],NM,False,65,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.521831570733804e-06,0.0009586,0,0.0009586,MP,data/source/MP/cleaned/cifs/MP-mp-1214577.cif,False,,data/final/MP/graphs/Ba2Cu4Sm1O8-MP-mp-1214577.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Al2Ca1Si2,1,0.0,1.0,True,Al2Ca1Si2,Al2Ca1Si2,0.0,Other,True,Al40Ca20Si40,Al-Ca-Si,3,Supercon,Ca1Al2Si2,MP-mp-7704,Ca1Al2Si2,Al-Ca-Si,Al40Ca20Si40,P -3 m 1,trigonal,4.155346000837841,4.15534583,7.106862,data/final/MP/cifs/Al2Ca1Si2-MP-mp-7704.cif,data/source/MP/raw/cifs/mp-7704.cif,mp-7704,0.0,,2011-05-27 17:37:53,2.347097201078894,10.17188/1299756,"@misc{osti_1299756,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ca(AlSi)2 (SG:164) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1299756"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695480'}},0.0,5.45136951,520.0,-21.84505476,-4.369010952,{'tags': ['Calcium dialuminium silicide']},-21.84505476,-4.369010952,-0.2711350359999997,"['bandstructure', 'elasticity']",True,[20278],True,2021-05-12 10:56:29.056000,NM,5,10,mp-7704,,Ca(AlSi)2,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Al', 'Si'], 'pot_type': 'paw'}","{'Ca': 1.0, 'Al': 2.0, 'Si': 2.0}",GGA,mp-7704,"['mp-927783', 'mp-927398', 'mp-7704', 'mp-911442', 'mp-1171114', 'mp-1267188', 'mp-1422876', 'mp-1695480', 'mp-1866262', 'mp-1593164']",0.000888,"{'Ca': 1.0, 'Al': 2.0, 'Si': 2.0}",106.27298364595968,[],NM,False,164,0,"[0, 0, 0, 0, 0]",8.355839551454621e-06,0.000888,0,0.000888,MP,data/source/MP/cleaned/cifs/MP-mp-7704.cif,False,,data/final/MP/graphs/Al2Ca1Si2-MP-mp-7704.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Cu1Pr0.15Sr0.85O2,3,0.075,2.0,False,Cu2Pr0.3Sr1.7O4,Cu2Sr2O4,39.0,Cuprate,True,Cu25Pr3.75Sr21.25O50,Cu-Pr-Sr-O,4,Supercon,Sr0.85Pr0.15Cu1O2,MP-mp-5787,Sr2Cu2O4,Cu-Sr-O,Cu25Sr25O50,C m c m,orthorhombic,3.644437999912225,3.974263,8.32909336,data/final/MP/cifs/Cu1Pr0.15Sr0.85O2-MP-mp-5787-synth_doped.cif,data/source/MP/raw/cifs/mp-5787.cif,mp-5787,0.0,,2011-05-13 22:43:08,5.167573150857569,10.17188/1276630,"@misc{osti_1276630,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SrCuO2 (SG:63) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1276630"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703560'}},0.0,3.45760864,520.0,-45.24374469,-5.65546808625,"{'tags': ['Strontium cuprate', 'Strontium copper oxide']}",-45.24374469,-5.65546808625,-2.0778125529166664,"['xas', 'elasticity', 'bandstructure']",True,"[77291, 93653, 202992, 16217, 83051, 77293]",True,2021-05-12 10:56:27.046000,NM,8,8,mp-5787,oxide,SrCuO2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Cu': 1.0, 'O': 2.0}",GGA,mp-5787,"['mp-924142', 'mp-909103', 'mp-5787', 'mp-924940', 'mp-1475985', 'mp-1703560', 'mp-1802910', 'mp-1593696']",4e-07,"{'Sr': 2.0, 'Cu': 2.0, 'O': 4.0}",117.71572347282628,[],NM,False,63,0,"[0, 0, 0, 0, 0, 0, 0, 0]",6.796033498317439e-09,4e-07,0,8e-07,MP,data/source/MP/cleaned/cifs/MP-mp-5787.cif,True,,data/final/MP/graphs/Cu1Pr0.15Sr0.85O2-MP-mp-5787-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
As2Ba0.65Fe2Na0.35,3,0.06,2.0,False,As4Ba1.3Fe4Na0.7,As4Ba1Fe4Na1,31.25,Ferrite,True,As40Ba13Fe40Na7,As-Ba-Fe-Na,4,Supercon,Ba0.65Na0.35Fe2As2,MP-mp-1227868,Ba1Na1Fe4As4,As-Ba-Fe-Na,As40Ba10Fe40Na10,C m m m,orthorhombic,5.458732000131759,5.462821,6.96934908,data/final/MP/cifs/As2Ba0.65Fe2Na0.35-MP-mp-1227868-synth_doped.cif,data/source/MP/raw/cifs/mp-1227868.cif,mp-1227868,0.0,,2019-01-13 03:39:01.428000,5.934244973483095,,,{'GGA': {'task_id': 'mp-1731957'}},0.0195872770000011,4.30353274,520.0,-59.62394279,-5.962394279,{'tags': []},-59.62394279,-5.962394279,-0.3865939246551718,[],False,[],True,2021-05-12 11:00:59.151000,FM,10,4,mp-1227868,,BaNa(FeAs)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Na_pv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Na': 1.0, 'Fe': 4.0, 'As': 4.0}",GGA,mp-1227868,"['mp-1227868', 'mp-1396889', 'mp-1731957', 'mp-1827521']",0.9949323,"{'Ba': 1.0, 'Na': 1.0, 'Fe': 4.0, 'As': 4.0}",191.22642477974767,[],FM,True,65,1,"[0.0, 0.0, 0.3, 0.3, 0.3, 0.3, 0.0, 0.0, 0.0, 0.0]",0.0052029017493055,0.9949323,4,0.9949323,MP,data/source/MP/cleaned/cifs/MP-mp-1227868.cif,True,,data/final/MP/graphs/As2Ba0.65Fe2Na0.35-MP-mp-1227868-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
B2C1Dy0.1Ni2Tb0.9,2,0.0333333333333333,1.0,True,B2C1Dy0.1Ni2Tb0.9,B2C1Ni2Tb1,0.0,Other,True,B33.333C16.667Dy1.667Ni33.333Tb15,B-C-Dy-Ni-Tb,5,Supercon,Dy0.1Tb0.9Ni2B2C1,MP-mp-6092,Tb1Ni2B2C1,B-C-Ni-Tb,B33.333C16.667Ni33.333Tb16.667,I 4/m m m,tetragonal,3.5665140003823987,3.5665140003823987,5.7333997100000005,data/final/MP/cifs/B2C1Dy0.1Ni2Tb0.9-MP-mp-6092-synth_doped.cif,data/source/MP/raw/cifs/mp-6092.cif,mp-6092,0.0,,2011-05-13 04:21:03,7.858244682564482,10.17188/1277657,"@misc{osti_1277657,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TbNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277657"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686417'}},0.0,6.76233636,520.0,-41.85355222,-6.975592036666666,{'tags': []},-41.85355222,-6.975592036666666,-0.5122247530555543,"['xas', 'elasticity', 'bandstructure']",True,"[89159, 89157, 79572, 56648, 89155, 89156, 89160, 89158]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-6092,,TbNi2B2C,"{'functional': 'PBE', 'labels': ['Tb_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Tb': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6092,"['mp-1007320', 'mp-1000865', 'mp-6092', 'mp-1440112', 'mp-1686417', 'mp-1793943', 'mp-1012059', 'mp-1590555']",0.0029604,"{'Tb': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.4949740949675,[],NM,False,139,0,"[-0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",4.520041485484718e-05,0.0029604,0,0.0029604,MP,data/source/MP/cleaned/cifs/MP-mp-6092.cif,True,,data/final/MP/graphs/B2C1Dy0.1Ni2Tb0.9-MP-mp-6092-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B4Er1Ru4,1,0.0,4.0,False,B16Er4Ru16,B16Er4Ru16,0.0,Other,True,B44.444Er11.111Ru44.444,B-Er-Ru,3,Supercon,Er1Ru4B4,MP-mp-1196250,Er4B16Ru16,B-Er-Ru,B44.444Er11.111Ru44.444,I 41/a c d,tetragonal,7.473553998055929,7.473553998055928,9.186464119999998,data/final/MP/cifs/B4Er1Ru4-MP-mp-1196250.cif,data/source/MP/raw/cifs/mp-1196250.cif,mp-1196250,0.0,,2019-01-12 01:27:26.956000,9.729495223593732,,,{'GGA': {'task_id': 'mp-1718312'}},0.0,6.93376204,520.0,-291.56095508,-8.098915418888888,{'tags': ['Erbium ruthenium boride (1/4/4)']},-291.56095508,-8.098915418888888,-0.5008215840740731,['bandstructure'],True,[613822],True,2021-05-12 10:58:37.524000,NM,36,5,mp-1196250,,Er(BRu)4,"{'functional': 'PBE', 'labels': ['Er_3', 'B', 'Ru_pv'], 'pot_type': 'paw'}","{'Er': 1.0, 'B': 4.0, 'Ru': 4.0}",GGA,mp-1196250,"['mp-1196250', 'mp-1397599', 'mp-1718312', 'mp-1818619', 'mp-1637226']",0.00670405,"{'Er': 4.0, 'B': 16.0, 'Ru': 16.0}",419.7016044597939,[],NM,False,142,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",6.389348936255713e-05,0.00670405,0,0.0268162,MP,data/source/MP/cleaned/cifs/MP-mp-1196250.cif,False,,data/final/MP/graphs/B4Er1Ru4-MP-mp-1196250.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ba2Cu4Pr0.4Y0.6O8,3,0.0355555555555555,3.0,False,Ba6Cu12Pr1.2Y1.8O24,Ba6Cu12Pr2Y1O24,55.25,Cuprate,True,Ba13.333Cu26.667Pr2.667Y4O53.333333333333336,Ba-Cu-Pr-Y-O,5,Supercon,Y0.6Pr0.4Ba2Cu4O8,MP-mp-1228680,Ba6Pr2Y1Cu12O24,Ba-Cu-Pr-Y-O,Ba13.333Cu26.667Pr4.444Y2.222O53.333333333333336,C m m m,orthorhombic,3.915598,3.938203,41.54960195,data/final/MP/cifs/Ba2Cu4Pr0.4Y0.6O8-MP-mp-1228680-synth_doped.cif,data/source/MP/raw/cifs/mp-1228680.cif,mp-1228680,0.0,,2019-01-13 04:21:52.401000,6.074507263149171,,,,0.0120846905555564,3.23727402,520.0,-270.06740063,-6.001497791777778,{'tags': []},-270.06740063,-6.001497791777778,-2.02381693525926,[],False,[],True,2021-05-12 11:01:01.648000,NM,45,2,mp-1228680,oxide,Ba6Pr2Y(CuO2)12,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Pr_3', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 6.0, 'Pr': 2.0, 'Y': 1.0, 'Cu': 12.0, 'O': 24.0}",GGA,mp-1228680,"['mp-1228680', 'mp-1886757']",0.000519,"{'Ba': 6.0, 'Pr': 2.0, 'Y': 1.0, 'Cu': 12.0, 'O': 24.0}",640.0006371700476,[],NM,False,38,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, 0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",8.109366926491078e-07,0.000519,0,0.000519,MP,data/source/MP/cleaned/cifs/MP-mp-1228680.cif,True,,data/final/MP/graphs/Ba2Cu4Pr0.4Y0.6O8-MP-mp-1228680-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
As1Fe0.96Ir0.04Sm1O1,2,0.02,2.0,False,As2Fe1.92Ir0.08Sm2O2,As2Fe2Sm2O2,0.0,Ferrite,True,As25Fe24Ir1Sm25O25,As-Fe-Ir-Sm-O,5,Supercon,Sm1Fe0.96Ir0.04As1O1,MP-mp-20349,Sm2Fe2As2O2,As-Fe-Sm-O,As25Fe25Sm25O25,P 4/n m m,tetragonal,4.026492,4.026492,9.046755,data/final/MP/cifs/As1Fe0.96Ir0.04Sm1O1-MP-mp-20349-synth_doped.cif,data/source/MP/raw/cifs/mp-20349.cif,mp-20349,0.0,,2014-02-19 11:24:42,6.727802583283198,,,{'GGA+U': {'task_id': 'mp-1695938'}},0.3015723809374986,3.77685593,520.0,-52.73407138,-6.5917589225,{'tags': ['Samarium iron arsenic oxide (1/1/1/1)']},-52.73407138,-6.5917589225,-1.6285904237499995,"['xas', 'elasticity', 'bandstructure']",True,"[236652, 236653, 422002, 163457, 163458]",True,2021-05-12 10:56:16.728000,FM,8,10,mp-20349,oxide,SmFeAsO,"{'functional': 'PBE', 'labels': ['Sm_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Sm': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-20349,"['mp-24944', 'mp-1078897', 'mp-1079866', 'mp-1173321', 'mp-20349', 'mp-1425472', 'mp-1695938', 'mp-1772503', 'mp-1789694', 'mp-1588381']",3.75729895,"{'Sm': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",146.67176231613362,[],FM,True,129,1,"[0.0, 0.0, 3.5, 3.5, -0.0, -0.0, -0.0, -0.0]",0.0512341147425717,3.75729895,2,7.5145979,MP,data/source/MP/cleaned/cifs/MP-mp-20349.cif,True,,data/final/MP/graphs/As1Fe0.96Ir0.04Sm1O1-MP-mp-20349-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ca0.075Sr0.925Ti1O3,2,0.0299999999999999,1.0,True,Ca0.075Sr0.925Ti1O3,Sr1Ti1O3,0.5,Oxide,True,Ca1.5Sr18.5Ti20O60,Ca-Sr-Ti-O,4,Supercon,Sr0.925Ca0.075Ti1O3,MP-mp-551830,Sr2Ti2O6,Sr-Ti-O,Sr20Ti20O60,P m -3 m,cubic,3.942851452350787,3.942851452692745,3.9464989993092807,data/final/MP/cifs/Ca0.075Sr0.925Ti1O3-MP-mp-551830-synth_doped.cif,data/source/MP/raw/cifs/mp-551830.cif,mp-551830,1.7869999999999997,,2014-02-21 05:23:00,4.966121139868444,,,{'GGA': {'task_id': 'mp-1759822'}},0.0005822479999988,3.22413565,520.0,-80.25240668,-8.025240668,{'tags': []},-80.25240668,-8.025240668,-3.551666971000001,"['bandstructure', 'elasticity']",True,[],True,2021-05-12 10:56:22.739000,NM,10,4,mp-551830,oxide,SrTiO3,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ti_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Ti': 1.0, 'O': 3.0}",GGA,mp-551830,"['mp-551830', 'mp-1406736', 'mp-1759822', 'mp-1627898']",0.00106425,"{'Sr': 2.0, 'Ti': 2.0, 'O': 6.0}",122.70515928291898,[],NM,False,221,0,"[0, 0, 0, 0, 0]",1.7346458881100164e-05,0.00106425,0,0.0021285,MP,data/source/MP/cleaned/cifs/MP-mp-551830.cif,True,,data/final/MP/graphs/Ca0.075Sr0.925Ti1O3-MP-mp-551830-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Cu1La2O4.003,2,0.0003671895718161,0.9992501873594803,True,Cu0.999La1.999O4,Cu1La2O4,0.0,Cuprate,True,Cu14.28La28.559O57.161216621447956,Cu-La-O,3,Supercon,La2Cu1O4.003,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La2O4.003-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La2O4.003-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Cu1La2O4.047,2,0.0057167183603964,0.9882954863685036,True,Cu0.988La1.977O4,Cu1La2O4,29.7,Cuprate,True,Cu14.19La28.381O57.428693060876974,Cu-La-O,3,Supercon,La2Cu1O4.047,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La2O4.047-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La2O4.047-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Rh3Zr1,1,0.0,1.0,True,Rh3Zr1,Rh3Zr1,0.0,Other,True,Rh75Zr25,Rh-Zr,2,Supercon,Rh3Zr,MP-mp-229,Zr1Rh3,Rh-Zr,Rh75Zr25,P m -3 m,cubic,3.973411,3.973411,3.973411,data/final/MP/cifs/Rh3Zr1-MP-mp-229.cif,data/source/MP/raw/cifs/mp-229.cif,mp-229,0.0,,2011-05-13 06:42:02,10.586539284709414,10.17188/1199065,"@misc{osti_1199065,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrRh3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199065"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688543'}},0.0,5.9980008,520.0,-33.33430362,-8.333575905,"{'tags': ['Rhodium zirconium (3/1)', 'Zirconium rhodium (1/3)']}",-33.33430362,-8.333575905,-0.6734198449999997,"['xas', 'elasticity', 'bandstructure']",True,"[105984, 650561, 650550, 185642, 650566, 650565, 105985, 191462]",True,2021-05-12 10:56:16.728000,NM,4,16,mp-229,,ZrRh3,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Rh_pv'], 'pot_type': 'paw'}","{'Zr': 1.0, 'Rh': 3.0}",GGA,mp-229,"['mp-997555', 'mp-997549', 'mp-229', 'mp-1064441', 'mp-1064455', 'mp-1064489', 'mp-1067861', 'mp-1067891', 'mp-1067844', 'mp-1442200', 'mp-1688543', 'mp-1791767', 'mp-997557', 'mp-1589517', 'mp-1067892', 'mp-1064493']",0.0056767,"{'Zr': 1.0, 'Rh': 3.0}",62.73219290129583,[],NM,False,221,0,"[0, 0, 0, 0]",9.049101804765283e-05,0.0056767,0,0.0056767,MP,data/source/MP/cleaned/cifs/MP-mp-229.cif,False,,data/final/MP/graphs/Rh3Zr1-MP-mp-229.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
B6Ce0.05Y0.95,2,0.0142857142857142,1.0,True,B6Ce0.05Y0.95,B6Y1,1.6,Other,True,B85.714Ce0.714Y13.571,B-Ce-Y,3,Supercon,Y0.95Ce0.05B6,MP-mp-2203,Y1B6,B-Y,B85.714Y14.286,P m -3 m,cubic,4.1021,4.1021,4.1021,data/final/MP/cifs/B6Ce0.05Y0.95-MP-mp-2203-synth_doped.cif,data/source/MP/raw/cifs/mp-2203.cif,mp-2203,0.0,,2011-05-12 20:11:15,3.699194842606093,10.17188/1197299,"@misc{osti_1197299,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YB6 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197299"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686414'}},0.0285229421428576,6.62579631,520.0,-49.33978236,-7.048540337142858,"{'tags': ['Yttrium boride (1/6)', 'Yttrium octahedro-hexaboride', 'Yttrium hexaboride']}",-49.33978236,-7.048540337142858,-0.3995658030952376,"['xas', 'elasticity', 'bandstructure']",True,"[194635, 615723, 54730, 615726, 615714, 659505, 76126, 615728, 615710]",True,2021-05-12 10:56:16.728000,NM,7,9,mp-2203,,YB6,"{'functional': 'PBE', 'labels': ['Y_sv', 'B'], 'pot_type': 'paw'}","{'Y': 1.0, 'B': 6.0}",GGA,mp-2203,"['mp-1000404', 'mp-1006875', 'mp-2203', 'mp-1077859', 'mp-1440131', 'mp-1686414', 'mp-1801281', 'mp-1011609', 'mp-1592923']",3.48e-05,"{'Y': 1.0, 'B': 6.0}",69.026957252261,[],NM,False,221,0,"[0, 0, 0, 0, 0, 0, 0]",5.041508620005138e-07,3.48e-05,0,3.48e-05,MP,data/source/MP/cleaned/cifs/MP-mp-2203.cif,True,,data/final/MP/graphs/B6Ce0.05Y0.95-MP-mp-2203-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ir1Nb1Si1,1,0.0,4.0,False,Ir4Nb4Si4,Ir4Nb4Si4,0.0,Other,True,Ir33.333Nb33.333Si33.333,Ir-Nb-Si,3,Supercon,Nb1Ir1Si1,MP-mp-21248,Nb4Si4Ir4,Ir-Nb-Si,Ir33.333Nb33.333Si33.333,P n m a,orthorhombic,3.817652,6.466432,7.335796,data/final/MP/cifs/Ir1Nb1Si1-MP-mp-21248.cif,data/source/MP/raw/cifs/mp-21248.cif,mp-21248,0.0,,2014-02-22 08:12:08,11.487746865334456,10.17188/1196520,"@misc{osti_1196520,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbSiIr (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196520"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695908'}},0.0,8.5597406,520.0,-107.77181036,-8.980984196666666,{'tags': ['Niobium iridium silicide (1/1/1)']},-107.77181036,-8.980984196666666,-0.859301036666667,"['xas', 'elasticity', 'bandstructure']",True,[411882],True,2021-05-12 10:56:16.728000,NM,12,9,mp-21248,,NbSiIr,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Si', 'Ir'], 'pot_type': 'paw'}","{'Nb': 1.0, 'Si': 1.0, 'Ir': 1.0}",GGA,mp-21248,"['mp-910926', 'mp-926561', 'mp-927114', 'mp-21248', 'mp-1124981', 'mp-1421833', 'mp-1695908', 'mp-1786196', 'mp-1598485']",2.0275e-05,"{'Nb': 4.0, 'Si': 4.0, 'Ir': 4.0}",181.09576659126333,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.478293530905352e-07,2.0275e-05,0,8.11e-05,MP,data/source/MP/cleaned/cifs/MP-mp-21248.cif,False,,data/final/MP/graphs/Ir1Nb1Si1-MP-mp-21248.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Lu1Os2,1,0.0,4.0,False,Lu4Os8,Lu4Os8,3.49,Other,True,Lu33.333Os66.667,Lu-Os,2,Supercon,Lu1Os2,MP-mp-567590,Lu4Os8,Lu-Os,Lu33.333Os66.667,P 63/m m c,hexagonal,5.271523997154336,5.27152339,8.789404,data/final/MP/cifs/Lu1Os2-MP-mp-567590.cif,data/source/MP/raw/cifs/mp-567590.cif,mp-567590,0.0,,2014-02-24 14:42:27,17.44109340925851,10.17188/1273945,"@misc{osti_1273945,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LuOs2 (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1273945"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700219'}},0.0,6.06460743,520.0,-112.57284169,-9.381070140833334,{'tags': ['Lutetium osmium (1/2)']},-112.57284169,-9.381070140833334,-0.3891757975000007,"['xas', 'elasticity', 'bandstructure']",True,"[150526, 642481]",True,2021-05-12 10:56:22.739000,NM,12,9,mp-567590,,LuOs2,"{'functional': 'PBE', 'labels': ['Lu_3', 'Os_pv'], 'pot_type': 'paw'}","{'Lu': 1.0, 'Os': 2.0}",GGA,mp-567590,"['mp-914530', 'mp-1001403', 'mp-567590', 'mp-1103184', 'mp-1427193', 'mp-1700219', 'mp-1829567', 'mp-1007839', 'mp-1600247']",0.001073375,"{'Lu': 4.0, 'Os': 8.0}",211.5253236714702,[],NM,False,194,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",2.029780607577953e-05,0.001073375,0,0.0042935,MP,data/source/MP/cleaned/cifs/MP-mp-567590.cif,False,,data/final/MP/graphs/Lu1Os2-MP-mp-567590.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
B1.95C0.05Mg1,2,0.0333333333333333,1.0,True,B1.95C0.05Mg1,B2Mg1,36.0,Other,True,B65C1.667Mg33.333,B-C-Mg,3,Supercon,Mg1B1.95C0.05,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B1.95C0.05Mg1-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B1.95C0.05Mg1-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Al1Ba1Ge1,1,0.0,1.0,True,Al1Ba1Ge1,Al1Ba1Ge1,6.3,Other,True,Al33.333Ba33.333Ge33.333,Al-Ba-Ge,3,Supercon,Ba1Al1Ge1,MP-mp-13272,Ba1Al1Ge1,Al-Ba-Ge,Al33.333Ba33.333Ge33.333,P -6 m 2,hexagonal,4.386658004141535,4.38665864,5.194098,data/final/MP/cifs/Al1Ba1Ge1-MP-mp-13272.cif,data/source/MP/raw/cifs/mp-13272.cif,mp-13272,0.0,,2011-05-27 18:58:20,4.545636711163821,10.17188/1189492,"@misc{osti_1189492,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BaAlGe (SG:187) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189492"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1667949'}},0.0,3.49785891,520.0,-11.71524594,-3.90508198,"{'tags': ['Barium aluminium germanide (1/1/1)', 'Barium aluminium germanide']}",-11.71524594,-3.90508198,-0.4758904750000005,"['xas', 'elasticity', 'bandstructure']",True,"[417662, 166380]",True,2021-05-12 10:56:12.755000,NM,3,10,mp-13272,,BaAlGe,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Al', 'Ge_d'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Al': 1.0, 'Ge': 1.0}",GGA,mp-13272,"['mp-1000500', 'mp-1006973', 'mp-13272', 'mp-1115786', 'mp-1263090', 'mp-1438909', 'mp-1667949', 'mp-1782675', 'mp-1011681', 'mp-1590383']",0.0065694,"{'Ba': 1.0, 'Al': 1.0, 'Ge': 1.0}",86.55823817876984,[],NM,False,187,0,"[0, 0, 0]",7.589572221227671e-05,0.0065694,0,0.0065694,MP,data/source/MP/cleaned/cifs/MP-mp-13272.cif,False,,data/final/MP/graphs/Al1Ba1Ge1-MP-mp-13272.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Ge2La1Pd2,1,0.0,1.0,True,Ge2La1Pd2,Ge2La1Pd2,1.04,Other,True,Ge40La20Pd40,Ge-La-Pd,3,Supercon,La1Pd2Ge2,MP-mp-21033,La1Ge2Pd2,Ge-La-Pd,Ge40La20Pd40,I 4/m m m,tetragonal,4.421290001597606,4.421290001597606,5.97061441,data/final/MP/cifs/Ge2La1Pd2-MP-mp-21033.cif,data/source/MP/raw/cifs/mp-21033.cif,mp-21033,0.0,,2014-02-21 11:30:39,8.300326005582953,10.17188/1196295,"@misc{osti_1196295,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La(GePd)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196295"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701817'}},0.0,6.14890347,520.0,-28.82817588,-5.765635176,{'tags': ['Lanthanum palladium germanide (1/2/2)']},-28.82817588,-5.765635176,-0.8572698889999998,"['xas', 'bandstructure']",True,"[81760, 53662]",True,2021-05-12 10:56:57.051000,NM,5,8,mp-21033,,La(GePd)2,"{'functional': 'PBE', 'labels': ['La', 'Ge_d', 'Pd'], 'pot_type': 'paw'}","{'La': 1.0, 'Ge': 2.0, 'Pd': 2.0}",GGA,mp-21033,"['mp-990571', 'mp-992631', 'mp-21033', 'mp-1438097', 'mp-1701817', 'mp-1796178', 'mp-994077', 'mp-1596763']",0.0004025,"{'La': 1.0, 'Ge': 2.0, 'Pd': 2.0}",99.4334691764027,[],NM,False,139,0,"[0, 0, 0, 0, 0]",4.047932786956611e-06,0.0004025,0,0.0004025,MP,data/source/MP/cleaned/cifs/MP-mp-21033.cif,False,,data/final/MP/graphs/Ge2La1Pd2-MP-mp-21033.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ti2O3,1,0.0,2.0,False,Ti4O6,Ti4O6,0.0,Oxide,True,Ti40O60,Ti-O,2,Supercon,O3Ti2,MP-mp-458,Ti4O6,Ti-O,Ti40O60,R -3 c,trigonal,5.112792466611405,5.112792466611405,5.51733371,data/final/MP/cifs/Ti2O3-MP-mp-458.cif,data/source/MP/raw/cifs/mp-458.cif,mp-458,0.0,,2011-05-13 19:42:56,4.523578340020309,10.17188/1208265,"@misc{osti_1208265,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ti2O3 (SG:167) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208265"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686861'}},0.0,7.02315602,520.0,-90.18213044,-9.018213044,"{'tags': ['Titanium oxide (2/3)', 'Titanium(III) oxide']}",-90.18213044,-9.018213044,-3.3034396343333325,"['xas', 'elasticity', 'bandstructure']",True,"[1462, 25779, 28353, 647550, 9654, 33640, 9656, 647544, 9655, 9648, 54175, 9647, 6095, 77696, 29286, 9657, 647561, 9646, 9658, 28354]",True,2021-05-12 10:56:20.740000,NM,10,11,mp-458,oxide,Ti2O3,"{'functional': 'PBE', 'labels': ['Ti_pv', 'O'], 'pot_type': 'paw'}","{'Ti': 2.0, 'O': 3.0}",GGA,mp-458,"['mp-918781', 'mp-905778', 'mp-919807', 'mp-458', 'mp-1079728', 'mp-1237650', 'mp-1441013', 'mp-1686861', 'mp-1930736', 'mp-1590234', 'mp-1588851']",0.0034219,"{'Ti': 4.0, 'O': 6.0}",105.52395262697846,[],NM,False,167,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.485541746329829e-05,0.0034219,0,0.0068438,MP,data/source/MP/cleaned/cifs/MP-mp-458.cif,False,,data/final/MP/graphs/Ti2O3-MP-mp-458.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
B4Er0.72Gd0.28Rh4,3,0.0622222222222222,2.0,False,B8Er1.44Gd0.56Rh8,B8Er2Rh8,2.5,Other,True,B44.444Er8Gd3.111Rh44.444,B-Er-Gd-Rh,4,Supercon,Er0.72Gd0.28Rh4B4,MP-mp-8408,Er2B8Rh8,B-Er-Rh,B44.444Er11.111Rh44.444,P 42/n m c,tetragonal,5.336304,5.336304,7.44528,data/final/MP/cifs/B4Er0.72Gd0.28Rh4-MP-mp-8408-synth_doped.cif,data/source/MP/raw/cifs/mp-8408.cif,mp-8408,0.0,,2011-06-07 02:27:50,9.745285939793032,10.17188/1308086,"@misc{osti_1308086,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Er(BRh)4 (SG:137) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1308086"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1673724'}},0.0133402750000009,6.84272912,520.0,-131.92031901,-7.328906611666666,{'tags': ['Erbium rhodium boride (1/4/4)']},-131.92031901,-7.328906611666666,-0.5797380146296286,"['xas', 'bandstructure']",True,"[613809, 601530, 49631]",True,2021-05-12 10:57:51.871000,NM,18,8,mp-8408,,Er(BRh)4,"{'functional': 'PBE', 'labels': ['Er_3', 'B', 'Rh_pv'], 'pot_type': 'paw'}","{'Er': 1.0, 'B': 4.0, 'Rh': 4.0}",GGA,mp-8408,"['mp-932384', 'mp-931412', 'mp-8408', 'mp-915879', 'mp-1434188', 'mp-1673724', 'mp-1785064', 'mp-1597242']",7.985e-05,"{'Er': 2.0, 'B': 8.0, 'Rh': 8.0}",212.01283845150363,[],NM,False,137,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",7.532562705467018e-07,7.985e-05,0,0.0001597,MP,data/source/MP/cleaned/cifs/MP-mp-8408.cif,True,,data/final/MP/graphs/B4Er0.72Gd0.28Rh4-MP-mp-8408-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ba2Bi2K1O7,1,0.0,1.0,True,Ba2Bi2K1O7,Ba2Bi2K1O7,0.0,Oxide,True,Ba16.667Bi16.667K8.333O58.333333333333336,Ba-Bi-K-O,4,Supercon,Ba2K1Bi2O7,MP-mp-1223506,K1Ba2Bi2O7,Ba-Bi-K-O,Ba16.667Bi16.667K8.333O58.333333333333336,I 4 m m,tetragonal,4.371894001444413,4.371894001444413,11.57884223,data/final/MP/cifs/Ba2Bi2K1O7-MP-mp-1223506.cif,data/source/MP/raw/cifs/mp-1223506.cif,mp-1223506,0.0,,2019-01-12 23:53:29.796000,6.568941261576043,,,{'GGA': {'task_id': 'mp-1720615'}},0.0,3.2162818,520.0,-68.02142757,-5.6684522975,{'tags': []},-68.02142757,-5.6684522975,-2.122190942333333,[],False,[],True,2021-05-12 11:00:52.054000,NM,12,4,mp-1223506,oxide,KBa2Bi2O7,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Bi', 'O'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 2.0, 'Bi': 2.0, 'O': 7.0}",GGA,mp-1223506,"['mp-1223506', 'mp-1384116', 'mp-1720615', 'mp-1829557']",0.0032741,"{'K': 1.0, 'Ba': 2.0, 'Bi': 2.0, 'O': 7.0}",213.2781423215188,[],NM,False,107,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.5351315256039053e-05,0.0032741,0,0.0032741,MP,data/source/MP/cleaned/cifs/MP-mp-1223506.cif,False,,data/final/MP/graphs/Ba2Bi2K1O7-MP-mp-1223506.json,0,True,4mm,0,0,0,0,5,0,0,0,0,1,0,1.0,False
B2Ru3Th1,1,0.0,1.0,True,B2Ru3Th1,B2Ru3Th1,1.79,Other,True,B33.333Ru50Th16.667,B-Ru-Th,3,Supercon,Th1Ru3B2,MP-mp-3223,Th1B2Ru3,B-Ru-Th,B33.333Ru50Th16.667,P 6/m m m,hexagonal,3.077152,5.558296000095163,5.558296400000001,data/final/MP/cifs/B2Ru3Th1-MP-mp-3223.cif,data/source/MP/raw/cifs/mp-3223.cif,mp-3223,0.0,,2011-05-13 08:42:33,11.231557938656753,10.17188/1206133,"@misc{osti_1206133,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ThB2Ru3 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1206133"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698946'}},0.0,8.10631572,520.0,-51.6799836,-8.6133306,{'tags': ['Ruthenium thorium boride (3/1/2)']},-51.6799836,-8.6133306,-0.5140288072222224,"['xas', 'elasticity', 'bandstructure']",True,"[615379, 44574]",True,2021-05-12 10:56:20.740000,NM,6,8,mp-3223,,ThB2Ru3,"{'functional': 'PBE', 'labels': ['Th', 'B', 'Ru_pv'], 'pot_type': 'paw'}","{'Th': 1.0, 'B': 2.0, 'Ru': 3.0}",GGA,mp-3223,"['mp-928330', 'mp-912282', 'mp-928820', 'mp-3223', 'mp-1433873', 'mp-1698946', 'mp-1782895', 'mp-1590519']",6.56e-05,"{'Th': 1.0, 'B': 2.0, 'Ru': 3.0}",82.33091924560527,[],NM,False,191,0,"[0, 0, 0, 0, 0, 0]",7.967844960446211e-07,6.56e-05,0,6.56e-05,MP,data/source/MP/cleaned/cifs/MP-mp-3223.cif,False,,data/final/MP/graphs/B2Ru3Th1-MP-mp-3223.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ti0.8V0.2,1,0.0,5.0,False,Ti4V1,Ti4V1,4.125,Other,True,Ti80V20,Ti-V,2,Supercon,Ti0.8V0.2,MP-mp-1217117,Ti4V1,Ti-V,Ti80V20,F m m m,orthorhombic,2.767063706683787,2.76706371,11.48284669,data/final/MP/cifs/Ti0.8V0.2-MP-mp-1217117.cif,data/source/MP/raw/cifs/mp-1217117.cif,mp-1217117,0.0,,2019-01-12 18:30:30.595000,4.9124038662380345,,,{'GGA': {'task_id': 'mp-1759107'}},0.0932410073333329,5.79308816,520.0,-40.1996691,-8.03993382,{'tags': []},-40.1996691,-8.03993382,0.0932410073333329,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,5,5,mp-1217117,,Ti4V,"{'functional': 'PBE', 'labels': ['Ti_pv', 'V_pv'], 'pot_type': 'paw'}","{'Ti': 4.0, 'V': 1.0}",GGA,mp-1217117,"['mp-1217117', 'mp-1385236', 'mp-1759107', 'mp-1800976', 'mp-1585466']",0.0400957,"{'Ti': 4.0, 'V': 1.0}",81.94164320069113,[],NM,False,69,0,"[0, 0, 0, 0, 0]",0.0004893201848759,0.0400957,0,0.0400957,MP,data/source/MP/cleaned/cifs/MP-mp-1217117.cif,False,,data/final/MP/graphs/Ti0.8V0.2-MP-mp-1217117.json,0,True,mmm,0,0,0,7,0,0,0,0,0,0,1,1.0,False
Ge13Nd3Ru4,1,0.0,2.0,False,Ge26Nd6Ru8,Ge26Nd6Ru8,0.0,Other,True,Ge65Nd15Ru20,Ge-Nd-Ru,3,Supercon,Nd3Ru4Ge13,MP-mp-1196347,Nd6Ge26Ru8,Ge-Nd-Ru,Ge65Nd15Ru20,P m -3 n,cubic,9.157584,9.157584,9.157584,data/final/MP/cifs/Ge13Nd3Ru4-MP-mp-1196347.cif,data/source/MP/raw/cifs/mp-1196347.cif,mp-1196347,0.0,,2019-01-12 01:32:11.075000,7.703352421979999,,,,0.0373499743749983,4.74557434,520.0,-240.54207324,-6.013551831,"{'tags': ['Neodymium ruthenium germanide (3/4/13)', 'Nd3Ru4Ge13', 'Y3Co4Ge13']}",-240.54207324,-6.013551831,-0.4384843127499998,[],False,[637328],True,2021-05-12 10:59:59.077000,NM,40,3,mp-1196347,,Nd3Ge13Ru4,"{'functional': 'PBE', 'labels': ['Nd_3', 'Ge_d', 'Ru_pv'], 'pot_type': 'paw'}","{'Nd': 3.0, 'Ge': 13.0, 'Ru': 4.0}",GGA,mp-1196347,"['mp-1196347', 'mp-1335696', 'mp-1876486']",0.0001182,"{'Nd': 6.0, 'Ge': 26.0, 'Ru': 8.0}",767.9673085993966,[],NM,False,167,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0]",3.078256031902473e-07,0.0001182,0,0.0002364,MP,data/source/MP/cleaned/cifs/MP-mp-1196347.cif,False,,data/final/MP/graphs/Ge13Nd3Ru4-MP-mp-1196347.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Nb1Sr0.9O3,2,0.0326530612244897,4.0,False,Nb4Sr3.6O12,Nb4Sr4O12,0.0,Oxide,True,Nb20.408Sr18.367O61.224489795918366,Nb-Sr-O,3,Supercon,Sr0.9Nb1O3,MP-mp-10339,Sr4Nb4O12,Nb-Sr-O,Nb20Sr20O60,P n m a,orthorhombic,5.751654,5.754906,8.19662,data/final/MP/cifs/Nb1Sr0.9O3-MP-mp-10339-synth_doped.cif,data/source/MP/raw/cifs/mp-10339.cif,mp-10339,0.0,,2011-06-06 13:05:19,5.594692481399679,10.17188/1186970,"@misc{osti_1186970,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SrNbO3 (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1186970"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1669855'}},0.0077974329285694,5.63978103,520.0,-161.91542396,-8.095771198,{'tags': ['Strontium niobate(IV)']},-161.91542396,-8.095771198,-3.1810348963333333,"['xas', 'bandstructure']",True,[88723],True,2021-05-12 10:56:51.169000,NM,20,8,mp-10339,oxide,SrNbO3,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Nb_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Nb': 1.0, 'O': 3.0}",GGA,mp-10339,"['mp-926391', 'mp-926905', 'mp-910622', 'mp-10339', 'mp-32243', 'mp-1433474', 'mp-1669855', 'mp-1608498']",0.001437925,"{'Sr': 4.0, 'Nb': 4.0, 'O': 12.0}",271.30999176806966,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.1199735264143395e-05,0.001437925,0,0.0057517,MP,data/source/MP/cleaned/cifs/MP-mp-10339.cif,True,,data/final/MP/graphs/Nb1Sr0.9O3-MP-mp-10339-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ba0.135Cu1La1.865O4,2,0.0385714285714285,1.0,True,Ba0.135Cu1La1.865O4,Cu1La2O4,2.99,Cuprate,True,Ba1.929Cu14.286La26.643O57.142857142857146,Ba-Cu-La-O,4,Supercon,La1.865Ba0.135Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ba0.135Cu1La1.865O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ba0.135Cu1La1.865O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ba1.9Cu3Gd1.1O7,2,0.0153846153846153,1.0,True,Ba1.9Cu3Gd1.1O7,Ba2Cu3Gd1O7,93.0,Cuprate,True,Ba14.615Cu23.077Gd8.462O53.84615384615385,Ba-Cu-Gd-O,4,Supercon,Gd1.1Ba1.9Cu3O7,MP-mp-19813,Ba2Gd1Cu3O7,Ba-Cu-Gd-O,Ba15.385Cu23.077Gd7.692O53.84615384615385,P m m m,orthorhombic,3.866027,3.930015,11.83802,data/final/MP/cifs/Ba1.9Cu3Gd1.1O7-MP-mp-19813-synth_doped.cif,data/source/MP/raw/cifs/mp-19813.cif,mp-19813,0.0,,2014-02-22 19:20:06,6.781489399734723,10.17188/1195011,"@misc{osti_1195011,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2GdCu3O7 (SG:47) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195011"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702590'}},0.0282650169230738,3.15888808,520.0,-88.25301217,-6.788693243846154,"{'tags': ['Gadolinium dibarium tricopper heptaoxide', 'Gadolinium barium copper oxide (1/2/3/7)', 'Dibarium gadolinium dicopper copper(III) oxide']}",-88.25301217,-6.788693243846154,-2.170353940384615,['bandstructure'],True,"[56514, 86959, 81172]",True,2021-05-12 10:58:49.477000,FM,13,5,mp-19813,oxide,Ba2GdCu3O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Gd', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Gd': 1.0, 'Cu': 3.0, 'O': 7.0}",GGA,mp-19813,"['mp-19813', 'mp-1432948', 'mp-1702590', 'mp-1829895', 'mp-1597575']",6.9263247,"{'Ba': 2.0, 'Gd': 1.0, 'Cu': 3.0, 'O': 7.0}",179.8614789314764,[],FM,True,47,1,"[0.0, 0.0, 6.9, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0385092168770545,6.9263247,1,6.9263247,MP,data/source/MP/cleaned/cifs/MP-mp-19813.cif,True,,data/final/MP/graphs/Ba1.9Cu3Gd1.1O7-MP-mp-19813-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Nb55Rh45,3,0.1,0.0181797979797979,False,Nb1Rh0.818,Nb1Rh1,5.13,Other,True,Nb55Rh45,Nb-Rh,2,Supercon,Nb55Rh45,MP-mp-1963,Nb1Rh1,Nb-Rh,Nb50Rh50,P 4/m m m,tetragonal,2.879837,2.879837,3.877267,data/final/MP/cifs/Nb55Rh45-MP-mp-1963-synth_doped.cif,data/source/MP/raw/cifs/mp-1963.cif,mp-1963,0.0,,2011-05-13 04:08:05,10.111756697385587,10.17188/1194846,"@misc{osti_1194846,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbRh (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1194846"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687603'}},0.0,6.00208314,520.0,-18.26823899,-9.134119495,{'tags': ['Niobium rhodium (1/1)']},-18.26823899,-9.134119495,-0.4013130399999998,"['xas', 'elasticity', 'bandstructure']",True,"[645280, 105213]",True,2021-05-12 10:56:14.760000,NM,2,8,mp-1963,,NbRh,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Rh_pv'], 'pot_type': 'paw'}","{'Nb': 1.0, 'Rh': 1.0}",GGA,mp-1963,"['mp-929427', 'mp-912669', 'mp-929028', 'mp-1963', 'mp-1439069', 'mp-1687603', 'mp-1790574', 'mp-1591985']",0.0050183,"{'Nb': 1.0, 'Rh': 1.0}",32.15596321937415,[],NM,False,123,0,"[0, 0]",0.0001560612557541,0.0050183,0,0.0050183,MP,data/source/MP/cleaned/cifs/MP-mp-1963.cif,True,,data/final/MP/graphs/Nb55Rh45-MP-mp-1963-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
As2Ba0.823Fe2K0.177,3,0.0625333333333333,3.0,False,As6Ba2.469Fe6K0.531,As6Ba2Fe6K1,10.0,Ferrite,True,As40Ba16.46Fe40K3.54,As-Ba-Fe-K,4,Supercon,Ba0.823K0.177Fe2As2,MP-mp-1223567,K1Ba2Fe6As6,As-Ba-Fe-K,As40Ba13.333Fe40K6.667,C 1 2/m 1,monoclinic,5.48060788,7.102799640000001,8.784942288492543,data/final/MP/cifs/As2Ba0.823Fe2K0.177-MP-mp-1223567-synth_doped.cif,data/source/MP/raw/cifs/mp-1223567.cif,mp-1223567,0.0,,2019-01-12 23:56:38.667000,6.101417464045543,,,,0.0186882046666676,4.38014394,520.0,-90.51509253,-6.034339502,{'tags': []},-90.51509253,-6.034339502,-0.4527993862000007,[],False,[],True,2021-05-12 11:00:52.054000,FM,15,4,mp-1223567,,KBa2(FeAs)6,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 2.0, 'Fe': 6.0, 'As': 6.0}",GGA,mp-1223567,"['mp-1223567', 'mp-1374097', 'mp-1656306', 'mp-1808539']",1.3326448,"{'K': 1.0, 'Ba': 2.0, 'Fe': 6.0, 'As': 6.0}",298.92336486922324,[],FM,True,12,2,"[0.0, 0.0, 0.0, 0.3, 0.3, 0.1, 0.3, 0.1, 0.3, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0044581486649028,1.3326448,6,1.3326448,MP,data/source/MP/cleaned/cifs/MP-mp-1223567.cif,True,,data/final/MP/graphs/As2Ba0.823Fe2K0.177-MP-mp-1223567-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
Li1Nb1O2,1,0.0,2.0,False,Li2Nb2O4,Li2Nb2O4,0.0,Oxide,True,Li25Nb25O50,Li-Nb-O,3,Supercon,Li1Nb1O2,MP-mp-3924,Li2Nb2O4,Li-Nb-O,Li25Nb25O50,P 63/m m c,hexagonal,2.9382460015394085,2.9382462799999995,10.596158,data/final/MP/cifs/Li1Nb1O2-MP-mp-3924.cif,data/source/MP/raw/cifs/mp-3924.cif,mp-3924,1.5790999999999995,,2011-05-13 04:22:15,5.52702240821137,10.17188/1207632,"@misc{osti_1207632,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LiNbO2 (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207632"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668027'}},0.0,5.23533304,520.0,-62.55535775,-7.81941971875,"{'tags': ['Lithium niobate(III)', 'Lithium dioxoniobate(III)', 'Lithium niobium(III) oxide', 'Lithium niobium oxide (1/1/2)']}",-62.55535775,-7.81941971875,-2.6863822395833346,"['xas', 'bandstructure', 'diel', 'phonons', 'elasticity']",True,"[73110, 451, 75880, 42008, 300243, 73109]",True,2021-05-12 10:56:20.740000,NM,8,9,mp-3924,oxide,LiNbO2,"{'functional': 'PBE', 'labels': ['Li_sv', 'Nb_pv', 'O'], 'pot_type': 'paw'}","{'Li': 1.0, 'Nb': 1.0, 'O': 2.0}",GGA,mp-3924,"['mp-661378', 'mp-662116', 'mp-660656', 'mp-3924', 'mp-1140636', 'mp-32179', 'mp-1438926', 'mp-1668027', 'mp-1801445']",2.5e-07,"{'Li': 2.0, 'Nb': 2.0, 'O': 4.0}",79.22375431180008,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",6.311238394890443e-09,2.5e-07,0,5e-07,MP,data/source/MP/cleaned/cifs/MP-mp-3924.cif,False,,data/final/MP/graphs/Li1Nb1O2-MP-mp-3924.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ge2Re1,1,0.0,2.0,False,Ge4Re2,Ge4Re2,2.7,Other,True,Ge66.667Re33.333,Ge-Re,2,Supercon,Re1Ge2,MP-mp-1025067,Re2Ge4,Ge-Re,Ge66.667Re33.333,C 1 2/m 1,monoclinic,3.2037099988868696,4.8588597,6.96665507070914,data/final/MP/cifs/Ge2Re1-MP-mp-1025067.cif,data/source/MP/raw/cifs/mp-1025067.cif,mp-1025067,0.0,,2016-09-29 17:12:01,11.175214981246318,10.17188/1355366,"@article{osti_1355366,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ReGe2 (SG:12) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1355366"",
    place = ""United States"",
    year = ""2017"",
    month = ""5""
}
",{'GGA': {'task_id': 'mp-1696027'}},0.010466161190477,5.26560629,520.0,-43.37943808,-7.229906346666667,"{'tags': ['Rhenium germanide (1/2)', 'Re3Ge7']}",-43.37943808,-7.229906346666667,0.0002879516666662,"['bandstructure', 'elasticity']",True,[637671],True,2021-05-12 10:56:10.715000,NM,6,6,mp-1025067,,ReGe2,"{'functional': 'PBE', 'labels': ['Re_pv', 'Ge_d'], 'pot_type': 'paw'}","{'Re': 1.0, 'Ge': 2.0}",GGA,mp-1025067,"['mp-1025067', 'mp-1080394', 'mp-1416390', 'mp-1696027', 'mp-1798207', 'mp-1587220']",3.5e-06,"{'Re': 2.0, 'Ge': 4.0}",98.51212965366064,[],NM,False,12,0,"[0, 0, 0, 0, 0, 0]",7.105723959688942e-08,3.5e-06,0,7e-06,MP,data/source/MP/cleaned/cifs/MP-mp-1025067.cif,False,,data/final/MP/graphs/Ge2Re1-MP-mp-1025067.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
Co1U6,1,0.0,2.0,False,Co2U12,Co2U12,2.358,Heavy_fermion,True,Co14.286U85.714,Co-U,2,Supercon,Co1U6,MP-mp-582635,U12Co2,Co-U,Co14.286U85.714,I 4/m c m,tetragonal,5.159668002407489,7.66916902998628,7.66916903,data/final/MP/cifs/Co1U6-MP-mp-582635.cif,data/source/MP/raw/cifs/mp-582635.cif,mp-582635,0.0,,2015-02-18 18:20:36,18.350875555967026,10.17188/1276991,"@misc{osti_1276991,
    author = ""Persson, Kristin"",
    title = ""Materials Data on U6Co (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1276991"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1708365'}},0.0407774460714254,13.89719457,520.0,-150.2155255,-10.729680392857144,"{'tags': ['Cobalt uranium (1/6)', 'Uranium cobalt (6/1)']}",-150.2155255,-10.729680392857144,-0.0358549850000002,"['xas', 'bandstructure']",True,"[625513, 108323]",True,2021-05-12 10:57:26.891000,NM,14,8,mp-582635,,U6Co,"{'functional': 'PBE', 'labels': ['U', 'Co'], 'pot_type': 'paw'}","{'U': 6.0, 'Co': 1.0}",GGA,mp-582635,"['mp-934080', 'mp-944771', 'mp-944132', 'mp-1426228', 'mp-1708365', 'mp-1868026', 'mp-1603208', 'mp-582635']",0.027408,"{'U': 12.0, 'Co': 2.0}",269.13143073714446,[],NM,False,140,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0]",0.0002036774368934,0.027408,0,0.054816,MP,data/source/MP/cleaned/cifs/MP-mp-582635.cif,False,,data/final/MP/graphs/Co1U6-MP-mp-582635.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
La0.9Ni1Th0.1O3,2,0.0399999999999999,2.0,False,La1.8Ni2Th0.2O6,La2Ni2O6,0.0,Oxide,True,La18Ni20Th2O60,La-Ni-Th-O,4,Supercon,La0.9Th0.1Ni1O3,MP-mp-19339,La2Ni2O6,La-Ni-O,La20Ni20O60,R -3 c,trigonal,5.44052788,5.44033618,5.4404415,data/final/MP/cifs/La0.9Ni1Th0.1O3-MP-mp-19339-synth_doped.cif,data/source/MP/raw/cifs/mp-19339.cif,mp-19339,0.0,,2013-06-07 05:29:36,6.934778690951409,10.17188/1194344,"@misc{osti_1194344,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaNiO3 (SG:167) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1194344"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-922720'}},0.0,6.77725286,520.0,-66.6331008,-6.66331008,"{'tags': ['Lanthanum nickel(III) oxide', 'Perovskite', 'Lanthanum niccolate(III)']}",-66.6331008,-6.66331008,-2.4717047200000004,"['xas', 'bandstructure']",True,"[173477, 93919, 67714, 91042, 67717, 187088, 67715, 187087, 84933, 67716]",True,2021-05-12 10:56:57.051000,FM,10,20,mp-19339,oxide,LaNiO3,"{'functional': 'PBE', 'labels': ['La', 'Ni_pv', 'O'], 'pot_type': 'paw'}","{'La': 1.0, 'Ni': 1.0, 'O': 3.0}",GGA+U,mp-19339,"['mp-923508', 'mp-908376', 'mp-922720', 'mp-611435', 'mp-19339', 'mp-1080688', 'mp-1092303', 'mp-1298178', 'mp-1298459', 'mp-1277409', 'mp-1284150', 'mp-1294225', 'mp-1283222', 'mp-1281199', 'mp-1279122', 'mp-1438619', 'mp-1668024', 'mp-1804253', 'mp-1876577', 'mp-1593937']",1.00042415,"{'La': 2.0, 'Ni': 2.0, 'O': 6.0}",117.6168836965564,[],FM,True,167,1,"[0.0, 0.0, 1.4, 1.4, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0170115738244013,1.00042415,2,2.0008483,MP,data/source/MP/cleaned/cifs/MP-mp-19339.cif,True,,data/final/MP/graphs/La0.9Ni1Th0.1O3-MP-mp-19339-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Bi1.05K0.95O3,2,0.02,1.0,True,Bi1.05K0.95O3,Bi1K1O3,8.1,Oxide,True,Bi21K19O60,Bi-K-O,3,Supercon,K0.95Bi1.05O3,MP-mp-982040,K1Bi1O3,Bi-K-O,Bi20K20O60,P m -3 m,cubic,4.284204,4.284204,4.284204,data/final/MP/cifs/Bi1.05K0.95O3-MP-mp-982040-synth_doped.cif,data/source/MP/raw/cifs/mp-982040.cif,mp-982040,0.0,,2015-10-12 11:25:13,6.252348761231978,10.17188/1316390,"@misc{osti_1316390,
    author = ""Persson, Kristin"",
    title = ""Materials Data on KBiO3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1316390"",
    place = ""United States"",
    year = ""2016"",
    month = ""9"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1717462'}},0.0928686834999998,1.80216133,520.0,-25.20286901,-5.040573802,{'tags': []},-25.20286901,-5.040573802,-1.4839105476,"['xas', 'elasticity']",False,[],True,2021-05-12 10:56:37.246000,NM,5,9,mp-982040,oxide,KBiO3,"{'functional': 'PBE', 'labels': ['K_sv', 'Bi', 'O'], 'pot_type': 'paw'}","{'K': 1.0, 'Bi': 1.0, 'O': 3.0}",GGA,mp-982040,"['mp-982222', 'mp-1006156', 'mp-982040', 'mp-1006117', 'mp-1431172', 'mp-1717462', 'mp-1798749', 'mp-1011221', 'mp-1585048']",0.0005425,"{'K': 1.0, 'Bi': 1.0, 'O': 3.0}",78.63401066432932,[],NM,False,221,0,"[0, 0, 0, 0, 0]",6.899050365315956e-06,0.0005425,0,0.0005425,MP,data/source/MP/cleaned/cifs/MP-mp-982040.cif,True,,data/final/MP/graphs/Bi1.05K0.95O3-MP-mp-982040-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Pd3Te1,1,0.0,1.0,True,Pd3Te1,Pd3Te1,0.76,Other,True,Pd75Te25,Pd-Te,2,Supercon,Pd3Te1,MP-mp-979273,Te1Pd3,Pd-Te,Pd75Te25,I 4/m m m,tetragonal,4.218948001987481,4.218948001987481,4.88582463,data/final/MP/cifs/Pd3Te1-MP-mp-979273.cif,data/source/MP/raw/cifs/mp-979273.cif,mp-979273,0.0,,2015-10-09 15:20:49,10.774057001814873,10.17188/1316113,"@misc{osti_1316113,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TePd3 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1316113"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1765893'}},0.0679712564999981,6.59196211,520.0,-19.58868603,-4.8971715075,{'tags': []},-19.58868603,-4.8971715075,-0.2264349175000006,"['xas', 'elasticity', 'bandstructure']",True,[],True,2021-05-12 10:56:37.246000,NM,4,6,mp-979273,,TePd3,"{'functional': 'PBE', 'labels': ['Te', 'Pd'], 'pot_type': 'paw'}","{'Te': 1.0, 'Pd': 3.0}",GGA,mp-979273,"['mp-979273', 'mp-980026', 'mp-1435323', 'mp-1765893', 'mp-1802265', 'mp-1613508']",0.0001655,"{'Te': 1.0, 'Pd': 3.0}",68.87178034939693,[],NM,False,139,0,"[0, 0, 0, 0]",2.4030161433375696e-06,0.0001655,0,0.0001655,MP,data/source/MP/cleaned/cifs/MP-mp-979273.cif,False,,data/final/MP/graphs/Pd3Te1-MP-mp-979273.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Hf0.99Ta0.01V2,2,0.0066666666666666,2.0,False,Hf1.98Ta0.02V4,Hf2V4,9.11,Other,True,Hf33Ta0.333V66.667,Hf-Ta-V,3,Supercon,Hf0.99Ta0.01V2,MP-mp-1077017,Hf2V4,Hf-V,Hf33.333V66.667,I 41/a m d,tetragonal,5.147745850539648,5.14774585,5.14774585,data/final/MP/cifs/Hf0.99Ta0.01V2-MP-mp-1077017-synth_doped.cif,data/source/MP/raw/cifs/mp-1077017.cif,mp-1077017,0.0,,2018-04-07 18:44:03,9.47163160017764,,,{'GGA': {'task_id': 'mp-1759109'}},0.0337706083333326,5.06389256,520.0,-56.04737833,-9.341229721666666,{'tags': ['Hafnium vanadium (1/2)']},-56.04737833,-9.341229721666666,0.033770608333332,['bandstructure'],True,[187951],True,2021-05-12 10:58:14.654000,NM,6,5,mp-1077017,,HfV2,"{'functional': 'PBE', 'labels': ['Hf_pv', 'V_pv'], 'pot_type': 'paw'}","{'Hf': 1.0, 'V': 2.0}",GGA,mp-1077017,"['mp-1077017', 'mp-1391381', 'mp-1759109', 'mp-1796366', 'mp-1627385']",0.03458425,"{'Hf': 2.0, 'V': 4.0}",98.30836742237948,[],NM,False,141,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0007035871087434,0.03458425,0,0.0691685,MP,data/source/MP/cleaned/cifs/MP-mp-1077017.cif,True,,data/final/MP/graphs/Hf0.99Ta0.01V2-MP-mp-1077017-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Bi1Pt1Se1,1,0.0,4.0,False,Bi4Pt4Se4,Bi4Pt4Se4,1.45,Other,True,Bi33.333Pt33.333Se33.333,Bi-Pt-Se,3,Supercon,Bi1Pt1Se1,MP-mp-1103607,Bi4Pt4Se4,Bi-Pt-Se,Bi33.333Pt33.333Se33.333,P 21 3,cubic,6.554152,6.554152,6.554152,data/final/MP/cifs/Bi1Pt1Se1-MP-mp-1103607.cif,data/source/MP/raw/cifs/mp-1103607.cif,mp-1103607,0.0,,2018-07-18 18:49:10,11.395375256181758,,,{'GGA': {'task_id': 'mp-1676532'}},0.0,6.11841269,520.0,-57.95093184,-4.82924432,"{'tags': ['NiSbS', 'PtBiSe', 'pyrite-marcasite family', 'Platinum bismuth selenide (1/1/1)']}",-57.95093184,-4.82924432,-0.5009598207812497,['bandstructure'],True,[616991],True,2021-05-12 10:58:20.361000,NM,12,5,mp-1103607,,BiPtSe,"{'functional': 'PBE', 'labels': ['Bi', 'Pt', 'Se'], 'pot_type': 'paw'}","{'Bi': 1.0, 'Pt': 1.0, 'Se': 1.0}",GGA,mp-1103607,"['mp-1103607', 'mp-1381527', 'mp-1676532', 'mp-1934872', 'mp-1603704']",0.0001404,"{'Bi': 4.0, 'Pt': 4.0, 'Se': 4.0}",281.5461073599704,[],NM,False,198,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.9946999277172285e-06,0.0001404,0,0.0005616,MP,data/source/MP/cleaned/cifs/MP-mp-1103607.cif,False,,data/final/MP/graphs/Bi1Pt1Se1-MP-mp-1103607.json,0,True,23,1,0,0,0,0,0,0,1,0,0,0,1.0,False
Ir2La1,1,0.0,2.0,False,Ir4La2,Ir4La2,0.24,Other,True,Ir66.667La33.333,Ir-La,2,Supercon,Ir2La1,MP-mp-1463,La2Ir4,Ir-La,Ir66.667La33.333,F d -3 m,cubic,5.47598341,5.47598341,5.47598341,data/final/MP/cifs/Ir2La1-MP-mp-1463.cif,data/source/MP/raw/cifs/mp-1463.cif,mp-1463,0.0,,2011-05-13 07:34:27,14.968945631330852,10.17188/1190798,"@misc{osti_1190798,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaIr2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1190798"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688126'}},0.0,9.63769276,520.0,-49.65559546,-8.275932576666667,{'tags': ['Iridium lanthanum (2/1)']},-49.65559546,-8.275932576666667,-0.7383099283333342,"['xas', 'elasticity', 'bandstructure']",True,"[640736, 104484, 104483]",True,2021-05-12 10:56:12.755000,NM,6,8,mp-1463,,LaIr2,"{'functional': 'PBE', 'labels': ['La', 'Ir'], 'pot_type': 'paw'}","{'La': 1.0, 'Ir': 2.0}",GGA,mp-1463,"['mp-931245', 'mp-915545', 'mp-932221', 'mp-1463', 'mp-1299960', 'mp-1688126', 'mp-1802976', 'mp-1591142']",4.15e-05,"{'La': 2.0, 'Ir': 4.0}",116.1104671540551,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",7.148365003981578e-07,4.15e-05,0,8.3e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1463.cif,False,,data/final/MP/graphs/Ir2La1-MP-mp-1463.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
B2Lu0.8Ru1Tb0.2,3,0.0999999999999999,4.0,False,B8Lu3.2Ru4Tb0.8,B8Lu4Ru4,0.0,Other,True,B50Lu20Ru25Tb5,B-Lu-Ru-Tb,4,Supercon,Lu0.8Tb0.2Ru1B2,MP-mp-29239,Lu4B8Ru4,B-Lu-Ru,B50Lu25Ru25,P n m a,orthorhombic,5.262881,5.829858,6.288542,data/final/MP/cifs/B2Lu0.8Ru1Tb0.2-MP-mp-29239-synth_doped.cif,data/source/MP/raw/cifs/mp-29239.cif,mp-29239,0.0,,2014-02-24 06:45:28,10.246997128776938,10.17188/1203618,"@misc{osti_1203618,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LuB2Ru (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1203618"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677301'}},0.0,6.02142224,520.0,-119.30016105,-7.456260065625,"{'tags': ['Lutetium ruthenium(III) boride', 'Lutetium ruthenium boride (1/1/2)']}",-119.30016105,-7.456260065625,-0.6677291364583331,"['xas', 'bandstructure']",True,"[614715, 100774]",True,2021-05-12 10:57:03.017000,NM,16,8,mp-29239,,LuB2Ru,"{'functional': 'PBE', 'labels': ['Lu_3', 'B', 'Ru_pv'], 'pot_type': 'paw'}","{'Lu': 1.0, 'B': 2.0, 'Ru': 1.0}",GGA,mp-29239,"['mp-909473', 'mp-925177', 'mp-924466', 'mp-29239', 'mp-1381674', 'mp-1677301', 'mp-1784701', 'mp-1603819']",4.565e-05,"{'Lu': 4.0, 'B': 8.0, 'Ru': 4.0}",192.9440954509509,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",9.4638812124945e-07,4.565e-05,0,0.0001826,MP,data/source/MP/cleaned/cifs/MP-mp-29239.cif,True,,data/final/MP/graphs/B2Lu0.8Ru1Tb0.2-MP-mp-29239-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ba1Nb2O5,3,0.0999999999999999,1.0,True,Ba1Nb2O5,Ba1Nb3O6,0.0,Oxide,True,Ba12.5Nb25O62.5,Ba-Nb-O,3,Supercon,Ba1Nb2O5,MP-mp-1205727,Ba1Nb3O6,Ba-Nb-O,Ba10Nb30O60,R 3 m,trigonal,2.9103099999999995,7.220685820000001,7.2206858,data/final/MP/cifs/Ba1Nb2O5-MP-mp-1205727-synth_doped.cif,data/source/MP/raw/cifs/mp-1205727.cif,mp-1205727,0.0,,2019-01-12 09:11:03.109000,6.589296245540585,,,,0.4715756759285696,5.55215674,520.0,-82.68349845,-8.268349845,{'tags': ['BaNb3O6']},-82.68349845,-8.268349845,-2.4894846470000003,[],False,[],True,2021-05-12 11:00:17.126000,NM,10,2,mp-1205727,oxide,BaNb3O6,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Nb_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Nb': 3.0, 'O': 6.0}",GGA,mp-1205727,"['mp-1205727', 'mp-1928014']",0.0006963,"{'Ba': 1.0, 'Nb': 3.0, 'O': 6.0}",129.03754964826857,[],NM,False,160,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.396103707006055e-06,0.0006963,0,0.0006963,MP,data/source/MP/cleaned/cifs/MP-mp-1205727.cif,True,,data/final/MP/graphs/Ba1Nb2O5-MP-mp-1205727-synth_doped.json,0,True,3m,0,0,0,0,0,0,5,1,0,0,0,1.0,False
Sn1,1,0.0,2.0,False,Sn2,Sn2,3.740729412,Other,True,Sn100,Sn,1,Supercon,Sn1,MP-mp-117,Sn2,Sn,Sn100,F d -3 m,cubic,4.69962117,4.69962117,4.69962117,data/final/MP/cifs/Sn1-MP-mp-117.cif,data/source/MP/raw/cifs/mp-117.cif,mp-117,0.0,,2011-05-12 19:59:17,5.371466121024904,10.17188/1188292,"@misc{osti_1188292,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sn (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188292"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688269'}},0.0,4.94236843,520.0,-8.01914371,-4.009571855,"{'tags': ['Tin - alpha, LT', 'Tin', 'Tin - grey, alpha', 'Tin grey', 'Tin - alpha']}",-8.01914371,-4.009571855,0.0,"['surfaces', 'eos', 'bandstructure', 'xas', 'elasticity']",True,"[426976, 40039, 76040, 53789, 70128]",True,2021-05-12 10:56:12.755000,NM,2,13,mp-117,,Sn,"{'functional': 'PBE', 'labels': ['Sn_d'], 'pot_type': 'paw'}",{'Sn': 1.0},GGA,mp-117,"['mp-922433', 'mp-117', 'mp-1057321', 'mp-1057292', 'mp-1057302', 'mp-907909', 'mp-923214', 'mp-1140045', 'mp-1440119', 'mp-1688269', 'mp-1784220', 'mp-1593540', 'mp-1057327']",0.0001439,{'Sn': 2.0},73.39619692452754,[],NM,False,227,0,"[0, 0]",3.92118409481e-06,0.0001439,0,0.0002878,MP,data/source/MP/cleaned/cifs/MP-mp-117.cif,False,,data/final/MP/graphs/Sn1-MP-mp-117.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Pd1Se2,1,0.0,4.0,False,Pd4Se8,Pd4Se8,0.0,Other,True,Pd33.333Se66.667,Pd-Se,2,Supercon,Pd1Se2,MP-mp-2418,Pd4Se8,Pd-Se,Pd33.333Se66.667,P b c a,orthorhombic,5.794418,5.945422,8.585061,data/final/MP/cifs/Pd1Se2-MP-mp-2418.cif,data/source/MP/raw/cifs/mp-2418.cif,mp-2418,0.0085000000000001,,2011-05-14 05:14:06,5.936576683260865,10.17188/1199960,"@misc{osti_1199960,
    author = ""Persson, Kristin"",
    title = ""Materials Data on PdSe2 (SG:61) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199960"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699384'}},0.0,2.82574535,520.0,-52.06871237,-4.339059364166666,"{'tags': ['Palladium(IV) selenide', 'Palladium selenide (1/2)', 'Palladium selenide']}",-52.06871237,-4.339059364166666,-0.5964911090624992,"['diel', 'xas', 'elasticity', 'bandstructure']",True,"[648826, 166277, 648838, 170327, 648835, 648829, 16693]",True,2021-05-12 10:56:16.728000,NM,12,12,mp-2418,,PdSe2,"{'functional': 'PBE', 'labels': ['Pd', 'Se'], 'pot_type': 'paw'}","{'Pd': 1.0, 'Se': 2.0}",GGA,mp-2418,"['mp-666481', 'mp-701931', 'mp-681878', 'mp-2418', 'mp-1101767', 'mp-1102213', 'mp-1102358', 'mp-1140386', 'mp-1413366', 'mp-1699384', 'mp-1807911', 'mp-1602724']",9.08e-05,"{'Pd': 4.0, 'Se': 8.0}",295.75758574986514,[],NM,False,61,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.2280327453956629e-06,9.08e-05,0,0.0003632,MP,data/source/MP/cleaned/cifs/MP-mp-2418.cif,False,,data/final/MP/graphs/Pd1Se2-MP-mp-2418.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
H0.827Pd1,3,0.0946907498631636,2.0,False,H1.654Pd2,H2Pd2,1.449,Other,True,H45.265Pd54.735,H-Pd,2,Supercon,H0.827Pd1,MP-mp-1184548,H2Pd2,H-Pd,H50Pd50,P 63 m c,hexagonal,2.968136003881316,2.96813585,5.040799,data/final/MP/cifs/H0.827Pd1-MP-mp-1184548-synth_doped.cif,data/source/MP/raw/cifs/mp-1184548.cif,mp-1184548,0.0,,2019-01-11 12:52:40.348000,9.276812227294194,,,{'GGA': {'task_id': 'mp-1734957'}},0.0,3.52113336,520.0,-17.47744839,-4.3693620975,{'tags': []},-17.47744839,-4.3693620975,-0.0830581699999992,['bandstructure'],True,[],True,2021-05-12 10:58:27.755000,NM,4,5,mp-1184548,,HPd,"{'functional': 'PBE', 'labels': ['H', 'Pd'], 'pot_type': 'paw'}","{'H': 1.0, 'Pd': 1.0}",GGA,mp-1184548,"['mp-1184548', 'mp-1426775', 'mp-1734957', 'mp-1792734', 'mp-1612181']",3.7e-05,"{'H': 2.0, 'Pd': 2.0}",38.45896345503417,[],NM,False,186,0,"[0, 0, 0, 0]",1.924128820749941e-06,3.7e-05,0,7.4e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1184548.cif,True,,data/final/MP/graphs/H0.827Pd1-MP-mp-1184548-synth_doped.json,0,True,6mm,0,5,0,0,0,0,0,1,0,0,0,1.0,False
As1Ce1F0.11Fe1O0.89,3,0.0549999999999999,2.0,False,As2Ce2F0.22Fe2O1.78,As2Ce2Fe2O2,47.0,Ferrite,True,As25Ce25F2.75Fe25O22.25,As-Ce-F-Fe-O,5,Supercon,Ce1Fe1As1F0.11O0.89,MP-mp-605060,Ce2Fe2As2O2,As-Ce-Fe-O,As25Ce25Fe25O25,P 4 m m,tetragonal,3.992256,3.992256,9.041971,data/final/MP/cifs/As1Ce1F0.11Fe1O0.89-MP-mp-605060-synth_doped.cif,data/source/MP/raw/cifs/mp-605060.cif,mp-605060,0.0,,2014-02-14 20:12:08,6.611233843492404,10.17188/1277425,"@misc{osti_1277425,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeFeAsO (SG:99) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277425"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-1751604'}},0.2072581873958352,6.30288445,520.0,-55.74271596,-6.967839495,{'tags': []},-55.74271596,-6.967839495,-1.7010452412499992,['bandstructure'],True,[],True,2021-05-12 10:58:51.532000,FiM,8,10,mp-605060,oxide,CeFeAsO,"{'functional': 'PBE', 'labels': ['Ce', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-605060,"['mp-605060', 'mp-917114', 'mp-918266', 'mp-919274', 'mp-1443189', 'mp-1751604', 'mp-1770633', 'mp-1779614', 'mp-1873964', 'mp-1622328']",2.99945325,"{'Ce': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",144.11191005541338,[],FiM,True,99,3,"[-0.5, -0.5, 3.5, 3.5, 0.0, 0.0, 0.0, 0.0]",0.0416267225775671,2.99945325,4,5.9989065,MP,data/source/MP/cleaned/cifs/MP-mp-605060.cif,True,,data/final/MP/graphs/As1Ce1F0.11Fe1O0.89-MP-mp-605060-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
Cu2La2Sr1O6.315,2,0.0253083196079219,0.9500296912114014,True,Cu1.9La1.9Sr0.95O6,Cu2La2Sr1O6,0.0,Cuprate,True,Cu17.676La17.676Sr8.838O55.81087052585064,Cu-La-Sr-O,4,Supercon,La2Sr1Cu2O6.315,MP-mp-1218240,Sr1La2Cu2O6,Cu-La-Sr-O,Cu18.182La18.182Sr9.091O54.54545454545455,I 4/m m m,tetragonal,3.878414000890276,3.878414000890275,10.332121229999998,data/final/MP/cifs/Cu2La2Sr1O6.315-MP-mp-1218240-synth_doped.cif,data/source/MP/raw/cifs/mp-1218240.cif,mp-1218240,0.0,,2019-01-12 19:26:29.085000,6.521932952077898,,,{'GGA': {'task_id': 'mp-1744577'}},0.040209457727272,6.22729824,520.0,-74.48878828,-6.7717080254545445,{'tags': []},-74.48878828,-6.7717080254545445,-2.6511910224242423,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,11,5,mp-1218240,oxide,SrLa2(CuO3)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 1.0, 'La': 2.0, 'Cu': 2.0, 'O': 6.0}",GGA,mp-1218240,"['mp-1218240', 'mp-1442927', 'mp-1744577', 'mp-1780326', 'mp-1622813']",0.0208588,"{'Sr': 1.0, 'La': 2.0, 'Cu': 2.0, 'O': 6.0}",149.8419813114288,[],NM,False,139,0,"[0.0, 0.0, 0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001392053136073,0.0208588,0,0.0208588,MP,data/source/MP/cleaned/cifs/MP-mp-1218240.cif,True,,data/final/MP/graphs/Cu2La2Sr1O6.315-MP-mp-1218240-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ba0.613Bi1K0.387O3,2,0.0214666666666666,3.0,False,Ba1.839Bi3K1.161O9,Ba2Bi3K1O9,30.7,Oxide,True,Ba12.26Bi20K7.74O60,Ba-Bi-K-O,4,Supercon,Ba0.613K0.387Bi1O3,MP-mp-1223518,K1Ba2Bi3O9,Ba-Bi-K-O,Ba13.333Bi20K6.667O60,P -3 m 1,trigonal,6.18756400330999,6.187564340000001,7.581401,data/final/MP/cifs/Ba0.613Bi1K0.387O3-MP-mp-1223518-synth_doped.cif,data/source/MP/raw/cifs/mp-1223518.cif,mp-1223518,0.0,,2019-01-12 23:54:06.965000,7.16530091201999,,,{'GGA': {'task_id': 'mp-1729135'}},0.001551682833333,3.46143017,520.0,-85.22271396,-5.681514264,{'tags': []},-85.22271396,-5.681514264,-2.0170414252000004,[],False,[],True,2021-05-12 11:00:52.054000,NM,15,4,mp-1223518,oxide,KBa2(BiO3)3,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Bi', 'O'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 2.0, 'Bi': 3.0, 'O': 9.0}",GGA,mp-1223518,"['mp-1223518', 'mp-1391182', 'mp-1729135', 'mp-1775199']",4.99e-05,"{'K': 1.0, 'Ba': 2.0, 'Bi': 3.0, 'O': 9.0}",251.37352739849624,[],NM,False,164,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.9850936777799505e-07,4.99e-05,0,4.99e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1223518.cif,True,,data/final/MP/graphs/Ba0.613Bi1K0.387O3-MP-mp-1223518-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ba2Cu4Pr0.5Y0.5O8,3,0.0222222222222222,3.0,False,Ba6Cu12Pr1.5Y1.5O24,Ba6Cu12Pr2Y1O24,50.5,Cuprate,True,Ba13.333Cu26.667Pr3.333Y3.333O53.333333333333336,Ba-Cu-Pr-Y-O,5,Supercon,Y0.5Pr0.5Ba2Cu4O8,MP-mp-1228680,Ba6Pr2Y1Cu12O24,Ba-Cu-Pr-Y-O,Ba13.333Cu26.667Pr4.444Y2.222O53.333333333333336,C m m m,orthorhombic,3.915598,3.938203,41.54960195,data/final/MP/cifs/Ba2Cu4Pr0.5Y0.5O8-MP-mp-1228680-synth_doped.cif,data/source/MP/raw/cifs/mp-1228680.cif,mp-1228680,0.0,,2019-01-13 04:21:52.401000,6.074507263149171,,,,0.0120846905555564,3.23727402,520.0,-270.06740063,-6.001497791777778,{'tags': []},-270.06740063,-6.001497791777778,-2.02381693525926,[],False,[],True,2021-05-12 11:01:01.648000,NM,45,2,mp-1228680,oxide,Ba6Pr2Y(CuO2)12,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Pr_3', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 6.0, 'Pr': 2.0, 'Y': 1.0, 'Cu': 12.0, 'O': 24.0}",GGA,mp-1228680,"['mp-1228680', 'mp-1886757']",0.000519,"{'Ba': 6.0, 'Pr': 2.0, 'Y': 1.0, 'Cu': 12.0, 'O': 24.0}",640.0006371700476,[],NM,False,38,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, 0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",8.109366926491078e-07,0.000519,0,0.000519,MP,data/source/MP/cleaned/cifs/MP-mp-1228680.cif,True,,data/final/MP/graphs/Ba2Cu4Pr0.5Y0.5O8-MP-mp-1228680-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ca0.14Cu1La1.86O4,2,0.0399999999999999,1.0,True,Ca0.14Cu1La1.86O4,Cu1La2O4,32.0,Cuprate,True,Ca2Cu14.286La26.571O57.142857142857146,Ca-Cu-La-O,4,Supercon,La1.86Ca0.14Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ca0.14Cu1La1.86O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ca0.14Cu1La1.86O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Fe1.78K0.8Se2,3,0.0733624454148471,1.0,True,Fe1.78K0.8Se2,Fe2K1Se2,32.0,Ferrite,True,Fe38.865K17.467Se43.668,Fe-K-Se,3,Supercon,K0.8Fe1.78Se2,MP-mp-1070735,K1Fe2Se2,Fe-K-Se,Fe40K20Se40,I 4/m m m,tetragonal,3.783558000712664,3.783558000712664,7.91886339,data/final/MP/cifs/Fe1.78K0.8Se2-MP-mp-1070735-synth_doped.cif,data/source/MP/raw/cifs/mp-1070735.cif,mp-1070735,0.0,,2018-03-22 03:52:22,4.804538531009527,,,{'GGA': {'task_id': 'mp-1761650'}},0.0327827750000011,3.42423866,520.0,-27.50456218,-5.500912436,{'tags': ['Potassium iron selenide (1/2/2)']},-27.50456218,-5.500912436,-0.6812646755374999,['bandstructure'],True,[186573],True,2021-05-12 10:58:14.654000,FM,5,8,mp-1070735,,K(FeSe)2,"{'functional': 'PBE', 'labels': ['K_sv', 'Fe_pv', 'Se'], 'pot_type': 'paw'}","{'K': 1.0, 'Fe': 2.0, 'Se': 2.0}",GGA,mp-1070735,"['mp-1070735', 'mp-1070765', 'mp-1070841', 'mp-1416829', 'mp-1761650', 'mp-1797161', 'mp-1585994', 'mp-1070830']",6.0503851,"{'K': 1.0, 'Fe': 2.0, 'Se': 2.0}",106.69540665041993,[],FM,True,139,1,"[0.0, 2.8, 2.8, 0.0, 0.0]",0.0567070813069176,6.0503851,2,6.0503851,MP,data/source/MP/cleaned/cifs/MP-mp-1070735.cif,True,,data/final/MP/graphs/Fe1.78K0.8Se2-MP-mp-1070735-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ce0.96Pt3Si1Th0.04,2,0.016,1.0,True,Ce0.96Pt3Si1Th0.04,Ce1Pt3Si1,0.0,Heavy_fermion,True,Ce19.2Pt60Si20Th0.8,Ce-Pt-Si-Th,4,Supercon,Ce0.96Th0.04Pt3Si1,MP-mp-1207119,Ce1Si1Pt3,Ce-Pt-Si,Ce20Pt60Si20,P 4 m m,tetragonal,4.067884,4.067884,5.552623,data/final/MP/cifs/Ce0.96Pt3Si1Th0.04-MP-mp-1207119-synth_doped.cif,data/source/MP/raw/cifs/mp-1207119.cif,mp-1207119,0.0,,2019-01-12 10:17:34.047000,13.616649050512317,,,,0.0,7.99187805,520.0,-34.84666915,-6.969333829999999,"{'tags': ['CePt3Si', 'CePt3B']}",-34.84666915,-6.969333829999999,-1.0409085689999995,[],False,[],True,2021-05-12 11:00:19.396000,NM,5,2,mp-1207119,,CeSiPt3,"{'functional': 'PBE', 'labels': ['Ce', 'Si', 'Pt'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Si': 1.0, 'Pt': 3.0}",GGA,mp-1207119,"['mp-1207119', 'mp-1923489']",0.0099182,"{'Ce': 1.0, 'Si': 1.0, 'Pt': 3.0}",91.88302988314366,[],NM,False,99,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",0.0001079437629844,0.0099182,0,0.0099182,MP,data/source/MP/cleaned/cifs/MP-mp-1207119.cif,True,,data/final/MP/graphs/Ce0.96Pt3Si1Th0.04-MP-mp-1207119-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
Bi2Ca0.1Cu2Sr2Y0.9O8,2,0.0133333333333333,2.0,False,Bi4Ca0.2Cu4Sr4Y1.8O16,Bi4Cu4Sr4Y2O16,0.0,Cuprate,True,Bi13.333Ca0.667Cu13.333Sr13.333Y6O53.333333333333336,Bi-Ca-Cu-Sr-Y-O,6,Supercon,Bi2Sr2Ca0.1Y0.9Cu2O8,MP-mp-1208863,Sr4Y2Cu4Bi4O16,Bi-Cu-Sr-Y-O,Bi13.333Cu13.333Sr13.333Y6.667O53.333333333333336,C c c m,orthorhombic,5.350205,5.505885998177413,15.59802851,data/final/MP/cifs/Bi2Ca0.1Cu2Sr2Y0.9O8-MP-mp-1208863-synth_doped.cif,data/source/MP/raw/cifs/mp-1208863.cif,mp-1208863,0.0,,2019-01-12 11:41:58.514000,6.881971262733002,,,{'GGA': {'task_id': 'mp-1680775'}},0.0913935707916726,5.2812548,520.0,-185.05210166,-6.1684033886666665,"{'tags': ['high-Tc cuprate family', 'Sr2(Sr0.4Y0.6)Cu2Bi2O8.7', 'Sr2.4Cu2Y0.6Bi2O8.7']}",-185.05210166,-6.1684033886666665,-2.174294854,[],False,[],True,2021-05-12 11:00:21.818000,FM,30,4,mp-1208863,oxide,Sr2YCu2(BiO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Y_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Y': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",GGA,mp-1208863,"['mp-1208863', 'mp-1359079', 'mp-1680775', 'mp-1819085']",0.1409948,"{'Sr': 4.0, 'Y': 2.0, 'Cu': 4.0, 'Bi': 4.0, 'O': 16.0}",452.2677998757687,[],FM,True,66,1,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.1, 0.1, 0.1, 0.1, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0006235013858547,0.1409948,4,0.2819896,MP,data/source/MP/cleaned/cifs/MP-mp-1208863.cif,True,,data/final/MP/graphs/Bi2Ca0.1Cu2Sr2Y0.9O8-MP-mp-1208863-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
P1Rh0.01Ru0.99Zr1,2,0.0066666666666666,4.0,False,P4Rh0.04Ru3.96Zr4,P4Ru4Zr4,10.1,Other,True,P33.333Rh0.333Ru33Zr33.333,P-Rh-Ru-Zr,4,Supercon,Zr1Ru0.99Rh0.01P1,MP-mp-22268,Zr4P4Ru4,P-Ru-Zr,P33.333Ru33.333Zr33.333,P n m a,orthorhombic,3.896771,6.476559,7.378435,data/final/MP/cifs/P1Rh0.01Ru0.99Zr1-MP-mp-22268-synth_doped.cif,data/source/MP/raw/cifs/mp-22268.cif,mp-22268,0.0,,2014-02-22 18:40:36,7.963823777103373,10.17188/1197495,"@misc{osti_1197495,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrPRu (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197495"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677547'}},0.0,7.91938263,520.0,-106.40582437,-8.867152030833333,"{'tags': ['Ruthenium zirconium phosphide (1/1/1)', 'Zirconium ruthenium phosphide (1/1/1)']}",-106.40582437,-8.867152030833333,-1.1220211002777785,"['xas', 'elasticity', 'bandstructure']",True,"[648038, 30727]",True,2021-05-12 10:56:16.728000,NM,12,9,mp-22268,,ZrPRu,"{'functional': 'PBE', 'labels': ['Zr_sv', 'P', 'Ru_pv'], 'pot_type': 'paw'}","{'Zr': 1.0, 'P': 1.0, 'Ru': 1.0}",GGA,mp-22268,"['mp-921696', 'mp-907212', 'mp-920689', 'mp-22268', 'mp-1102635', 'mp-1442687', 'mp-1677547', 'mp-1785321', 'mp-1602314']",3.01e-05,"{'Zr': 4.0, 'P': 4.0, 'Ru': 4.0}",186.21448765818843,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.46566233992512e-07,3.01e-05,0,0.0001204,MP,data/source/MP/cleaned/cifs/MP-mp-22268.cif,True,,data/final/MP/graphs/P1Rh0.01Ru0.99Zr1-MP-mp-22268-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Sn0.985Te1,2,0.0075566750629723,1.0,True,Sn0.985Te1,Sn1Te1,0.0466,Other,True,Sn49.622Te50.378,Sn-Te,2,Supercon,Sn0.985Te1,MP-mp-1883,Sn1Te1,Sn-Te,Sn50Te50,F m -3 m,cubic,4.53766968,4.53766968,4.53766968,data/final/MP/cifs/Sn0.985Te1-MP-mp-1883-synth_doped.cif,data/source/MP/raw/cifs/mp-1883.cif,mp-1883,0.6623999999999999,,2011-05-12 18:43:07,6.19081042904143,10.17188/1193534,"@misc{osti_1193534,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SnTe (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1193534"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686906'}},0.0,6.06645058,520.0,-7.72519638,-3.86259819,"{'tags': ['Tin telluride (1/1)', 'Tin telluride']}",-7.72519638,-3.86259819,-0.4971617975000004,"['eos', 'elasticity', 'bandstructure', 'xas']",True,"[52489, 652760, 652744, 652756, 652761, 600865, 652763, 652745, 652742, 604177, 600813, 652741, 601065, 652750, 652755, 652753, 652751, 652749, 652752, 600136, 652754, 652746, 652759]",True,2021-05-12 10:56:14.760000,NM,2,9,mp-1883,,SnTe,"{'functional': 'PBE', 'labels': ['Sn_d', 'Te'], 'pot_type': 'paw'}","{'Sn': 1.0, 'Te': 1.0}",GGA,mp-1883,"['mp-663289', 'mp-655511', 'mp-657302', 'mp-1883', 'mp-1440781', 'mp-1686906', 'mp-1784332', 'mp-1596407', 'mp-1596974']",0.0,"{'Sn': 1.0, 'Te': 1.0}",66.06685541129963,[],NM,False,225,0,"[0, 0]",0.0,0.0,0,0.0,MP,data/source/MP/cleaned/cifs/MP-mp-1883.cif,True,,data/final/MP/graphs/Sn0.985Te1-MP-mp-1883-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Os1Ti1,1,0.0,1.0,True,Os1Ti1,Os1Ti1,0.46,Other,True,Os50Ti50,Os-Ti,2,Supercon,Os1Ti1,MP-mp-291,Ti1Os1,Os-Ti,Os50Ti50,P m -3 m,cubic,3.095162,3.095162,3.095162,data/final/MP/cifs/Os1Ti1-MP-mp-291.cif,data/source/MP/raw/cifs/mp-291.cif,mp-291,0.0,,2011-05-12 19:24:10,13.333767140704715,10.17188/1203169,"@misc{osti_1203169,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TiOs (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1203169"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688608'}},0.0,7.62617406,520.0,-20.53698073,-10.268490365,{'tags': ['Osmium titanium (1/1)']},-20.53698073,-10.268490365,-0.7070612291666674,"['xas', 'elasticity', 'bandstructure']",True,"[290933, 105573, 647842, 105572, 647841]",True,2021-05-12 10:56:18.721000,NM,2,12,mp-291,,TiOs,"{'functional': 'PBE', 'labels': ['Ti_pv', 'Os_pv'], 'pot_type': 'paw'}","{'Ti': 1.0, 'Os': 1.0}",GGA,mp-291,"['mp-929478', 'mp-929154', 'mp-912771', 'mp-291', 'mp-1057438', 'mp-1057426', 'mp-1057461', 'mp-1442176', 'mp-1688608', 'mp-1791479', 'mp-1587613', 'mp-1057455']",0.0017294,"{'Ti': 1.0, 'Os': 1.0}",29.6517380248298,[],NM,False,221,0,"[0, 0]",5.832373126161555e-05,0.0017294,0,0.0017294,MP,data/source/MP/cleaned/cifs/MP-mp-291.cif,False,,data/final/MP/graphs/Os1Ti1-MP-mp-291.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
La2S3,1,0.0,4.0,False,La8S12,La8S12,0.0,Other,True,La40S60,La-S,2,Supercon,La2S3,MP-mp-7475,La8S12,La-S,La40S60,P n m a,orthorhombic,4.160674,7.616566,15.884064,data/final/MP/cifs/La2S3-MP-mp-7475.cif,data/source/MP/raw/cifs/mp-7475.cif,mp-7475,1.0358,,2011-06-06 17:28:32,4.9351807310837525,10.17188/1288478,"@misc{osti_1288478,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La2S3 (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1288478"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1674949'}},0.0,5.952125,520.0,-132.9767532,-6.64883766,"{'tags': ['Lanthanum sulfide (2/3)', 'Lanthanum sulfide - alpha', 'Lanthanum sulfide - A-type']}",-132.9767532,-6.64883766,-2.494364897875,"['bandstructure', 'elasticity']",True,"[166513, 15151, 641807]",True,2021-05-12 10:56:29.056000,NM,20,8,mp-7475,,La2S3,"{'functional': 'PBE', 'labels': ['La', 'S'], 'pot_type': 'paw'}","{'La': 2.0, 'S': 3.0}",GGA,mp-7475,"['mp-681453', 'mp-666106', 'mp-701670', 'mp-7475', 'mp-1382464', 'mp-1674949', 'mp-1825305', 'mp-1606398']",0.00048995,"{'La': 8.0, 'S': 12.0}",503.3667525882679,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.893383879493191e-06,0.00048995,0,0.0019598,MP,data/source/MP/cleaned/cifs/MP-mp-7475.cif,False,,data/final/MP/graphs/La2S3-MP-mp-7475.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ga1V2.1,3,0.1451612903225806,2.0,False,Ga2V4.2,Ga2V6,6.3,Other,True,Ga32.258V67.742,Ga-V,2,Supercon,Ga1V2.1,MP-mp-22568,V6Ga2,Ga-V,Ga25V75,P m -3 n,cubic,4.789645,4.789645,4.789645,data/final/MP/cifs/Ga1V2.1-MP-mp-22568-synth_doped.cif,data/source/MP/raw/cifs/mp-22568.cif,mp-22568,0.0,,2014-02-22 11:36:40,6.726541666276222,10.17188/1198793,"@misc{osti_1198793,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Ga (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198793"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686867'}},0.0,5.67452231,520.0,-61.95244347,-7.74405543375,{'tags': ['Gallium vanadium (1/3)']},-61.95244347,-7.74405543375,-0.1741018756249994,"['xas', 'elasticity', 'bandstructure']",True,"[635643, 635628, 635619, 635634, 104021, 635646, 635604, 635610, 635617, 635624, 635626, 635605, 635631, 635625, 635636, 635603, 104020, 635616, 635607]",True,2021-05-12 10:56:16.728000,FM,8,9,mp-22568,,V3Ga,"{'functional': 'PBE', 'labels': ['V_pv', 'Ga_d'], 'pot_type': 'paw'}","{'V': 3.0, 'Ga': 1.0}",GGA,mp-22568,"['mp-941343', 'mp-941663', 'mp-934924', 'mp-22568', 'mp-1440749', 'mp-1686867', 'mp-1804076', 'mp-1593784', 'mp-1595713']",0.09063635,"{'V': 6.0, 'Ga': 2.0}",109.87780534443452,[],FM,True,131,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.0, -0.0, -0.0]",0.0016497662965852,0.09063635,2,0.1812727,MP,data/source/MP/cleaned/cifs/MP-mp-22568.cif,True,,data/final/MP/graphs/Ga1V2.1-MP-mp-22568-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Fe2Si2Y1,1,0.0,1.0,True,Fe2Si2Y1,Fe2Si2Y1,2.9,Other,True,Fe40Si40Y20,Fe-Si-Y,3,Supercon,Y1Fe2Si2,MP-mp-5288,Y1Fe2Si2,Fe-Si-Y,Fe40Si40Y20,I 4/m m m,tetragonal,3.9678680008130542,3.9678680008130542,5.52996739,data/final/MP/cifs/Fe2Si2Y1-MP-mp-5288.cif,data/source/MP/raw/cifs/mp-5288.cif,mp-5288,0.0,,2011-05-13 03:22:08,5.68301635941366,10.17188/1263182,"@misc{osti_1263182,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Y(FeSi)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1263182"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698085'}},0.0,6.42214726,520.0,-37.64165294,-7.528330588,"{'tags': ['Yttrium iron silicide (1/2/2)', 'Iron yttrium silicide (2/1/2)']}",-37.64165294,-7.528330588,-0.6485073773333326,"['xas', 'elasticity', 'bandstructure']",True,"[193616, 633642, 53556]",True,2021-05-12 10:56:22.739000,NM,5,13,mp-5288,,Y(FeSi)2,"{'functional': 'PBE', 'labels': ['Y_sv', 'Fe_pv', 'Si'], 'pot_type': 'paw'}","{'Y': 1.0, 'Fe': 2.0, 'Si': 2.0}",GGA,mp-5288,"['mp-1000949', 'mp-1007397', 'mp-5288', 'mp-1068071', 'mp-1068110', 'mp-1068026', 'mp-1170847', 'mp-1438528', 'mp-1698085', 'mp-1876617', 'mp-1012158', 'mp-1591353', 'mp-1068097']",0.0246538,"{'Y': 1.0, 'Fe': 2.0, 'Si': 2.0}",75.0255425055318,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",0.0003286054212561,0.0246538,0,0.0246538,MP,data/source/MP/cleaned/cifs/MP-mp-5288.cif,False,,data/final/MP/graphs/Fe2Si2Y1-MP-mp-5288.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ba2Ca0.2Cu3Y0.8O6,3,0.0333333333333333,1.0,True,Ba2Ca0.2Cu3Y0.8O6,Ba2Cu3Y1O6,24.0,Cuprate,True,Ba16.667Ca1.667Cu25Y6.667O50,Ba-Ca-Cu-Y-O,5,Supercon,Y0.8Ca0.2Ba2Cu3O6,MP-mp-22215,Ba2Y1Cu3O6,Ba-Cu-Y-O,Ba16.667Cu25Y8.333O50,P 4/m m m,tetragonal,3.890574,3.890574,12.12302,data/final/MP/cifs/Ba2Ca0.2Cu3Y0.8O6-MP-mp-22215-synth_doped.cif,data/source/MP/raw/cifs/mp-22215.cif,mp-22215,0.0,,2014-02-22 10:32:14,5.883747679108356,10.17188/1197430,"@misc{osti_1197430,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Y(CuO2)3 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197430"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697120'}},0.0102308603749952,3.24358281,520.0,-74.96347692,-6.24695641,"{'tags': ['Dibarium yttrium dicopper copper(I) hexaoxide', 'Yttrium dibarium copper(I) dicopper oxide', 'Yttrium dibarium copper oxide (1/2/3/6)', 'Dibarium yttrium tricopper hexaoxide', 'Yttrium barium copper oxide (1/2/3/6)']}",-74.96347692,-6.24695641,-2.232973175555556,"['xas', 'bandstructure']",True,"[68290, 72254, 63424, 66903, 68046, 68008, 67016, 84739, 203116, 63269]",True,2021-05-12 10:56:59.077000,NM,12,11,mp-22215,oxide,Ba2Y(CuO2)3,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Cu': 3.0, 'O': 6.0}",GGA,mp-22215,"['mp-917350', 'mp-923178', 'mp-922392', 'mp-610585', 'mp-22215', 'mp-1182689', 'mp-1236883', 'mp-1432999', 'mp-1697120', 'mp-1830265', 'mp-1587968']",0.1132814,"{'Ba': 2.0, 'Y': 1.0, 'Cu': 3.0, 'O': 6.0}",183.5008929491185,[],NM,False,123,0,"[0.0, 0.0, 0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0006173343256232,0.1132814,0,0.1132814,MP,data/source/MP/cleaned/cifs/MP-mp-22215.cif,True,,data/final/MP/graphs/Ba2Ca0.2Cu3Y0.8O6-MP-mp-22215-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Si3V5,1,0.0,2.0,False,Si6V10,Si6V10,0.0,Other,True,Si37.5V62.5,Si-V,2,Supercon,Si3V5,MP-mp-568671,V10Si6,Si-V,Si37.5V62.5,I 4/m c m,tetragonal,4.724050000064136,7.062475930523686,7.06247593,data/final/MP/cifs/Si3V5-MP-mp-568671.cif,data/source/MP/raw/cifs/mp-568671.cif,mp-568671,0.0,,2015-02-15 05:41:39,5.379232288046671,10.17188/1274636,"@misc{osti_1274636,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V5Si3 (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1274636"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704108'}},0.0,7.98223019,520.0,-132.72518617,-8.295324135625,{'tags': ['Vanadium silicide (5/3)']},-132.72518617,-8.295324135625,-0.5567650843750016,"['xas', 'elasticity', 'bandstructure']",True,"[652495, 652485, 652527, 652506]",True,2021-05-12 10:56:22.739000,NM,16,12,mp-568671,,V5Si3,"{'functional': 'PBE', 'labels': ['V_pv', 'Si'], 'pot_type': 'paw'}","{'V': 5.0, 'Si': 3.0}",GGA,mp-568671,"['mp-933835', 'mp-943939', 'mp-944596', 'mp-1124900', 'mp-1146753', 'mp-568671', 'mp-1188847', 'mp-1190283', 'mp-1475686', 'mp-1704108', 'mp-1789507', 'mp-1598787']",0.00130135,"{'V': 10.0, 'Si': 6.0}",209.27260026370467,[],NM,False,69,0,"[0.0, 0.0, -0.0, -0.0, 0.0, -0.0, 0.0, 0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",1.2436888521098005e-05,0.00130135,0,0.0026027,MP,data/source/MP/cleaned/cifs/MP-mp-568671.cif,False,,data/final/MP/graphs/Si3V5-MP-mp-568671.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Hg1Li3,1,0.0,1.0,True,Hg1Li3,Hg1Li3,0.0,Other,True,Hg25Li75,Hg-Li,2,Supercon,Hg1Li3,MP-mp-1646,Li3Hg1,Hg-Li,Hg25Li75,F m -3 m,cubic,4.63143487,4.63143487,4.63143487,data/final/MP/cifs/Hg1Li3-MP-mp-1646.cif,data/source/MP/raw/cifs/mp-1646.cif,mp-1646,0.0,,2011-05-12 18:54:21,5.233841055431295,10.17188/1191875,"@misc{osti_1191875,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Li3Hg (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191875"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703650'}},0.0,1.20833758,520.0,-7.15016719,-1.7875417975,{'tags': ['Mercury lithium (1/3)']},-7.15016719,-1.7875417975,-0.2799295562500001,"['eos', 'elasticity', 'bandstructure', 'xas']",True,"[104309, 639073]",True,2021-05-12 10:56:14.760000,NM,4,7,mp-1646,,Li3Hg,"{'functional': 'PBE', 'labels': ['Li_sv', 'Hg'], 'pot_type': 'paw'}","{'Li': 3.0, 'Hg': 1.0}",GGA,mp-1646,"['mp-993576', 'mp-991668', 'mp-1646', 'mp-1438509', 'mp-1703650', 'mp-1799253', 'mp-994870']",0.0032323,"{'Li': 3.0, 'Hg': 1.0}",70.2476312251726,[],NM,False,225,0,"[0, 0, 0, 0]",4.601293942053572e-05,0.0032323,0,0.0032323,MP,data/source/MP/cleaned/cifs/MP-mp-1646.cif,False,,data/final/MP/graphs/Hg1Li3-MP-mp-1646.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Li1.15Ti1.85O4,2,0.0428571428571428,2.0,False,Li2.3Ti3.7O8,Li2Ti4O8,0.0,Oxide,True,Li16.429Ti26.429O57.142857142857146,Li-Ti-O,3,Supercon,Li1.15Ti1.85O4,MP-mp-5670,Li2Ti4O8,Li-Ti-O,Li14.286Ti28.571O57.142857142857146,F d -3 m,cubic,5.986032260000001,5.98603226,5.98603226,data/final/MP/cifs/Li1.15Ti1.85O4-MP-mp-5670-synth_doped.cif,data/source/MP/raw/cifs/mp-5670.cif,mp-5670,0.0,,2011-05-14 11:10:22,3.649565337909552,10.17188/1273637,"@misc{osti_1273637,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LiTi2O4 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1273637"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699404'}},0.0,5.03116805,520.0,-114.93444733,-8.209603380714286,"{'tags': ['Lithium titanium oxide (1/2/4)', 'Lithium titanium(III) titanium(IV) oxide', 'Lithium titanium(III) titanium oxide', 'Lithium titanium titanium(III) oxide', 'Lithium titano(III)titanate', 'Spinel-(Li,Ti)']}",-114.93444733,-8.209603380714286,-3.2462103921428564,"['bandstructure', 'elasticity']",True,"[72859, 78482, 154982, 81329, 15789, 48127]",True,2021-05-12 10:56:22.739000,NM,14,7,mp-5670,oxide,LiTi2O4,"{'functional': 'PBE', 'labels': ['Li_sv', 'Ti_pv', 'O'], 'pot_type': 'paw'}","{'Li': 1.0, 'Ti': 2.0, 'O': 4.0}",GGA,mp-5670,"['mp-923613', 'mp-922835', 'mp-908534', 'mp-5670', 'mp-1418091', 'mp-1699404', 'mp-1787951']",0.0521081,"{'Li': 2.0, 'Ti': 4.0, 'O': 8.0}",151.67086379131675,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0006871207652868,0.0521081,0,0.1042162,MP,data/source/MP/cleaned/cifs/MP-mp-5670.cif,True,,data/final/MP/graphs/Li1.15Ti1.85O4-MP-mp-5670-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Co2Ge2Sr1,1,0.0,1.0,True,Co2Ge2Sr1,Co2Ge2Sr1,0.0,Other,True,Co40Ge40Sr20,Co-Ge-Sr,3,Supercon,Sr1Co2Ge2,MP-mp-7361,Sr1Co2Ge2,Co-Ge-Sr,Co40Ge40Sr20,I 4/m m m,tetragonal,4.033349999543224,4.033349999543224,6.18842841,data/final/MP/cifs/Co2Ge2Sr1-MP-mp-7361.cif,data/source/MP/raw/cifs/mp-7361.cif,mp-7361,0.0,,2011-05-28 08:45:14,6.519288707190946,10.17188/1287850,"@misc{osti_1287850,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr(CoGe)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1287850"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696717'}},0.0,4.08994229,520.0,-27.28843535,-5.45768707,{'tags': ['Strontium cobalt germanide (1/2/2)']},-27.28843535,-5.45768707,-0.4272501193333333,"['bandstructure', 'elasticity']",True,[407],True,2021-05-12 10:56:29.056000,NM,5,8,mp-7361,,Sr(CoGe)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Co', 'Ge_d'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Co': 2.0, 'Ge': 2.0}",GGA,mp-7361,"['mp-922151', 'mp-921920', 'mp-907526', 'mp-7361', 'mp-1440540', 'mp-1696717', 'mp-1783479', 'mp-1588219']",0.0158498,"{'Sr': 1.0, 'Co': 2.0, 'Ge': 2.0}",89.3443011969667,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",0.0001774013539493,0.0158498,0,0.0158498,MP,data/source/MP/cleaned/cifs/MP-mp-7361.cif,False,,data/final/MP/graphs/Co2Ge2Sr1-MP-mp-7361.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Al1Nd1Rh1,1,0.0,4.0,False,Al4Nd4Rh4,Al4Nd4Rh4,0.0,Other,True,Al33.333Nd33.333Rh33.333,Al-Nd-Rh,3,Supercon,Nd1Rh1Al1,MP-mp-1209843,Nd4Al4Rh4,Al-Nd-Rh,Al33.333Nd33.333Rh33.333,P n m a,orthorhombic,4.29635,7.088643,8.093107,data/final/MP/cifs/Al1Nd1Rh1-MP-mp-1209843.cif,data/source/MP/raw/cifs/mp-1209843.cif,mp-1209843,0.0,,2019-01-12 12:29:51.119000,7.387306033649939,,,{'GGA': {'task_id': 'mp-1737281'}},0.0,5.50570184,520.0,-73.35217633,-6.112681360833334,"{'tags': ['TiNiSi', 'AlB2 family', 'NdRhAl']}",-73.35217633,-6.112681360833334,-0.8200057241666675,[],False,[],True,2021-05-12 11:00:24.227000,NM,12,4,mp-1209843,,NdAlRh,"{'functional': 'PBE', 'labels': ['Nd_3', 'Al', 'Rh_pv'], 'pot_type': 'paw'}","{'Nd': 1.0, 'Al': 1.0, 'Rh': 1.0}",GGA,mp-1209843,"['mp-1209843', 'mp-1391544', 'mp-1737281', 'mp-1776500']",0.000270275,"{'Nd': 4.0, 'Al': 4.0, 'Rh': 4.0}",246.47793163640844,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.386193899074028e-06,0.000270275,0,0.0010811,MP,data/source/MP/cleaned/cifs/MP-mp-1209843.cif,False,,data/final/MP/graphs/Al1Nd1Rh1-MP-mp-1209843.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Er1Ir1Si1,1,0.0,4.0,False,Er4Ir4Si4,Er4Ir4Si4,0.0,Other,True,Er33.333Ir33.333Si33.333,Er-Ir-Si,3,Supercon,Er1Ir1Si1,MP-mp-20733,Er4Si4Ir4,Er-Ir-Si,Er33.333Ir33.333Si33.333,P n m a,orthorhombic,4.209637,6.791188,7.443742,data/final/MP/cifs/Er1Ir1Si1-MP-mp-20733.cif,data/source/MP/raw/cifs/mp-20733.cif,mp-20733,0.0,,2014-02-21 16:22:53,12.096730458224794,10.17188/1195898,"@misc{osti_1195898,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ErSiIr (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195898"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697460'}},0.0,6.94965077,520.0,-88.44009451,-7.370007875833333,"{'tags': ['Erbium iridium silicide (1/1/1)', 'Erbium iridium silicide']}",-88.44009451,-7.370007875833333,-1.0928534591666663,"['xas', 'bandstructure']",True,"[93220, 413856, 630720, 93223]",True,2021-05-12 10:56:57.051000,NM,12,11,mp-20733,,ErSiIr,"{'functional': 'PBE', 'labels': ['Er_3', 'Si', 'Ir'], 'pot_type': 'paw'}","{'Er': 1.0, 'Si': 1.0, 'Ir': 1.0}",GGA,mp-20733,"['mp-927822', 'mp-927370', 'mp-911397', 'mp-20733', 'mp-1102818', 'mp-1144304', 'mp-1257355', 'mp-1414142', 'mp-1697460', 'mp-1788633', 'mp-1599792']",7.625e-06,"{'Er': 4.0, 'Si': 4.0, 'Ir': 4.0}",212.8049438424997,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.433237379229945e-07,7.625e-06,0,3.05e-05,MP,data/source/MP/cleaned/cifs/MP-mp-20733.cif,False,,data/final/MP/graphs/Er1Ir1Si1-MP-mp-20733.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
B2C1Co0.1Er1Ni1.9,2,0.0333333333333333,1.0,True,B2C1Co0.1Er1Ni1.9,B2C1Er1Ni2,3.1,Other,True,B33.333C16.667Co1.667Er16.667Ni31.667,B-C-Co-Er-Ni,5,Supercon,Er1Ni1.9Co0.1B2C1,MP-mp-6098,Er1Ni2B2C1,B-C-Er-Ni,B33.333C16.667Er16.667Ni33.333,I 4/m m m,tetragonal,3.5122880026935177,3.5122880026935173,5.77805085,data/final/MP/cifs/B2C1Co0.1Er1Ni1.9-MP-mp-6098-synth_doped.cif,data/source/MP/raw/cifs/mp-6098.cif,mp-6098,0.0,,2011-05-13 04:24:02,8.212015229638553,10.17188/1277667,"@misc{osti_1277667,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ErNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277667"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700042'}},0.0,6.72687579,520.0,-41.84324782,-6.973874636666667,{'tags': []},-41.84324782,-6.973874636666667,-0.5216152347222227,"['xas', 'elasticity', 'bandstructure']",True,"[246431, 79576, 56651]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-6098,,ErNi2B2C,"{'functional': 'PBE', 'labels': ['Er_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Er': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6098,"['mp-1006980', 'mp-1000513', 'mp-6098', 'mp-1441533', 'mp-1700042', 'mp-1793903', 'mp-1011723', 'mp-1589040']",0.0020747,"{'Er': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",64.35860973581151,[],NM,False,139,0,"[0.0, -0.0, -0.0, 0.0, 0.0, 0.0]",3.2236557136900987e-05,0.0020747,0,0.0020747,MP,data/source/MP/cleaned/cifs/MP-mp-6098.cif,True,,data/final/MP/graphs/B2C1Co0.1Er1Ni1.9-MP-mp-6098-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Nd0.97Ni1Sr0.03O3,2,0.012,4.0,False,Nd3.88Ni4Sr0.12O12,Nd4Ni4O12,0.0,Oxide,True,Nd19.4Ni20Sr0.6O60,Nd-Ni-Sr-O,4,Supercon,Nd0.97Sr0.03Ni1O3,MP-mp-22106,Nd4Ni4O12,Nd-Ni-O,Nd20Ni20O60,P n m a,orthorhombic,5.431762,5.495849,7.709429,data/final/MP/cifs/Nd0.97Ni1Sr0.03O3-MP-mp-22106-synth_doped.cif,data/source/MP/raw/cifs/mp-22106.cif,mp-22106,0.0,,2014-02-19 13:18:08,7.242194237367626,,,{'GGA+U': {'task_id': 'mp-1701351'}},0.0,3.99854667,520.0,-131.66600273,-6.5833001365,"{'tags': ['Neodymium nickel(III) oxide', 'Dineodymium niccolate', 'Neodymium niccolate', 'Neodymium nickel oxide', 'Neodymium niccolate(III)']}",-131.66600273,-6.5833001365,-2.425267555500001,"['xas', 'bandstructure']",True,"[155746, 67725, 164825, 67724, 416213, 78319, 164562, 155747, 67723, 69788, 155748, 67722, 24875, 416212]",True,2021-05-12 10:57:01.079000,FM,20,11,mp-22106,oxide,NdNiO3,"{'functional': 'PBE', 'labels': ['Nd_3', 'Ni_pv', 'O'], 'pot_type': 'paw'}","{'Nd': 1.0, 'Ni': 1.0, 'O': 3.0}",GGA+U,mp-22106,"['mp-919926', 'mp-918860', 'mp-905914', 'mp-602303', 'mp-25591', 'mp-1189695', 'mp-22106', 'mp-1416651', 'mp-1701351', 'mp-1930748', 'mp-1599871']",1.00005245,"{'Nd': 4.0, 'Ni': 4.0, 'O': 12.0}",230.14298278419733,[],FM,True,62,1,"[0.0, 0.0, 0.0, 0.0, 1.4, 1.4, 1.4, 1.4, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0173814111193255,1.00005245,4,4.0002098,MP,data/source/MP/cleaned/cifs/MP-mp-22106.cif,True,,data/final/MP/graphs/Nd0.97Ni1Sr0.03O3-MP-mp-22106-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Nd0.98Ni1Sr0.02O3,2,0.008,4.0,False,Nd3.92Ni4Sr0.08O12,Nd4Ni4O12,0.0,Oxide,True,Nd19.6Ni20Sr0.4O60,Nd-Ni-Sr-O,4,Supercon,Nd0.98Sr0.02Ni1O3,MP-mp-22106,Nd4Ni4O12,Nd-Ni-O,Nd20Ni20O60,P n m a,orthorhombic,5.431762,5.495849,7.709429,data/final/MP/cifs/Nd0.98Ni1Sr0.02O3-MP-mp-22106-synth_doped.cif,data/source/MP/raw/cifs/mp-22106.cif,mp-22106,0.0,,2014-02-19 13:18:08,7.242194237367626,,,{'GGA+U': {'task_id': 'mp-1701351'}},0.0,3.99854667,520.0,-131.66600273,-6.5833001365,"{'tags': ['Neodymium nickel(III) oxide', 'Dineodymium niccolate', 'Neodymium niccolate', 'Neodymium nickel oxide', 'Neodymium niccolate(III)']}",-131.66600273,-6.5833001365,-2.425267555500001,"['xas', 'bandstructure']",True,"[155746, 67725, 164825, 67724, 416213, 78319, 164562, 155747, 67723, 69788, 155748, 67722, 24875, 416212]",True,2021-05-12 10:57:01.079000,FM,20,11,mp-22106,oxide,NdNiO3,"{'functional': 'PBE', 'labels': ['Nd_3', 'Ni_pv', 'O'], 'pot_type': 'paw'}","{'Nd': 1.0, 'Ni': 1.0, 'O': 3.0}",GGA+U,mp-22106,"['mp-919926', 'mp-918860', 'mp-905914', 'mp-602303', 'mp-25591', 'mp-1189695', 'mp-22106', 'mp-1416651', 'mp-1701351', 'mp-1930748', 'mp-1599871']",1.00005245,"{'Nd': 4.0, 'Ni': 4.0, 'O': 12.0}",230.14298278419733,[],FM,True,62,1,"[0.0, 0.0, 0.0, 0.0, 1.4, 1.4, 1.4, 1.4, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0173814111193255,1.00005245,4,4.0002098,MP,data/source/MP/cleaned/cifs/MP-mp-22106.cif,True,,data/final/MP/graphs/Nd0.98Ni1Sr0.02O3-MP-mp-22106-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Er1,1,0.0,3.0,False,Er3,Er3,0.0,Other,True,Er100,Er,1,Supercon,Er1,MP-mp-1184115,Er3,Er,Er100,R -3 m,trigonal,3.53517716007418,3.53517716007418,8.7592653,data/final/MP/cifs/Er1-MP-mp-1184115.cif,data/source/MP/raw/cifs/mp-1184115.cif,mp-1184115,0.0,,2019-01-11 12:32:38.944000,9.037772387254838,,,{'GGA': {'task_id': 'mp-1764951'}},0.0,3.02597036,520.0,-13.70315643,-4.56771881,{'tags': []},-13.70315643,-4.56771881,0.0,['bandstructure'],True,[],True,2021-05-12 10:58:27.755000,NM,3,5,mp-1184115,,Er,"{'functional': 'PBE', 'labels': ['Er_3'], 'pot_type': 'paw'}",{'Er': 1.0},GGA,mp-1184115,"['mp-1184115', 'mp-1444808', 'mp-1764951', 'mp-1797205', 'mp-1585416']",0.0027394333333333,{'Er': 3.0},92.19310638939793,[],NM,False,166,0,"[-0.0, 0.0, 0.0]",8.91422398252663e-05,0.0027394333333333,0,0.0082183,MP,data/source/MP/cleaned/cifs/MP-mp-1184115.cif,False,,data/final/MP/graphs/Er1-MP-mp-1184115.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ga6Ho1,1,0.0,2.0,False,Ga12Ho2,Ga12Ho2,0.0,Other,True,Ga85.714Ho14.286,Ga-Ho,2,Supercon,Ga6Ho1,MP-mp-1103872,Ho2Ga12,Ga-Ho,Ga85.714Ho14.286,P 4/n b m,tetragonal,6.024667,6.024667,7.586315,data/final/MP/cifs/Ga6Ho1-MP-mp-1103872.cif,data/source/MP/raw/cifs/mp-1103872.cif,mp-1103872,0.0,,2018-07-18 19:49:57,7.034779924915351,,,{'GGA': {'task_id': 'mp-1673915'}},0.010692343214286,3.72471112,520.0,-49.61248927,-3.5437492335714285,{'tags': ['Holmium gallide (1/6)']},-49.61248927,-3.5437492335714285,-0.2936085185714278,['bandstructure'],True,"[634367, 634372, 634365]",True,2021-05-12 10:58:20.361000,NM,14,6,mp-1103872,,HoGa6,"{'functional': 'PBE', 'labels': ['Ho_3', 'Ga_d'], 'pot_type': 'paw'}","{'Ho': 1.0, 'Ga': 6.0}",GGA,mp-1103872,"['mp-1103872', 'mp-1103981', 'mp-1105035', 'mp-1423099', 'mp-1673915', 'mp-1597535']",8.715e-05,"{'Ho': 2.0, 'Ga': 12.0}",275.3575355612292,[],NM,False,125,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.329952061952641e-07,8.715e-05,0,0.0001743,MP,data/source/MP/cleaned/cifs/MP-mp-1103872.cif,False,,data/final/MP/graphs/Ga6Ho1-MP-mp-1103872.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Rh0.85Si1.15Th1,3,0.0999999999999999,2.0,False,Rh1.7Si2.3Th2,Rh2Si2Th2,5.48,Other,True,Rh28.333Si38.333Th33.333,Rh-Si-Th,3,Supercon,Th1Rh0.85Si1.15,MP-mp-1206329,Th2Si2Rh2,Rh-Si-Th,Rh33.333Si33.333Th33.333,I 41 m d,tetragonal,4.160111999093129,4.160111999093129,7.80458876,data/final/MP/cifs/Rh0.85Si1.15Th1-MP-mp-1206329-synth_doped.cif,data/source/MP/raw/cifs/mp-1206329.cif,mp-1206329,0.0,,2019-01-12 09:39:44.927000,9.636795300196392,,,{'GGA': {'task_id': 'mp-1760823'}},0.0,7.54938841,520.0,-46.36075947,-7.726793245,"{'tags': ['ThRhSi', 'LaPtSi']}",-46.36075947,-7.726793245,-0.9922998649999996,['bandstructure'],True,[],True,2021-05-12 10:58:37.524000,NM,6,5,mp-1206329,,ThSiRh,"{'functional': 'PBE', 'labels': ['Th', 'Si', 'Rh_pv'], 'pot_type': 'paw'}","{'Th': 1.0, 'Si': 1.0, 'Rh': 1.0}",GGA,mp-1206329,"['mp-1206329', 'mp-1444802', 'mp-1760823', 'mp-1805474', 'mp-1624907']",6.5e-06,"{'Th': 2.0, 'Si': 2.0, 'Rh': 2.0}",125.1087976163176,[],NM,False,109,0,"[0, 0, 0, 0, 0, 0]",1.0390955910125737e-07,6.5e-06,0,1.3e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1206329.cif,True,,data/final/MP/graphs/Rh0.85Si1.15Th1-MP-mp-1206329-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,0,0,1,0,1.0,False
Cu1Nd0.09Sr0.91O1.98,2,0.0477386934673366,1.0,True,Cu1Nd0.09Sr0.91O1.98,Cu1Sr1O2,0.0,Cuprate,True,Cu25.126Nd2.261Sr22.864O49.74874371859297,Cu-Nd-Sr-O,4,Supercon,Sr0.91Nd0.09Cu1O1.98,MP-mp-37514,Sr1Cu1O2,Cu-Sr-O,Cu25Sr25O50,P 4/m m m,tetragonal,3.484968,3.947813,3.947813,data/final/MP/cifs/Cu1Nd0.09Sr0.91O1.98-MP-mp-37514-synth_doped.cif,data/source/MP/raw/cifs/mp-37514.cif,mp-37514,0.0,,2014-02-19 09:18:09,5.599885836861445,10.17188/1207376,"@misc{osti_1207376,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SrCuO2 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207376"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1731754'}},0.0140859162499999,3.30951965,520.0,-22.56552868,-5.64138217,{'tags': []},-22.56552868,-5.64138217,-2.0637266366666664,"['xas', 'elasticity', 'bandstructure']",True,[],True,2021-05-12 10:56:20.740000,NM,4,6,mp-37514,oxide,SrCuO2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Cu': 1.0, 'O': 2.0}",GGA,mp-37514,"['mp-37514', 'mp-1141686', 'mp-1443464', 'mp-1731754', 'mp-1794901', 'mp-1613121']",0.0002664,"{'Sr': 1.0, 'Cu': 1.0, 'O': 2.0}",54.31401905086751,[],NM,False,123,0,"[0, 0, 0, 0]",4.904811035075576e-06,0.0002664,0,0.0002664,MP,data/source/MP/cleaned/cifs/MP-mp-37514.cif,True,,data/final/MP/graphs/Cu1Nd0.09Sr0.91O1.98-MP-mp-37514-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Si5Zr6,3,0.0909090909090909,0.6666333333333334,False,Si3.333Zr4,Si4Zr4,0.0,Other,True,Si45.455Zr54.545,Si-Zr,2,Supercon,Si5Zr6,MP-mp-893,Zr4Si4,Si-Zr,Si50Zr50,P n m a,orthorhombic,3.803331,5.328118,7.030146,data/final/MP/cifs/Si5Zr6-MP-mp-893-synth_doped.cif,data/source/MP/raw/cifs/mp-893.cif,mp-893,0.0,,2011-05-13 11:07:54,5.5626509889834965,10.17188/1312835,"@misc{osti_1312835,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrSi (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1312835"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698212'}},0.0,6.90800899,520.0,-63.35876587,-7.91984573375,"{'tags': ['Zirconium silicide', 'Zirconium silicide (1/1)']}",-63.35876587,-7.91984573375,-0.8978384087500002,"['xas', 'elasticity', 'bandstructure']",True,"[652609, 16771, 652613, 43245]",True,2021-05-12 10:56:33.121000,NM,8,10,mp-893,,ZrSi,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Si'], 'pot_type': 'paw'}","{'Zr': 1.0, 'Si': 1.0}",GGA,mp-893,"['mp-912244', 'mp-928807', 'mp-928271', 'mp-893', 'mp-1125250', 'mp-1138328', 'mp-1431730', 'mp-1698212', 'mp-1780493', 'mp-1588280']",0.0008038,"{'Zr': 4.0, 'Si': 4.0}",142.46307104930645,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0]",2.256865569665573e-05,0.0008038,0,0.0032152,MP,data/source/MP/cleaned/cifs/MP-mp-893.cif,True,,data/final/MP/graphs/Si5Zr6-MP-mp-893-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
C1.35Y1,3,0.051063829787234,8.0,False,C10.8Y8,C12Y8,10.0,Other,True,C57.447Y42.553,C-Y,2,Supercon,C1.35Y1,MP-mp-1695,Y8C12,C-Y,C60Y40,I -4 3 d,cubic,7.157130121586623,7.15713012,7.157130119999999,data/final/MP/cifs/C1.35Y1-MP-mp-1695-synth_doped.cif,data/source/MP/raw/cifs/mp-1695.cif,mp-1695,0.0,,2011-05-15 19:04:09,5.032814278610675,10.17188/1192250,"@misc{osti_1192250,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Y2C3 (SG:220) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1192250"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1669276'}},0.0442951846600028,5.37066524,520.0,-167.58612106,-8.379306053,{'tags': ['Yttrium carbide (2/3)']},-167.58612106,-8.379306053,-0.256649187666666,"['xas', 'elasticity', 'bandstructure']",True,"[155382, 77572, 619114, 601153, 155383]",True,2021-05-12 10:56:14.760000,NM,20,8,mp-1695,,Y2C3,"{'functional': 'PBE', 'labels': ['Y_sv', 'C'], 'pot_type': 'paw'}","{'Y': 2.0, 'C': 3.0}",GGA,mp-1695,"['mp-927691', 'mp-927238', 'mp-911194', 'mp-1695', 'mp-1425550', 'mp-1669276', 'mp-1872240', 'mp-1598231']",0.0001762,"{'Y': 8.0, 'C': 12.0}",282.22458798795367,[],NM,False,220,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.497301900676646e-06,0.0001762,0,0.0007048,MP,data/source/MP/cleaned/cifs/MP-mp-1695.cif,True,,data/final/MP/graphs/C1.35Y1-MP-mp-1695-synth_doped.json,0,True,-43m,5,0,0,0,0,0,0,0,0,1,0,1.0,False
La1Ni0.9Pt0.1Si1,3,0.0666666666666666,2.0,False,La2Ni1.8Pt0.2Si2,La2Ni2Si2,1.275,Other,True,La33.333Ni30Pt3.333Si33.333,La-Ni-Pt-Si,4,Supercon,La1Pt0.1Ni0.9Si1,MP-mp-7030,La2Si2Ni2,La-Ni-Si,La33.333Ni33.333Si33.333,I 41 m d,tetragonal,4.181653997985801,4.181653997985801,7.60797294,data/final/MP/cifs/La1Ni0.9Pt0.1Si1-MP-mp-7030-synth_doped.cif,data/source/MP/raw/cifs/mp-7030.cif,mp-7030,0.0,,2011-05-28 11:56:29,6.11469839556342,10.17188/1285593,"@misc{osti_1285593,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaSiNi (SG:109) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1285593"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699194'}},0.0,8.03760791,520.0,-36.63393333,-6.105655554999999,{'tags': ['Lanthanum nickel silicide (1/1/1)']},-36.63393333,-6.105655554999999,-0.7015029533333319,['bandstructure'],True,[78264],True,2021-05-12 10:58:53.520000,NM,6,9,mp-7030,,LaSiNi,"{'functional': 'PBE', 'labels': ['La', 'Si', 'Ni_pv'], 'pot_type': 'paw'}","{'La': 1.0, 'Si': 1.0, 'Ni': 1.0}",GGA,mp-7030,"['mp-923783', 'mp-908804', 'mp-924370', 'mp-7030', 'mp-1156285', 'mp-1433627', 'mp-1699194', 'mp-1803860', 'mp-1586401']",4.03e-05,"{'La': 2.0, 'Si': 2.0, 'Ni': 2.0}",122.57602545954455,[],NM,False,109,0,"[0, 0, 0, 0, 0, 0]",6.575510969443329e-07,4.03e-05,0,8.06e-05,MP,data/source/MP/cleaned/cifs/MP-mp-7030.cif,True,,data/final/MP/graphs/La1Ni0.9Pt0.1Si1-MP-mp-7030-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,0,0,1,0,1.0,False
Cr0.7Rh0.3,3,0.1,8.0,False,Cr5.6Rh2.4,Cr6Rh2,1.1,Other,True,Cr70Rh30,Cr-Rh,2,Supercon,Cr0.7Rh0.3,MP-mp-958,Cr6Rh2,Cr-Rh,Cr75Rh25,P m -3 n,cubic,4.63773,4.63773,4.63773,data/final/MP/cifs/Cr0.7Rh0.3-MP-mp-958-synth_doped.cif,data/source/MP/raw/cifs/mp-958.cif,mp-958,0.0,,2011-05-14 15:38:07,8.61954536112071,10.17188/1313350,"@misc{osti_1313350,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Cr3Rh (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1313350"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697049'}},0.113421036666665,6.94723457,520.0,-72.02893318,-9.0036166475,{'tags': ['Chromium rhodium (3/1)']},-72.02893318,-9.0036166475,0.0772459225000012,"['xas', 'bandstructure']",True,"[626569, 626570]",True,2021-05-12 10:57:55.580000,FM,8,8,mp-958,,Cr3Rh,"{'functional': 'PBE', 'labels': ['Cr_pv', 'Rh_pv'], 'pot_type': 'paw'}","{'Cr': 3.0, 'Rh': 1.0}",GGA,mp-958,"['mp-958', 'mp-944403', 'mp-943758', 'mp-933553', 'mp-1429787', 'mp-1697049', 'mp-1797860', 'mp-1588324']",0.69366955,"{'Cr': 6.0, 'Rh': 2.0}",99.75079914067096,[],FM,True,223,1,"[0.2, 0.2, 0.2, 0.2, 0.2, 0.2, 0.0, 0.0]",0.0139080499800662,0.69366955,6,1.3873391,MP,data/source/MP/cleaned/cifs/MP-mp-958.cif,True,,data/final/MP/graphs/Cr0.7Rh0.3-MP-mp-958-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Mo0.18Tc0.82,3,0.1399999999999999,4.0,False,Mo0.72Tc3.28,Mo1Tc3,13.7,Other,True,Mo18Tc82,Mo-Tc,2,Supercon,Mo0.18Tc0.82,MP-mp-1187395,Tc3Mo1,Mo-Tc,Mo25Tc75,P m -3 m,cubic,3.914319,3.914319,3.914319,data/final/MP/cifs/Mo0.18Tc0.82-MP-mp-1187395-synth_doped.cif,data/source/MP/raw/cifs/mp-1187395.cif,mp-1187395,0.0,,2019-01-11 15:03:16.119000,10.796381868720824,,,{'GGA': {'task_id': 'mp-1733975'}},0.1169263725,8.23961456,520.0,-41.45979727,-10.3649493175,{'tags': []},-41.45979727,-10.3649493175,0.1169263725,['bandstructure'],True,[],True,2021-05-12 10:58:31.620000,NM,4,5,mp-1187395,,Tc3Mo,"{'functional': 'PBE', 'labels': ['Tc_pv', 'Mo_pv'], 'pot_type': 'paw'}","{'Tc': 3.0, 'Mo': 1.0}",GGA,mp-1187395,"['mp-1187395', 'mp-1436691', 'mp-1733975', 'mp-1793356', 'mp-1584941']",0.0069778,"{'Tc': 3.0, 'Mo': 1.0}",59.97477780088212,[],NM,False,221,0,"[0.0, 0.0, 0.0, -0.0]",0.0001163455748542,0.0069778,0,0.0069778,MP,data/source/MP/cleaned/cifs/MP-mp-1187395.cif,True,,data/final/MP/graphs/Mo0.18Tc0.82-MP-mp-1187395-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Rb0.19W1O3,3,0.0631540297411419,3.0,False,Rb0.57W3O9,Rb1W3O9,5.5,Oxide,True,Rb4.535W23.866O71.59904534606207,Rb-W-O,3,Supercon,Rb0.19W1O3,MP-mp-565431,Rb1W3O9,Rb-W-O,Rb7.692W23.077O69.23076923076923,P 6/m m m,hexagonal,3.882989,7.530094003231798,7.530093400000001,data/final/MP/cifs/Rb0.19W1O3-MP-mp-565431-synth_doped.cif,data/source/MP/raw/cifs/mp-565431.cif,mp-565431,0.0,,2014-02-23 19:51:49,6.801313653620402,10.17188/1272509,"@misc{osti_1272509,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Rb(WO3)3 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1272509"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-1672885'}},0.0038003846153671,3.17423124,520.0,-93.98226341,-7.229404877692308,{'tags': ['Rubidium tungsten oxide (0.33/1/3)']},-93.98226341,-7.229404877692308,-2.2379000678846164,"['xas', 'bandstructure']",True,[96419],True,2021-05-12 10:57:23.123000,FM,13,15,mp-565431,oxide,Rb(WO3)3,"{'functional': 'PBE', 'labels': ['Rb_sv', 'W_pv', 'O'], 'pot_type': 'paw'}","{'Rb': 1.0, 'W': 3.0, 'O': 9.0}",GGA+U,mp-565431,"['mp-704837', 'mp-932684', 'mp-940813', 'mp-940952', 'mp-565431', 'mp-1179797', 'mp-1192870', 'mp-1414087', 'mp-1427299', 'mp-1672885', 'mp-1670084', 'mp-1833003', 'mp-1609186', 'mp-1605159', 'mp-1984777']",0.8587592,"{'Rb': 1.0, 'W': 3.0, 'O': 9.0}",190.6766621234564,[],FM,True,65,1,"[0.0, 0.4, 0.4, 0.3, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0045037457150575,0.8587592,3,0.8587592,MP,data/source/MP/cleaned/cifs/MP-mp-565431.cif,True,,data/final/MP/graphs/Rb0.19W1O3-MP-mp-565431-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Co1P3,1,0.0,4.0,False,Co4P12,Co4P12,0.0,Other,True,Co25P75,Co-P,2,Supercon,Co1P3,MP-mp-1944,Co4P12,Co-P,Co25P75,I m -3,cubic,6.686580411482311,6.68658041,6.68658041,data/final/MP/cifs/Co1P3-MP-mp-1944.cif,data/source/MP/raw/cifs/mp-1944.cif,mp-1944,0.0,,2011-05-14 11:42:47,4.382746750446,10.17188/1194452,"@misc{osti_1194452,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CoP3 (SG:204) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1194452"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704930'}},0.0,8.30298262,520.0,-101.35062912,-6.33441432,{'tags': ['Cobalt phosphide (1/3)']},-101.35062912,-6.33441432,-0.4973579912499994,"['xas', 'elasticity', 'bandstructure']",True,"[624594, 23711, 92393, 604454]",True,2021-05-12 10:56:14.760000,NM,16,6,mp-1944,,CoP3,"{'functional': 'PBE', 'labels': ['Co', 'P'], 'pot_type': 'paw'}","{'Co': 1.0, 'P': 3.0}",GGA,mp-1944,"['mp-1944', 'mp-1141618', 'mp-1417524', 'mp-1704930', 'mp-1774465', 'mp-1603816']",0.007753675,"{'Co': 4.0, 'P': 12.0}",230.1390543390233,[],NM,False,204,0,"[-0.0, -0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.000134765044938,0.007753675,0,0.0310147,MP,data/source/MP/cleaned/cifs/MP-mp-1944.cif,False,,data/final/MP/graphs/Co1P3-MP-mp-1944.json,0,True,m-3,2,0,0,0,0,0,0,0,0,1,0,1.0,False
Mo3Si1,1,0.0,2.0,False,Mo6Si2,Mo6Si2,1.402,Other,True,Mo75Si25,Mo-Si,2,Supercon,Mo3Si1,MP-mp-1275,Si2Mo6,Mo-Si,Mo75Si25,P m -3 n,cubic,4.91941,4.91941,4.91941,data/final/MP/cifs/Mo3Si1-MP-mp-1275.cif,data/source/MP/raw/cifs/mp-1275.cif,mp-1275,0.0,,2011-05-13 22:36:52,8.812461272463066,10.17188/1189161,"@misc{osti_1189161,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SiMo3 (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189161"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687594'}},0.0,9.39010762,520.0,-78.44059285,-9.80507410625,"{'tags': ['Molydenum silicide (3/1)', 'Molybdenum silicon (3/1)', 'Molybdenum silicide (3/1)']}",-78.44059285,-9.80507410625,-0.3145133287499995,"['xas', 'elasticity', 'bandstructure']",True,"[644409, 644415, 644414, 644398, 35755, 644417, 644408, 644402, 30640]",True,2021-05-12 10:56:12.755000,NM,8,11,mp-1275,,SiMo3,"{'functional': 'PBE', 'labels': ['Si', 'Mo_pv'], 'pot_type': 'paw'}","{'Si': 1.0, 'Mo': 3.0}",GGA,mp-1275,"['mp-907385', 'mp-920787', 'mp-921824', 'mp-1275', 'mp-1125217', 'mp-1132596', 'mp-1261496', 'mp-1439549', 'mp-1687594', 'mp-1802687', 'mp-1594554']",0.0020449,"{'Si': 2.0, 'Mo': 6.0}",119.05264780975064,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",3.435286887978848e-05,0.0020449,0,0.0040898,MP,data/source/MP/cleaned/cifs/MP-mp-1275.cif,False,,data/final/MP/graphs/Mo3Si1-MP-mp-1275.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Al1Nb2.895W0.105,3,0.0524999999999999,2.0,False,Al2Nb5.79W0.21,Al2Nb6,16.0,Other,True,Al25Nb72.375W2.625,Al-Nb-W,3,Supercon,Nb2.895W0.105Al1,MP-mp-796,Nb6Al2,Al-Nb,Al25Nb75,P m -3 n,cubic,5.215254,5.215254,5.215254,data/final/MP/cifs/Al1Nb2.895W0.105-MP-mp-796-synth_doped.cif,data/source/MP/raw/cifs/mp-796.cif,mp-796,0.0,,2011-05-13 16:07:37,7.157298025966356,,,{'GGA': {'task_id': 'mp-1686893'}},0.0460773865000003,5.52947534,520.0,-69.48918494,-8.6861481175,"{'tags': ['Aluminium niobium (1/3)', 'Niobium aluminide (3/1)', 'Aluminum niobium (1/3)']}",-69.48918494,-8.6861481175,-0.1737753800000003,"['bandstructure', 'elasticity']",True,"[608675, 608654, 608688, 608668, 608669, 608685, 608676, 608683, 58014, 608657, 107856, 608655, 608666, 608691, 608656, 608665, 608673, 608653, 608661]",True,2021-05-12 10:56:31.128000,NM,8,10,mp-796,,Nb3Al,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Al': 1.0}",GGA,mp-796,"['mp-911586', 'mp-927906', 'mp-796', 'mp-927472', 'mp-1260512', 'mp-1440919', 'mp-1686893', 'mp-1927652', 'mp-1591599', 'mp-1587739']",0.16323955,"{'Nb': 6.0, 'Al': 2.0}",141.8490379078192,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0023015954483396,0.16323955,0,0.3264791,MP,data/source/MP/cleaned/cifs/MP-mp-796.cif,True,,data/final/MP/graphs/Al1Nb2.895W0.105-MP-mp-796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Cu3La0.7Pr0.3O7,3,0.0461538461538461,1.0,True,Ba2Cu3La0.7Pr0.3O7,Ba2Cu3La1O7,57.1,Cuprate,True,Ba15.385Cu23.077La5.385Pr2.308O53.84615384615385,Ba-Cu-La-Pr-O,5,Supercon,La0.7Pr0.3Ba2Cu3O7,MP-mp-622210,Ba2La1Cu3O7,Ba-Cu-La-O,Ba15.385Cu23.077La7.692O53.84615384615385,P m m m,orthorhombic,3.912033,3.978575,11.900925,data/final/MP/cifs/Ba2Cu3La0.7Pr0.3O7-MP-mp-622210-synth_doped.cif,data/source/MP/raw/cifs/mp-622210.cif,mp-622210,0.0,,2014-02-16 07:47:08,6.420495647479224,10.17188/1278110,"@misc{osti_1278110,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2LaCu3O7 (SG:47) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278110"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1676618'}},0.0206010060576886,3.9422618,520.0,-79.09444788,-6.084188298461539,{'tags': ['Lanthanum dibarium tricopper heptaoxide']},-79.09444788,-6.084188298461539,-2.1689347746153844,['bandstructure'],True,[81167],True,2021-05-12 10:58:51.532000,NM,13,10,mp-622210,oxide,Ba2LaCu3O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'La': 1.0, 'Cu': 3.0, 'O': 7.0}",GGA,mp-622210,"['mp-932742', 'mp-931665', 'mp-916330', 'mp-622210', 'mp-1228591', 'mp-1236979', 'mp-1381031', 'mp-1676618', 'mp-1832760', 'mp-1598015']",6.1e-06,"{'Ba': 2.0, 'La': 1.0, 'Cu': 3.0, 'O': 7.0}",185.22976563934355,[],NM,False,47,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.293207211565103e-08,6.1e-06,0,6.1e-06,MP,data/source/MP/cleaned/cifs/MP-mp-622210.cif,True,,data/final/MP/graphs/Ba2Cu3La0.7Pr0.3O7-MP-mp-622210-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ca0.3Cu1La1Sr0.7Tl1O5,3,0.0666666666666666,1.0,True,Ca0.3Cu1La1Sr0.7Tl1O5,Cu1La1Sr1Tl1O5,32.0,Cuprate,True,Ca3.333Cu11.111La11.111Sr7.778Tl11.111O55.55555555555556,Ca-Cu-La-Sr-Tl-O,6,Supercon,Tl1Sr0.7Ca0.3La1Cu1O5,MP-mp-1218170,Sr1La1Tl1Cu1O5,Cu-La-Sr-Tl-O,Cu11.111La11.111Sr11.111Tl11.111O55.55555555555556,P 4 m m,tetragonal,3.808314,3.808314,8.940218,data/final/MP/cifs/Ca0.3Cu1La1Sr0.7Tl1O5-MP-mp-1218170-synth_doped.cif,data/source/MP/raw/cifs/mp-1218170.cif,mp-1218170,0.0,,2019-01-12 19:23:00.047000,7.356801903811997,,,{'GGA': {'task_id': 'mp-1751231'}},0.0235770105555133,5.93274247,520.0,-55.01092809,-6.1123253433333335,{'tags': []},-55.01092809,-6.1123253433333335,-2.2909747433333343,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,9,5,mp-1218170,oxide,SrLaTlCuO5,"{'functional': 'PBE', 'labels': ['Sr_sv', 'La', 'Tl_d', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 1.0, 'La': 1.0, 'Tl': 1.0, 'Cu': 1.0, 'O': 5.0}",GGA,mp-1218170,"['mp-1218170', 'mp-1444406', 'mp-1751231', 'mp-1787322', 'mp-1618863']",0.0033628,"{'Sr': 1.0, 'La': 1.0, 'Tl': 1.0, 'Cu': 1.0, 'O': 5.0}",129.66226608171218,[],NM,False,99,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",2.593507040730561e-05,0.0033628,0,0.0033628,MP,data/source/MP/cleaned/cifs/MP-mp-1218170.cif,True,,data/final/MP/graphs/Ca0.3Cu1La1Sr0.7Tl1O5-MP-mp-1218170-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
Ba2Cu4Sc0.2Y0.8O8,3,0.0266666666666666,1.0,True,Ba2Cu4Sc0.2Y0.8O8,Ba2Cu4Y1O8,87.0,Cuprate,True,Ba13.333Cu26.667Sc1.333Y5.333O53.333333333333336,Ba-Cu-Sc-Y-O,5,Supercon,Y0.8Sc0.2Ba2Cu4O8,MP-mp-6790,Ba2Y1Cu4O8,Ba-Cu-Y-O,Ba13.333Cu26.667Y6.667O53.333333333333336,C m m m,orthorhombic,3.889922,3.899603999537882,13.88942687,data/final/MP/cifs/Ba2Cu4Sc0.2Y0.8O8-MP-mp-6790-synth_doped.cif,data/source/MP/raw/cifs/mp-6790.cif,mp-6790,0.0,,2011-05-16 03:21:24,5.936250568336678,10.17188/1283441,"@misc{osti_1283441,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Y(CuO2)4 (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1283441"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686864'}},0.0,3.31391536,520.0,-91.58381472,-6.105587648,"{'tags': ['Yttrium barium copper oxide (1/2/4/8)', 'High pressure experimental phase']}",-91.58381472,-6.105587648,-2.0529924817777783,"['xas', 'bandstructure']",True,"[72261, 85273, 74251, 400273, 85277, 85275, 400280, 67632, 85272, 67631, 83920, 66613, 85279, 400277, 75689, 74259, 85278, 85280, 66603, 94265, 400276, 88873, 71417, 75712, 97052, 66605, 72258, 85281, 85274, 400279, 66604, 69698]",True,2021-05-12 10:57:34.594000,NM,15,10,mp-6790,oxide,Ba2Y(CuO2)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-6790,"['mp-1000664', 'mp-6790', 'mp-1007136', 'mp-1237713', 'mp-1440937', 'mp-1686864', 'mp-1834179', 'mp-1011883', 'mp-1590064', 'mp-1590433']",0.0004643,"{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",208.60454115924333,[],NM,False,65,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.225742533790601e-06,0.0004643,0,0.0004643,MP,data/source/MP/cleaned/cifs/MP-mp-6790.cif,True,,data/final/MP/graphs/Ba2Cu4Sc0.2Y0.8O8-MP-mp-6790-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ir0.85Nb0.15Pt3,3,0.075,1.0,True,Ir0.85Nb0.15Pt3,Ir1Pt3,0.0,Other,True,Ir21.25Nb3.75Pt75,Ir-Nb-Pt,3,Supercon,Nb0.15Ir0.85Pt3,MP-mp-1184759,Ir1Pt3,Ir-Pt,Ir25Pt75,P m -3 m,cubic,3.951253,3.951253,3.951253,data/final/MP/cifs/Ir0.85Nb0.15Pt3-MP-mp-1184759-synth_doped.cif,data/source/MP/raw/cifs/mp-1184759.cif,mp-1184759,0.0,,2019-01-11 13:02:20.956000,20.927996939625864,,,{'GGA': {'task_id': 'mp-1763708'}},0.0814671425000002,7.96891416,520.0,-26.72528498,-6.681321245,{'tags': []},-26.72528498,-6.681321245,0.0814671425000002,['bandstructure'],True,[],True,2021-05-12 10:58:27.755000,NM,4,5,mp-1184759,,IrPt3,"{'functional': 'PBE', 'labels': ['Ir', 'Pt'], 'pot_type': 'paw'}","{'Ir': 1.0, 'Pt': 3.0}",GGA,mp-1184759,"['mp-1184759', 'mp-1432180', 'mp-1763708', 'mp-1781942', 'mp-1613362']",0.2916785,"{'Ir': 1.0, 'Pt': 3.0}",61.68854340407387,[],NM,False,221,0,"[0, 0, 0, 0]",0.004728244239606,0.2916785,0,0.2916785,MP,data/source/MP/cleaned/cifs/MP-mp-1184759.cif,True,,data/final/MP/graphs/Ir0.85Nb0.15Pt3-MP-mp-1184759-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
B2C1Fe0.1Ni1.9Tm1,2,0.0333333333333333,1.0,True,B2C1Fe0.1Ni1.9Tm1,B2C1Ni2Tm1,6.64,Other,True,B33.333C16.667Fe1.667Ni31.667Tm16.667,B-C-Fe-Ni-Tm,5,Supercon,Tm1Ni1.9Fe0.1B2C1,MP-mp-6754,Tm1Ni2B2C1,B-C-Ni-Tm,B33.333C16.667Ni33.333Tm16.667,I 4/m m m,tetragonal,3.4928639994202824,3.492863999420283,5.7937603300000005,data/final/MP/cifs/B2C1Fe0.1Ni1.9Tm1-MP-mp-6754-synth_doped.cif,data/source/MP/raw/cifs/mp-6754.cif,mp-6754,0.0,,2011-05-13 04:35:22,8.309262229712736,10.17188/1282688,"@misc{osti_1282688,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TmNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1282688"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696752'}},0.0,6.71149537,520.0,-41.76249282,-6.96041547,{'tags': []},-41.76249282,-6.96041547,-0.5234699658333332,"['xas', 'elasticity', 'bandstructure']",True,"[79577, 56652, 164574]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-6754,,TmNi2B2C,"{'functional': 'PBE', 'labels': ['Tm_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Tm': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6754,"['mp-6754', 'mp-1000684', 'mp-1007145', 'mp-1412917', 'mp-1696752', 'mp-1790753', 'mp-1011888', 'mp-1590290']",0.0028138,"{'Tm': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",63.94016944835002,[],NM,False,139,0,"[0.0, -0.0, -0.0, 0.0, 0.0, 0.0]",4.40067648283752e-05,0.0028138,0,0.0028138,MP,data/source/MP/cleaned/cifs/MP-mp-6754.cif,True,,data/final/MP/graphs/B2C1Fe0.1Ni1.9Tm1-MP-mp-6754-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Fe1Se0.75Te0.25,1,0.0,4.0,False,Fe4Se3Te1,Fe4Se3Te1,13.3,Ferrite,True,Fe50Se37.5Te12.5,Fe-Se-Te,3,Supercon,Fe1Se0.75Te0.25,MP-mp-1225054,Fe4Te1Se3,Fe-Se-Te,Fe50Se37.5Te12.5,A m m 2,orthorhombic,3.626187,7.275827129999999,7.27582713,data/final/MP/cifs/Fe1Se0.75Te0.25-MP-mp-1225054.cif,data/source/MP/raw/cifs/mp-1225054.cif,mp-1225054,0.0,,2019-01-13 01:13:11.838000,5.819916917038002,,,,0.0575719878124987,4.01309388,520.0,-48.95297599,-6.11912199875,{'tags': []},-48.95297599,-6.11912199875,-0.4099883533789059,[],False,[],True,2021-05-12 11:00:54.298000,FM,8,2,mp-1225054,,Fe4TeSe3,"{'functional': 'PBE', 'labels': ['Fe_pv', 'Te', 'Se'], 'pot_type': 'paw'}","{'Fe': 4.0, 'Te': 1.0, 'Se': 3.0}",GGA,mp-1225054,"['mp-1225054', 'mp-1830180']",6.1508113,"{'Fe': 4.0, 'Te': 1.0, 'Se': 3.0}",167.7282527579941,[],FM,True,38,3,"[1.9, 1.1, 1.5, 1.5, 0.0, 0.0, 0.0, 0.0]",0.0366712894152344,6.1508113,4,6.1508113,MP,data/source/MP/cleaned/cifs/MP-mp-1225054.cif,False,,data/final/MP/graphs/Fe1Se0.75Te0.25-MP-mp-1225054.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
B2Co0.03Mg0.97,2,0.02,1.0,True,B2Co0.03Mg0.97,B2Mg1,36.2,Other,True,B66.667Co1Mg32.333,B-Co-Mg,3,Supercon,Mg0.97Co0.03B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B2Co0.03Mg0.97-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B2Co0.03Mg0.97-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Cu1Hg1O4.097,2,0.0119797455847845,0.976206034903588,True,Ba1.953Cu0.976Hg0.976O4,Ba2Cu1Hg1O4,95.3,Cuprate,True,Ba24.701Cu12.35Hg12.35O50.598987279239225,Ba-Cu-Hg-O,4,Supercon,Hg1Ba2Cu1O4.097,MP-mp-6562,Ba2Cu1Hg1O4,Ba-Cu-Hg-O,Ba25Cu12.5Hg12.5O50,P 4/m m m,tetragonal,3.933714,3.933714,9.827602,data/final/MP/cifs/Ba2Cu1Hg1O4.097-MP-mp-6562-synth_doped.cif,data/source/MP/raw/cifs/mp-6562.cif,mp-6562,0.0,,2011-05-13 18:18:06,6.582036471328142,10.17188/1281336,"@misc{osti_1281336,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2CuHgO4 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281336"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697135'}},0.0234340381250053,2.58068675,520.0,-40.91481298,-5.1143516225,"{'tags': ['Mercury dibarium copper oxide', 'High pressure experimental phase']}",-40.91481298,-5.1143516225,-1.953767533125,"['xas', 'bandstructure']",True,"[75722, 75720, 75724, 75721, 75723]",True,2021-05-12 10:57:32.679000,NM,8,8,mp-6562,oxide,Ba2CuHgO4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Cu_pv', 'Hg', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",GGA,mp-6562,"['mp-6562', 'mp-990899', 'mp-992892', 'mp-1435690', 'mp-1697135', 'mp-1878488', 'mp-994198', 'mp-1592659']",0.0003984,"{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",152.07335344042525,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0, 0, 0]",2.619788352047311e-06,0.0003984,0,0.0003984,MP,data/source/MP/cleaned/cifs/MP-mp-6562.cif,True,,data/final/MP/graphs/Ba2Cu1Hg1O4.097-MP-mp-6562-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
La3Ru1,3,0.0714285714285715,3.333166666666667,False,La10Ru3.333,La10Ru4,4.875,Other,True,La75Ru25,La-Ru,2,Supercon,La3Ru1,MP-mp-1104417,La10Ru4,La-Ru,La71.429Ru28.571,C 1 2/c 1,monoclinic,6.721843997287566,7.35036374,9.10215779,data/final/MP/cifs/La3Ru1-MP-mp-1104417-synth_doped.cif,data/source/MP/raw/cifs/mp-1104417.cif,mp-1104417,0.0,,2018-07-18 21:55:26,7.154635129908844,,,{'GGA': {'task_id': 'mp-1677117'}},0.0,8.04248411,520.0,-90.27680955,-6.448343539285714,"{'tags': ['Lanthanum ruthenium (5/2)', 'Mn5C2', 'La5Ru2']}",-90.27680955,-6.448343539285714,-0.2727985628571424,['bandstructure'],True,"[641780, 641763]",True,2021-05-12 10:58:20.361000,NM,14,6,mp-1104417,,La5Ru2,"{'functional': 'PBE', 'labels': ['La', 'Ru_pv'], 'pot_type': 'paw'}","{'La': 5.0, 'Ru': 2.0}",GGA,mp-1104417,"['mp-1104417', 'mp-1104870', 'mp-1382651', 'mp-1677117', 'mp-1820167', 'mp-1605014']",0.00086855,"{'La': 10.0, 'Ru': 4.0}",416.2200132877121,[],NM,False,15,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0, -0.0, -0.0]",4.173513873777208e-06,0.00086855,0,0.0017371,MP,data/source/MP/cleaned/cifs/MP-mp-1104417.cif,True,,data/final/MP/graphs/La3Ru1-MP-mp-1104417-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
As1Fe0.98Ni0.02Sm1O1,2,0.01,2.0,False,As2Fe1.96Ni0.04Sm2O2,As2Fe2Sm2O2,0.0,Ferrite,True,As25Fe24.5Ni0.5Sm25O25,As-Fe-Ni-Sm-O,5,Supercon,Sm1Fe0.98Ni0.02As1O1,MP-mp-20349,Sm2Fe2As2O2,As-Fe-Sm-O,As25Fe25Sm25O25,P 4/n m m,tetragonal,4.026492,4.026492,9.046755,data/final/MP/cifs/As1Fe0.98Ni0.02Sm1O1-MP-mp-20349-synth_doped.cif,data/source/MP/raw/cifs/mp-20349.cif,mp-20349,0.0,,2014-02-19 11:24:42,6.727802583283198,,,{'GGA+U': {'task_id': 'mp-1695938'}},0.3015723809374986,3.77685593,520.0,-52.73407138,-6.5917589225,{'tags': ['Samarium iron arsenic oxide (1/1/1/1)']},-52.73407138,-6.5917589225,-1.6285904237499995,"['xas', 'elasticity', 'bandstructure']",True,"[236652, 236653, 422002, 163457, 163458]",True,2021-05-12 10:56:16.728000,FM,8,10,mp-20349,oxide,SmFeAsO,"{'functional': 'PBE', 'labels': ['Sm_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Sm': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-20349,"['mp-24944', 'mp-1078897', 'mp-1079866', 'mp-1173321', 'mp-20349', 'mp-1425472', 'mp-1695938', 'mp-1772503', 'mp-1789694', 'mp-1588381']",3.75729895,"{'Sm': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",146.67176231613362,[],FM,True,129,1,"[0.0, 0.0, 3.5, 3.5, -0.0, -0.0, -0.0, -0.0]",0.0512341147425717,3.75729895,2,7.5145979,MP,data/source/MP/cleaned/cifs/MP-mp-20349.cif,True,,data/final/MP/graphs/As1Fe0.98Ni0.02Sm1O1-MP-mp-20349-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B2V1,1,0.0,1.0,True,B2V1,B2V1,0.0,Other,True,B66.667V33.333,B-V,2,Supercon,B2V1,MP-mp-1491,V1B2,B-V,B66.667V33.333,P 6/m m m,hexagonal,2.998219998091496,2.9982202700000005,3.029774,data/final/MP/cifs/B2V1-MP-mp-1491.cif,data/source/MP/raw/cifs/mp-1491.cif,mp-1491,0.0,,2011-05-12 18:01:58,5.108570690305548,10.17188/1190962,"@misc{osti_1190962,
    author = ""Persson, Kristin"",
    title = ""Materials Data on VB2 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1190962"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686792'}},0.0,8.9240768,520.0,-24.65921071,-8.219736903333333,"{'tags': ['Vanadium boride (1/2)', 'High pressure experimental phase']}",-24.65921071,-8.219736903333333,-0.7388403661111115,"['xas', 'elasticity', 'bandstructure']",True,"[193834, 615666, 165125, 167798, 615667, 167792, 615674, 615657, 30417, 30331, 167793, 167797, 167796, 167794, 615663, 167795, 615678]",True,2021-05-12 10:56:12.755000,NM,3,13,mp-1491,,VB2,"{'functional': 'PBE', 'labels': ['V_pv', 'B'], 'pot_type': 'paw'}","{'V': 1.0, 'B': 2.0}",GGA,mp-1491,"['mp-1000554', 'mp-1007023', 'mp-1491', 'mp-1061673', 'mp-1061725', 'mp-1061628', 'mp-1441029', 'mp-1686792', 'mp-1805654', 'mp-1011764', 'mp-1588115', 'mp-1594078', 'mp-1061699']",0.0028625,"{'V': 1.0, 'B': 2.0}",23.5867395919351,[],NM,False,191,0,"[0.0, 0.0, 0.0]",0.0001213605631606,0.0028625,0,0.0028625,MP,data/source/MP/cleaned/cifs/MP-mp-1491.cif,False,,data/final/MP/graphs/B2V1-MP-mp-1491.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
B6Gd1,1,0.0,1.0,True,B6Gd1,B6Gd1,0.0,Other,True,B85.714Gd14.286,B-Gd,2,Supercon,B6Gd1,MP-mp-22266,Gd1B6,B-Gd,B85.714Gd14.286,P m -3 m,cubic,4.110279,4.110279,4.110279,data/final/MP/cifs/B6Gd1-MP-mp-22266.cif,data/source/MP/raw/cifs/mp-22266.cif,mp-22266,0.0,,2014-02-21 07:40:34,5.3114736922575725,10.17188/1197492,"@misc{osti_1197492,
    author = ""Persson, Kristin"",
    title = ""Materials Data on GdB6 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197492"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688023'}},0.0,6.25217395,520.0,-57.34881311,-8.192687587142858,"{'tags': ['Gadolinium boride (1/6)', 'Gadolinium octahedro-hexaboride']}",-57.34881311,-8.192687587142858,-0.4566200349999992,"['xas', 'elasticity', 'bandstructure']",True,"[602750, 76125, 614326, 614311, 614319, 614323, 659489, 614305, 614329]",True,2021-05-12 10:56:16.728000,FM,7,8,mp-22266,,GdB6,"{'functional': 'PBE', 'labels': ['Gd', 'B'], 'pot_type': 'paw'}","{'Gd': 1.0, 'B': 6.0}",GGA,mp-22266,"['mp-943004', 'mp-942583', 'mp-921193', 'mp-22266', 'mp-1440212', 'mp-1688023', 'mp-1799453', 'mp-1587822']",6.7622563,"{'Gd': 1.0, 'B': 6.0}",69.44067064750126,[],FM,True,221,1,"[6.8, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0973817827066641,6.7622563,1,6.7622563,MP,data/source/MP/cleaned/cifs/MP-mp-22266.cif,False,,data/final/MP/graphs/B6Gd1-MP-mp-22266.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Cu3Pb2Pr1Sr2O8,1,0.0,1.0,True,Cu3Pb2Pr1Sr2O8,Cu3Pb2Pr1Sr2O8,0.0,Cuprate,True,Cu18.75Pb12.5Pr6.25Sr12.5O50,Cu-Pb-Pr-Sr-O,5,Supercon,Pb2Sr2Pr1Cu3O8,MP-mp-1218727,Sr2Pr1Cu3Pb2O8,Cu-Pb-Pr-Sr-O,Cu18.75Pb12.5Pr6.25Sr12.5O50,P -1,triclinic,3.865805,3.90250611,16.03698769,data/final/MP/cifs/Cu3Pb2Pr1Sr2O8-MP-mp-1218727.cif,data/source/MP/raw/cifs/mp-1218727.cif,mp-1218727,0.0,,2019-01-12 19:50:53.822000,7.202740451659969,,,,0.0190844011328108,4.54610681,520.0,-94.50314753,-5.906446720625,{'tags': []},-94.50314753,-5.906446720625,-2.033291205520833,[],False,[],True,2021-05-12 11:00:42.526000,NM,16,3,mp-1218727,oxide,Sr2PrCu3(PbO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Pr_3', 'Cu_pv', 'Pb_d', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Pr': 1.0, 'Cu': 3.0, 'Pb': 2.0, 'O': 8.0}",GGA,mp-1218727,"['mp-1218727', 'mp-1323740', 'mp-1776868']",0.0019453,"{'Sr': 2.0, 'Pr': 1.0, 'Cu': 3.0, 'Pb': 2.0, 'O': 8.0}",241.8809619819189,[],NM,False,2,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",8.04238574239429e-06,0.0019453,0,0.0019453,MP,data/source/MP/cleaned/cifs/MP-mp-1218727.cif,False,,data/final/MP/graphs/Cu3Pb2Pr1Sr2O8-MP-mp-1218727.json,0,True,-1,0,0,0,0,0,2,0,1,0,0,0,1.0,False
Cu1Ho2O4,1,0.0,2.0,False,Cu2Ho4O8,Cu2Ho4O8,0.0,Cuprate,True,Cu14.286Ho28.571O57.142857142857146,Cu-Ho-O,3,Supercon,Ho2Cu1O4,MP-mp-754263,Ho4Cu2O8,Cu-Ho-O,Cu14.286Ho28.571O57.142857142857146,C m c a,orthorhombic,5.478715,5.483643998286842,6.52028283,data/final/MP/cifs/Cu1Ho2O4-MP-mp-754263.cif,data/source/MP/raw/cifs/mp-754263.cif,mp-754263,0.0,,2014-05-08 22:42:28,8.547104405356135,10.17188/1289323,"@misc{osti_1289323,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ho2CuO4 (SG:64) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1289323"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1733356'}},0.0287142319642788,3.26028288,520.0,-104.32159421,-7.451542443571428,{'tags': []},-104.32159421,-7.451542443571428,-3.121846953571428,['bandstructure'],True,[],True,2021-05-12 10:58:57.544000,NM,14,7,mp-754263,oxide,Ho2CuO4,"{'functional': 'PBE', 'labels': ['Ho_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ho': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-754263,"['mp-900002', 'mp-754263', 'mp-885264', 'mp-1389632', 'mp-1733356', 'mp-1833129', 'mp-900696']",0.00047885,"{'Ho': 4.0, 'Cu': 2.0, 'O': 8.0}",177.72980736552367,[],NM,False,12,0,"[0.0, 0.0, 0.0, 0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",5.388516502639142e-06,0.00047885,0,0.0009577,MP,data/source/MP/cleaned/cifs/MP-mp-754263.cif,False,,data/final/MP/graphs/Cu1Ho2O4-MP-mp-754263.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Al3Ta1,1,0.0,1.0,True,Al3Ta1,Al3Ta1,0.0,Other,True,Al75Ta25,Al-Ta,2,Supercon,Al3Ta1,MP-mp-869,Ta1Al3,Al-Ta,Al75Ta25,I 4/m m m,tetragonal,3.859200001276578,3.8592000012765775,5.080475210000001,data/final/MP/cifs/Al3Ta1-MP-mp-869.cif,data/source/MP/raw/cifs/mp-869.cif,mp-869,0.0,,2011-05-12 18:43:31,6.813775743499663,10.17188/1312587,"@misc{osti_1312587,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TaAl3 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1312587"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686823'}},0.0,7.94966973,520.0,-24.36731399,-6.0918284975,"{'tags': ['Aluminum tantalum (3/1)', 'Tantalum aluminium (1/3)', 'Aluminium tantalum (3/1)', 'Tantalum aluminide (1/3)']}",-24.36731399,-6.0918284975,-0.3182022174999996,"['xas', 'elasticity', 'bandstructure']",True,"[609433, 609436, 281665, 609431, 609440, 107889, 609428, 151394, 58169]",True,2021-05-12 10:56:33.121000,NM,4,10,mp-869,,TaAl3,"{'functional': 'PBE', 'labels': ['Ta_pv', 'Al'], 'pot_type': 'paw'}","{'Ta': 1.0, 'Al': 3.0}",GGA,mp-869,"['mp-928619', 'mp-911990', 'mp-869', 'mp-928104', 'mp-1256855', 'mp-1476210', 'mp-1686823', 'mp-1781498', 'mp-1591414', 'mp-1589756']",3.51e-05,"{'Ta': 1.0, 'Al': 3.0}",63.82404365746174,[],NM,False,139,0,"[0, 0, 0, 0]",5.499494859394798e-07,3.51e-05,0,3.51e-05,MP,data/source/MP/cleaned/cifs/MP-mp-869.cif,False,,data/final/MP/graphs/Al3Ta1-MP-mp-869.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As2Ba1Ru2,1,0.0,1.0,True,As2Ba1Ru2,As2Ba1Ru2,0.0,Other,True,As40Ba20Ru40,As-Ba-Ru,3,Supercon,Ba1Ru2As2,MP-mp-4109,Ba1As2Ru2,As-Ba-Ru,As40Ba20Ru40,I 4/m m m,tetragonal,4.205669997748139,4.205669997748138,6.88919491,data/final/MP/cifs/As2Ba1Ru2-MP-mp-4109.cif,data/source/MP/raw/cifs/mp-4109.cif,mp-4109,0.0,,2015-02-19 20:31:53,7.39218322448805,10.17188/1207859,"@misc{osti_1207859,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba(AsRu)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207859"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701056'}},0.0,5.25248087,520.0,-33.26685683,-6.653371366,"{'tags': ['Barium diruthenium(II) arsenide', 'Barium ruthenium arsenide (1/2/2)']}",-33.26685683,-6.653371366,-0.6961739760000001,"['xas', 'elasticity', 'bandstructure']",True,"[165119, 602110, 609861]",True,2021-05-12 10:56:20.740000,NM,5,8,mp-4109,,Ba(AsRu)2,"{'functional': 'PBE', 'labels': ['Ba_sv', 'As', 'Ru_pv'], 'pot_type': 'paw'}","{'Ba': 1.0, 'As': 2.0, 'Ru': 2.0}",GGA,mp-4109,"['mp-943648', 'mp-944296', 'mp-937021', 'mp-4109', 'mp-1441471', 'mp-1701056', 'mp-1804158', 'mp-1592672']",0.0009823,"{'Ba': 1.0, 'As': 2.0, 'Ru': 2.0}",109.91593120882509,[],NM,False,139,0,"[0, 0, 0, 0, 0]",8.936830077286665e-06,0.0009823,0,0.0009823,MP,data/source/MP/cleaned/cifs/MP-mp-4109.cif,False,,data/final/MP/graphs/As2Ba1Ru2-MP-mp-4109.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As2V1,1,0.0,2.0,False,As4V2,As4V2,0.0,Other,True,As66.667V33.333,As-V,2,Supercon,As2V1,MP-mp-1072660,V2As4,As-V,As66.667V33.333,C 1 2/m 1,monoclinic,3.294422002187421,4.84940204,6.77531748158552,data/final/MP/cifs/As2V1-MP-mp-1072660.cif,data/source/MP/raw/cifs/mp-1072660.cif,mp-1072660,0.0,,2018-03-22 10:12:51,6.806542435055741,,,{'GGA': {'task_id': 'mp-1699936'}},0.0,6.67878111,520.0,-39.18233016,-6.53038836,"{'tags': ['VAs2', 'OsGe2', 'Vanadium arsenide (1/2)']}",-39.18233016,-6.53038836,-0.3963407333333333,['bandstructure'],True,[611574],True,2021-05-12 10:58:14.654000,NM,6,8,mp-1072660,,VAs2,"{'functional': 'PBE', 'labels': ['V_pv', 'As'], 'pot_type': 'paw'}","{'V': 1.0, 'As': 2.0}",GGA,mp-1072660,"['mp-1072660', 'mp-1072709', 'mp-1072770', 'mp-1435809', 'mp-1699936', 'mp-1876647', 'mp-1590482', 'mp-1072730']",0.00016105,"{'V': 2.0, 'As': 4.0}",97.9677542619568,[],NM,False,12,0,"[0, 0, 0, 0, 0, 0]",3.287816510917808e-06,0.00016105,0,0.0003221,MP,data/source/MP/cleaned/cifs/MP-mp-1072660.cif,False,,data/final/MP/graphs/As2V1-MP-mp-1072660.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
C2Th0.09Y0.91,3,0.0599999999999999,1.0,True,C2Th0.09Y0.91,C2Y1,3.7,Carbon,True,C66.667Th3Y30.333,C-Th-Y,3,Supercon,Y0.91Th0.09C2,MP-mp-313,Y1C2,C-Y,C66.667Y33.333,I 4/m m m,tetragonal,3.6847620031018047,4.05388196,3.6847620031018047,data/final/MP/cifs/C2Th0.09Y0.91-MP-mp-313-synth_doped.cif,data/source/MP/raw/cifs/mp-313.cif,mp-313,0.0,,2011-05-12 18:28:55,4.447058270599283,10.17188/1205571,"@misc{osti_1205571,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YC2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1205571"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686717'}},0.068494783958334,5.01076797,520.0,-25.48704506,-8.495681686666666,{'tags': ['Yttrium carbide (1/2)']},-25.48704506,-8.495681686666666,-0.1890041822222213,"['xas', 'elasticity', 'bandstructure']",True,"[619117, 33607, 619112, 619108, 619126, 74666, 619115, 95963]",True,2021-05-12 10:56:20.740000,NM,3,9,mp-313,,YC2,"{'functional': 'PBE', 'labels': ['Y_sv', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'C': 2.0}",GGA,mp-313,"['mp-1000986', 'mp-313', 'mp-1007425', 'mp-1442291', 'mp-1686717', 'mp-1791028', 'mp-1012183', 'mp-1591717', 'mp-1592070']",0.0001427,"{'Y': 1.0, 'C': 2.0}",42.16722581497335,[],NM,False,139,0,"[0, 0, 0]",3.384144848090244e-06,0.0001427,0,0.0001427,MP,data/source/MP/cleaned/cifs/MP-mp-313.cif,True,,data/final/MP/graphs/C2Th0.09Y0.91-MP-mp-313-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As2Ba0.4Fe2Na0.6,2,0.0399999999999999,2.0,False,As4Ba0.8Fe4Na1.2,As4Ba1Fe4Na1,28.7,Ferrite,True,As40Ba8Fe40Na12,As-Ba-Fe-Na,4,Supercon,Ba0.4Na0.6Fe2As2,MP-mp-1227868,Ba1Na1Fe4As4,As-Ba-Fe-Na,As40Ba10Fe40Na10,C m m m,orthorhombic,5.458732000131759,5.462821,6.96934908,data/final/MP/cifs/As2Ba0.4Fe2Na0.6-MP-mp-1227868-synth_doped.cif,data/source/MP/raw/cifs/mp-1227868.cif,mp-1227868,0.0,,2019-01-13 03:39:01.428000,5.934244973483095,,,{'GGA': {'task_id': 'mp-1731957'}},0.0195872770000011,4.30353274,520.0,-59.62394279,-5.962394279,{'tags': []},-59.62394279,-5.962394279,-0.3865939246551718,[],False,[],True,2021-05-12 11:00:59.151000,FM,10,4,mp-1227868,,BaNa(FeAs)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Na_pv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Na': 1.0, 'Fe': 4.0, 'As': 4.0}",GGA,mp-1227868,"['mp-1227868', 'mp-1396889', 'mp-1731957', 'mp-1827521']",0.9949323,"{'Ba': 1.0, 'Na': 1.0, 'Fe': 4.0, 'As': 4.0}",191.22642477974767,[],FM,True,65,1,"[0.0, 0.0, 0.3, 0.3, 0.3, 0.3, 0.0, 0.0, 0.0, 0.0]",0.0052029017493055,0.9949323,4,0.9949323,MP,data/source/MP/cleaned/cifs/MP-mp-1227868.cif,True,,data/final/MP/graphs/As2Ba0.4Fe2Na0.6-MP-mp-1227868-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
C1Mo0.6W0.4,3,0.0999999999999999,2.0,False,C2Mo1.2W0.8,C2Mo1W1,11.3,Other,True,C50Mo30W20,C-Mo-W,3,Supercon,Mo0.6W0.4C1,MP-mp-1221393,Mo1W1C2,C-Mo-W,C50Mo25W25,P m m 2,orthorhombic,2.842292,2.930337,5.061663,data/final/MP/cifs/C1Mo0.6W0.4-MP-mp-1221393-synth_doped.cif,data/source/MP/raw/cifs/mp-1221393.cif,mp-1221393,0.0,,2019-01-12 22:05:35.996000,11.966286040988832,,,{'GGA': {'task_id': 'mp-1734927'}},0.0005651775000004,8.22527661,520.0,-42.67012626,-10.667531565,{'tags': []},-42.67012626,-10.667531565,-0.103198840000001,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,4,5,mp-1221393,,MoWC2,"{'functional': 'PBE', 'labels': ['Mo_pv', 'W_pv', 'C'], 'pot_type': 'paw'}","{'Mo': 1.0, 'W': 1.0, 'C': 2.0}",GGA,mp-1221393,"['mp-1221393', 'mp-1399123', 'mp-1734927', 'mp-1794322', 'mp-1609499']",0.00213,"{'Mo': 1.0, 'W': 1.0, 'C': 2.0}",42.15795038324907,[],NM,False,25,0,"[0, 0, 0, 0]",5.0524277879655375e-05,0.00213,0,0.00213,MP,data/source/MP/cleaned/cifs/MP-mp-1221393.cif,True,,data/final/MP/graphs/C1Mo0.6W0.4-MP-mp-1221393-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,1,0,0,0,1.0,False
Ba1.8Cu4Sr0.2Yb1O8,3,0.0266666666666666,1.0,True,Ba1.8Cu4Sr0.2Yb1O8,Ba2Cu4Yb1O8,81.0,Cuprate,True,Ba12Cu26.667Sr1.333Yb6.667O53.333333333333336,Ba-Cu-Sr-Yb-O,5,Supercon,Yb1Ba1.8Sr0.2Cu4O8,MP-mp-15039,Ba2Yb1Cu4O8,Ba-Cu-Yb-O,Ba13.333Cu26.667Yb6.667O53.333333333333336,C m m m,orthorhombic,3.8323699978883337,3.864227,14.07800749,data/final/MP/cifs/Ba1.8Cu4Sr0.2Yb1O8-MP-mp-15039-synth_doped.cif,data/source/MP/raw/cifs/mp-15039.cif,mp-15039,0.0,,2011-06-05 16:29:12,6.671911625695413,10.17188/1191000,"@misc{osti_1191000,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YbBa2(CuO2)4 (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191000"",
    place = ""United States"",
    year = ""2015"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1708113'}},0.0,2.57482917,520.0,-84.80896532,-5.653931021333333,{'tags': []},-84.80896532,-5.653931021333333,-1.929793377333333,"['xas', 'bandstructure']",True,[78621],True,2021-05-12 10:56:53.126000,NM,15,8,mp-15039,oxide,Ba2Yb(CuO2)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Yb_2', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Yb': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-15039,"['mp-937238', 'mp-931809', 'mp-916540', 'mp-15039', 'mp-1424980', 'mp-1708113', 'mp-1789741', 'mp-1600170']",0.0006418,"{'Ba': 2.0, 'Yb': 1.0, 'Cu': 4.0, 'O': 8.0}",206.54303387610025,[],NM,False,65,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.107342755432744e-06,0.0006418,0,0.0006418,MP,data/source/MP/cleaned/cifs/MP-mp-15039.cif,True,,data/final/MP/graphs/Ba1.8Cu4Sr0.2Yb1O8-MP-mp-15039-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ir0.22Ru0.78,3,0.06,8.0,False,Ir1.76Ru6.24,Ir2Ru6,0.21,Other,True,Ir22Ru78,Ir-Ru,2,Supercon,Ir0.22Ru0.78,MP-mp-862620,Ir2Ru6,Ir-Ru,Ir25Ru75,P 63/m m c,hexagonal,4.324858,5.479349996743059,5.47934974,data/final/MP/cifs/Ir0.22Ru0.78-MP-mp-862620-synth_doped.cif,data/source/MP/raw/cifs/mp-862620.cif,mp-862620,0.0,,2014-08-23 01:08:58,14.63181570566001,10.17188/1309490,"@misc{osti_1309490,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ru3Ir (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1309490"",
    place = ""United States"",
    year = ""2016"",
    month = ""8"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1754749'}},0.0,8.78966032,520.0,-73.74476093,-9.21809511625,{'tags': []},-73.74476093,-9.21809511625,-0.0526952699999991,"['xas', 'elasticity', 'bandstructure']",True,[],True,2021-05-12 10:56:31.128000,NM,8,11,mp-862620,,IrRu3,"{'functional': 'PBE', 'labels': ['Ir', 'Ru_pv'], 'pot_type': 'paw'}","{'Ir': 1.0, 'Ru': 3.0}",GGA,mp-862620,"['mp-862620', 'mp-1002464', 'mp-1004058', 'mp-1050147', 'mp-1050219', 'mp-1385810', 'mp-1754749', 'mp-1804901', 'mp-1009375', 'mp-1619818', 'mp-1050210']",0.00075935,"{'Ir': 2.0, 'Ru': 6.0}",112.45028022464815,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.3505524370112808e-05,0.00075935,0,0.0015187,MP,data/source/MP/cleaned/cifs/MP-mp-862620.cif,True,,data/final/MP/graphs/Ir0.22Ru0.78-MP-mp-862620-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
C2La1,1,0.0,1.0,True,C2La1,C2La1,1.23375,Carbon,True,C66.667La33.333,C-La,2,Supercon,C2La1,MP-mp-2367,La1C2,C-La,C66.667La33.333,I 4/m m m,tetragonal,3.93816799603586,4.31381491,3.93816799603586,data/final/MP/cifs/C2La1-MP-mp-2367.cif,data/source/MP/raw/cifs/mp-2367.cif,mp-2367,0.0,,2011-05-12 18:46:19,5.2948067338573725,10.17188/1199651,"@misc{osti_1199651,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaC2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199651"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686773'}},0.0,7.3435196,520.0,-23.87407566,-7.95802522,"{'tags': ['Lanthanum carbide (1/2)', 'Lanthanum dicarbide']}",-23.87407566,-7.95802522,-0.1615023849999997,"['xas', 'elasticity', 'bandstructure']",True,"[618153, 236844, 26587, 236840, 236842, 236841, 618162, 236851, 236846, 236849, 42897, 618167, 56161, 74667, 618168, 236847, 69887, 236848, 236839, 236843, 618147, 618170, 618156, 602553, 236852, 236850, 236845, 618158]",True,2021-05-12 10:56:16.728000,NM,3,65,mp-2367,,LaC2,"{'functional': 'PBE', 'labels': ['La', 'C'], 'pot_type': 'paw'}","{'La': 1.0, 'C': 2.0}",GGA,mp-2367,"['mp-1000639', 'mp-1007092', 'mp-2367', 'mp-1062039', 'mp-1062071', 'mp-1062110', 'mp-1062113', 'mp-1062140', 'mp-1062193', 'mp-1062381', 'mp-1062411', 'mp-1062413', 'mp-1062409', 'mp-1062446', 'mp-1062445', 'mp-1062470', 'mp-1062448', 'mp-1062475', 'mp-1062465', 'mp-1062501', 'mp-1062504', 'mp-1062498', 'mp-1062540', 'mp-1062384', 'mp-1063038', 'mp-1063086', 'mp-1063140', 'mp-1063238', 'mp-1063295', 'mp-1063337', 'mp-1063341', 'mp-1063387', 'mp-1063390', 'mp-1063272', 'mp-1063296', 'mp-1063313', 'mp-1063546', 'mp-1063558', 'mp-1063575', 'mp-1063584', 'mp-1063603', 'mp-1063635', 'mp-1063641', 'mp-1063650', 'mp-1063541', 'mp-1440714', 'mp-1686773', 'mp-1792065', 'mp-1011835', 'mp-1588055', 'mp-1594313', 'mp-1062479', 'mp-1063629', 'mp-1063290', 'mp-1063362', 'mp-1062436', 'mp-1062435', 'mp-1063360', 'mp-1062167', 'mp-1062485', 'mp-1062520', 'mp-1062093', 'mp-1063614', 'mp-1063113', 'mp-1063617']",0.0001596,"{'La': 1.0, 'C': 2.0}",51.09656428134838,[],NM,False,139,0,"[0, 0, 0]",3.1234976802199265e-06,0.0001596,0,0.0001596,MP,data/source/MP/cleaned/cifs/MP-mp-2367.cif,False,,data/final/MP/graphs/C2La1-MP-mp-2367.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ga0.296V0.704,3,0.092,8.0,False,Ga2.368V5.632,Ga2V6,12.1,Other,True,Ga29.6V70.4,Ga-V,2,Supercon,Ga0.296V0.704,MP-mp-22568,V6Ga2,Ga-V,Ga25V75,P m -3 n,cubic,4.789645,4.789645,4.789645,data/final/MP/cifs/Ga0.296V0.704-MP-mp-22568-synth_doped.cif,data/source/MP/raw/cifs/mp-22568.cif,mp-22568,0.0,,2014-02-22 11:36:40,6.726541666276222,10.17188/1198793,"@misc{osti_1198793,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Ga (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198793"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686867'}},0.0,5.67452231,520.0,-61.95244347,-7.74405543375,{'tags': ['Gallium vanadium (1/3)']},-61.95244347,-7.74405543375,-0.1741018756249994,"['xas', 'elasticity', 'bandstructure']",True,"[635643, 635628, 635619, 635634, 104021, 635646, 635604, 635610, 635617, 635624, 635626, 635605, 635631, 635625, 635636, 635603, 104020, 635616, 635607]",True,2021-05-12 10:56:16.728000,FM,8,9,mp-22568,,V3Ga,"{'functional': 'PBE', 'labels': ['V_pv', 'Ga_d'], 'pot_type': 'paw'}","{'V': 3.0, 'Ga': 1.0}",GGA,mp-22568,"['mp-941343', 'mp-941663', 'mp-934924', 'mp-22568', 'mp-1440749', 'mp-1686867', 'mp-1804076', 'mp-1593784', 'mp-1595713']",0.09063635,"{'V': 6.0, 'Ga': 2.0}",109.87780534443452,[],FM,True,131,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.0, -0.0, -0.0]",0.0016497662965852,0.09063635,2,0.1812727,MP,data/source/MP/cleaned/cifs/MP-mp-22568.cif,True,,data/final/MP/graphs/Ga0.296V0.704-MP-mp-22568-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Nb3Sn0.9Tl0.1,2,0.0499999999999999,2.0,False,Nb6Sn1.8Tl0.2,Nb6Sn2,18.25,Other,True,Nb75Sn22.5Tl2.5,Nb-Sn-Tl,3,Supercon,Nb3Tl0.1Sn0.9,MP-mp-1326,Nb6Sn2,Nb-Sn,Nb75Sn25,P m -3 n,cubic,5.334611,5.334611,5.334611,data/final/MP/cifs/Nb3Sn0.9Tl0.1-MP-mp-1326-synth_doped.cif,data/source/MP/raw/cifs/mp-1326.cif,mp-1326,0.0,,2011-05-14 09:51:48,8.694218121896231,10.17188/1189484,"@misc{osti_1189484,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Sn (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189484"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668415'}},0.0,6.59372491,520.0,-69.93787048,-8.74223381,{'tags': ['Niobium tin (3/1)']},-69.93787048,-8.74223381,-0.163862066250001,"['xas', 'elasticity', 'bandstructure']",True,"[105230, 645503, 645489, 105231, 645498, 645485, 645474, 645496, 645480, 645488, 645482, 645487, 645500, 645493, 645477, 645484, 645502, 645483, 150878, 645479, 645481, 645486, 645473]",True,2021-05-12 10:56:12.755000,NM,8,9,mp-1326,,Nb3Sn,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Sn_d'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Sn': 1.0}",GGA,mp-1326,"['mp-930046', 'mp-913770', 'mp-930577', 'mp-1326', 'mp-1440651', 'mp-1668415', 'mp-1880085', 'mp-1594093', 'mp-1594507']",0.62023085,"{'Nb': 6.0, 'Sn': 2.0}",151.81275738025872,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0081709977567491,0.62023085,0,1.2404617,MP,data/source/MP/cleaned/cifs/MP-mp-1326.cif,True,,data/final/MP/graphs/Nb3Sn0.9Tl0.1-MP-mp-1326-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ge1Zr1,1,0.0,4.0,False,Ge4Zr4,Ge4Zr4,0.0,Other,True,Ge50Zr50,Ge-Zr,2,Supercon,Ge1Zr1,MP-mp-1025513,Zr4Ge4,Ge-Zr,Ge50Zr50,P n m a,orthorhombic,3.934538,5.437467,7.120695,data/final/MP/cifs/Ge1Zr1-MP-mp-1025513.cif,data/source/MP/raw/cifs/mp-1025513.cif,mp-1025513,0.0,,2016-10-12 20:08:38,7.144632229558943,10.17188/1355518,"@article{osti_1355518,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrGe (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1355518"",
    place = ""United States"",
    year = ""2017"",
    month = ""5""
}
",{'GGA': {'task_id': 'mp-1703775'}},0.0,5.18354575,520.0,-59.12369985,-7.39046248125,"{'tags': ['Zirconium germanide (1/1)', 'FeB-b', 'ZrGe']}",-59.12369985,-7.39046248125,-0.8050982387500003,['bandstructure'],True,"[638153, 638161]",True,2021-05-12 10:58:09.072000,NM,8,5,mp-1025513,,ZrGe,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Ge_d'], 'pot_type': 'paw'}","{'Zr': 1.0, 'Ge': 1.0}",GGA,mp-1025513,"['mp-1025513', 'mp-1415688', 'mp-1703775', 'mp-1874798', 'mp-1590996']",1.995e-05,"{'Zr': 4.0, 'Ge': 4.0}",152.33958298572352,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0]",5.238297127771345e-07,1.995e-05,0,7.98e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1025513.cif,False,,data/final/MP/graphs/Ge1Zr1-MP-mp-1025513.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ni1P3,1,0.0,4.0,False,Ni4P12,Ni4P12,0.0,Ferrite,True,Ni25P75,Ni-P,2,Supercon,Ni1P3,MP-mp-2301,Ni4P12,Ni-P,Ni25P75,I m -3,cubic,6.7758797515021065,6.7758797500000005,6.77587975,data/final/MP/cifs/Ni1P3-MP-mp-2301.cif,data/source/MP/raw/cifs/mp-2301.cif,mp-2301,0.0,,2011-05-15 06:47:29,4.20508887788062,10.17188/1199162,"@misc{osti_1199162,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NiP3 (SG:204) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199162"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1708162'}},0.0,8.26690845,520.0,-92.92277809,-5.807673630625,{'tags': ['Nickel phosphide (1/3)']},-92.92277809,-5.807673630625,-0.3026625806249994,"['xas', 'elasticity', 'bandstructure']",True,"[23714, 92394]",True,2021-05-12 10:56:16.728000,NM,16,8,mp-2301,,NiP3,"{'functional': 'PBE', 'labels': ['Ni_pv', 'P'], 'pot_type': 'paw'}","{'Ni': 1.0, 'P': 3.0}",GGA,mp-2301,"['mp-913000', 'mp-929254', 'mp-930106', 'mp-2301', 'mp-1427640', 'mp-1708162', 'mp-1776689', 'mp-1603425']",0.002495425,"{'Ni': 4.0, 'P': 12.0}",239.4832703751852,[],NM,False,204,0,"[-0.0, -0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",4.168015571343345e-05,0.002495425,0,0.0099817,MP,data/source/MP/cleaned/cifs/MP-mp-2301.cif,False,,data/final/MP/graphs/Ni1P3-MP-mp-2301.json,0,True,m-3,2,0,0,0,0,0,0,0,0,1,0,1.0,False
Bi2Cu1Sr2O6.17,2,0.0138357613738097,1.944973662884927,False,Bi3.89Cu1.945Sr3.89O12,Bi4Cu2Sr4O12,0.0,Cuprate,True,Bi17.905Cu8.953Sr17.905O55.23724261414503,Bi-Cu-Sr-O,4,Supercon,Bi2Sr2Cu1O6.17,MP-mp-555827,Sr4Cu2Bi4O12,Bi-Cu-Sr-O,Bi18.182Cu9.091Sr18.182O54.54545454545455,C c c m,orthorhombic,5.133052,5.52519599964684,13.01880065,data/final/MP/cifs/Bi2Cu1Sr2O6.17-MP-mp-555827-synth_doped.cif,data/source/MP/raw/cifs/mp-555827.cif,mp-555827,0.0,,2014-02-22 10:13:35,6.928457216674172,10.17188/1269010,"@misc{osti_1269010,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr2Cu(BiO3)2 (SG:66) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1269010"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1707731'}},0.0585641377272736,4.75363105,520.0,-126.5422218,-5.7519191727272725,{'tags': ['Dibismuth distrontium copper hexaoxide']},-126.5422218,-5.7519191727272725,-2.0406438793939388,"['xas', 'bandstructure']",True,[67426],True,2021-05-12 10:57:17.297000,NM,22,8,mp-555827,oxide,Sr2Cu(BiO3)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Cu': 1.0, 'Bi': 2.0, 'O': 6.0}",GGA,mp-555827,"['mp-932594', 'mp-931549', 'mp-918058', 'mp-555827', 'mp-1418436', 'mp-1707731', 'mp-1837530', 'mp-1605675']",0.00627605,"{'Sr': 4.0, 'Cu': 2.0, 'Bi': 4.0, 'O': 12.0}",360.8189966762927,[],NM,False,66,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",3.478780251490214e-05,0.00627605,0,0.0125521,MP,data/source/MP/cleaned/cifs/MP-mp-555827.cif,True,,data/final/MP/graphs/Bi2Cu1Sr2O6.17-MP-mp-555827-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
C1Mg1Ni2.8Ru0.2,3,0.08,1.0,True,C1Mg1Ni2.8Ru0.2,C1Mg1Ni3,3.48,Other,True,C20Mg20Ni56Ru4,C-Mg-Ni-Ru,4,Supercon,Mg1C1Ni2.8Ru0.2,MP-mp-10700,Mg1Ni3C1,C-Mg-Ni,C20Mg20Ni60,P m -3 m,cubic,3.810209,3.810209,3.810209,data/final/MP/cifs/C1Mg1Ni2.8Ru0.2-MP-mp-10700-synth_doped.cif,data/source/MP/raw/cifs/mp-10700.cif,mp-10700,0.0,,2011-05-28 10:04:44,6.376007671789427,10.17188/1187303,"@misc{osti_1187303,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MgNi3C (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187303"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678621'}},0.0,6.64260176,520.0,-28.85099542,-5.770199084,{'tags': ['Magnesium nickel carbide (1/3/1)']},-28.85099542,-5.770199084,-0.1367049259999994,"['xas', 'elasticity', 'bandstructure']",True,[77152],True,2021-05-12 10:56:10.715000,NM,5,8,mp-10700,,MgNi3C,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Ni_pv', 'C'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",GGA,mp-10700,"['mp-927245', 'mp-927653', 'mp-911184', 'mp-10700', 'mp-1438083', 'mp-1678621', 'mp-1791467', 'mp-1591421']",0.0387875,"{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",55.31544309398296,[],NM,False,221,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",0.0007012056277683,0.0387875,0,0.0387875,MP,data/source/MP/cleaned/cifs/MP-mp-10700.cif,True,,data/final/MP/graphs/C1Mg1Ni2.8Ru0.2-MP-mp-10700-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Cu0.81Ga0.19,3,0.12,4.0,False,Cu3.24Ga0.76,Cu3Ga1,0.048,Other,True,Cu81Ga19,Cu-Ga,2,Supercon,Cu0.81Ga0.19,MP-mp-1183995,Ga1Cu3,Cu-Ga,Cu75Ga25,P m -3 m,cubic,3.686444,3.686444,3.686444,data/final/MP/cifs/Cu0.81Ga0.19-MP-mp-1183995-synth_doped.cif,data/source/MP/raw/cifs/mp-1183995.cif,mp-1183995,0.0,,2019-01-11 12:27:03.686000,8.629827312743574,,,{'GGA': {'task_id': 'mp-1713085'}},0.0,6.68720671,520.0,-15.70446045,-3.9261151125,{'tags': []},-15.70446045,-3.9261151125,-0.094686104375,['bandstructure'],True,[],True,2021-05-12 10:58:27.755000,NM,4,5,mp-1183995,,GaCu3,"{'functional': 'PBE', 'labels': ['Ga_d', 'Cu_pv'], 'pot_type': 'paw'}","{'Ga': 1.0, 'Cu': 3.0}",GGA,mp-1183995,"['mp-1183995', 'mp-1422862', 'mp-1713085', 'mp-1793276', 'mp-1616761']",6.93e-05,"{'Ga': 1.0, 'Cu': 3.0}",50.09829238188941,[],NM,False,221,0,"[0, 0, 0, 0]",1.3832806809409744e-06,6.93e-05,0,6.93e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1183995.cif,True,,data/final/MP/graphs/Cu0.81Ga0.19-MP-mp-1183995-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Cu50Sn50,1,0.0,0.04,False,Cu2Sn2,Cu2Sn2,3.26,Other,True,Cu50Sn50,Cu-Sn,2,Supercon,Cu50Sn50,MP-mp-10598,Cu2Sn2,Cu-Sn,Cu50Sn50,P 63/m m c,hexagonal,4.175425999271037,4.17542601,5.096759,data/final/MP/cifs/Cu50Sn50-MP-mp-10598.cif,data/source/MP/raw/cifs/mp-10598.cif,mp-10598,0.0,,2011-05-28 11:27:25,7.865649927546907,10.17188/1187217,"@misc{osti_1187217,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CuSn (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187217"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700375'}},0.0,7.85825915,520.0,-16.31080228,-4.07770057,{'tags': ['Copper tin (1/1)']},-16.31080228,-4.07770057,-0.0233113075000002,"['xas', 'elasticity', 'bandstructure']",True,[629278],True,2021-05-12 10:56:10.715000,NM,4,8,mp-10598,,CuSn,"{'functional': 'PBE', 'labels': ['Cu_pv', 'Sn_d'], 'pot_type': 'paw'}","{'Cu': 1.0, 'Sn': 1.0}",GGA,mp-10598,"['mp-929980', 'mp-930527', 'mp-10598', 'mp-913665', 'mp-1441241', 'mp-1700375', 'mp-1802264', 'mp-1592126']",0.00030375,"{'Cu': 2.0, 'Sn': 2.0}",76.95313442881285,[],NM,False,194,0,"[0, 0, 0, 0]",7.894415276378131e-06,0.00030375,0,0.0006075,MP,data/source/MP/cleaned/cifs/MP-mp-10598.cif,False,,data/final/MP/graphs/Cu50Sn50-MP-mp-10598.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ge3Zr5,1,0.0,2.0,False,Ge6Zr10,Ge6Zr10,0.0,Other,True,Ge37.5Zr62.5,Ge-Zr,2,Supercon,Ge3Zr5,MP-mp-17706,Zr10Ge6,Ge-Zr,Ge37.5Zr62.5,P 63/m c m,hexagonal,5.648912,8.107132002795803,8.10713264,data/final/MP/cifs/Ge3Zr5-MP-mp-17706.cif,data/source/MP/raw/cifs/mp-17706.cif,mp-17706,0.0,,2014-02-16 02:53:51,6.962012329744756,10.17188/1192647,"@misc{osti_1192647,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Zr5Ge3 (SG:193) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1192647"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1673300'}},0.0,4.69233028,520.0,-126.04204371,-7.877627731875,{'tags': ['Zirconium germanide (5/3)']},-126.04204371,-7.877627731875,-0.8016793925000005,"['xas', 'bandstructure']",True,"[76315, 638151]",True,2021-05-12 10:56:55.092000,NM,16,8,mp-17706,,Zr5Ge3,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Ge_d'], 'pot_type': 'paw'}","{'Zr': 5.0, 'Ge': 3.0}",GGA,mp-17706,"['mp-940020', 'mp-940453', 'mp-921204', 'mp-17706', 'mp-1432603', 'mp-1673300', 'mp-1813022', 'mp-1602794']",9.9e-06,"{'Zr': 10.0, 'Ge': 6.0}",321.536274122657,[],NM,False,193,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.15793662908679e-08,9.9e-06,0,1.98e-05,MP,data/source/MP/cleaned/cifs/MP-mp-17706.cif,False,,data/final/MP/graphs/Ge3Zr5-MP-mp-17706.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
B2C1Ho0.85Lu0.15Ni2,2,0.05,1.0,True,B2C1Ho0.85Lu0.15Ni2,B2C1Ho1Ni2,8.72,Other,True,B33.333C16.667Ho14.167Lu2.5Ni33.333,B-C-Ho-Lu-Ni,5,Supercon,Ho0.85Lu0.15Ni2B2C1,MP-mp-6646,Ho1Ni2B2C1,B-C-Ho-Ni,B33.333C16.667Ho16.667Ni33.333,I 4/m m m,tetragonal,3.529863997734658,3.529863997734658,5.76032203,data/final/MP/cifs/B2C1Ho0.85Lu0.15Ni2-MP-mp-6646-synth_doped.cif,data/source/MP/raw/cifs/mp-6646.cif,mp-6646,0.0,,2011-05-13 04:24:09,8.11075125231065,10.17188/1281460,"@misc{osti_1281460,
    author = ""Persson, Kristin"",
    title = ""Materials Data on HoNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281460"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1670774'}},0.0,6.70981387,520.0,-41.84364575,-6.973940958333333,{'tags': ['Holmium dinickel diboride carbide']},-41.84364575,-6.973940958333333,-0.5192332130555558,"['xas', 'elasticity', 'bandstructure']",True,"[79064, 56650, 79065, 79062, 79063, 79575]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-6646,,HoNi2B2C,"{'functional': 'PBE', 'labels': ['Ho_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Ho': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6646,"['mp-1007146', 'mp-6646', 'mp-1000682', 'mp-1439301', 'mp-1670774', 'mp-1782657', 'mp-1011887', 'mp-1589032']",0.0032459,"{'Ho': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",64.68537905730652,[],NM,False,139,0,"[0.0, -0.0, -0.0, 0.0, 0.0, 0.0]",5.017980952271099e-05,0.0032459,0,0.0032459,MP,data/source/MP/cleaned/cifs/MP-mp-6646.cif,True,,data/final/MP/graphs/B2C1Ho0.85Lu0.15Ni2-MP-mp-6646-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ca1Si1.9,2,0.0229885057471264,1.0,True,Ca1Si1.9,Ca1Si2,1.35,Other,True,Ca34.483Si65.517,Ca-Si,2,Supercon,Ca1Si1.9,MP-mp-2700,Ca1Si2,Ca-Si,Ca33.333Si66.667,R -3 m,trigonal,3.84369785723118,3.84369785723118,5.73497046,data/final/MP/cifs/Ca1Si1.9-MP-mp-2700-synth_doped.cif,data/source/MP/raw/cifs/mp-2700.cif,mp-2700,0.0,,2011-05-12 18:30:01,2.362147975614476,10.17188/1201274,"@misc{osti_1201274,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CaSi2 (SG:166) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201274"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672812'}},0.0032755049999977,5.30351294,520.0,-13.99433662,-4.664778873333334,{'tags': ['Calcium silicide (1/2)']},-13.99433662,-4.664778873333334,-0.3320362333333335,"['xas', 'elasticity', 'bandstructure']",True,"[193539, 409057, 15632]",True,2021-05-12 10:56:18.721000,NM,3,15,mp-2700,,CaSi2,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Si'], 'pot_type': 'paw'}","{'Ca': 1.0, 'Si': 2.0}",GGA,mp-2700,"['mp-908870', 'mp-924438', 'mp-923818', 'mp-2700', 'mp-1061758', 'mp-1061819', 'mp-1061726', 'mp-1138777', 'mp-1145985', 'mp-1251016', 'mp-1439308', 'mp-1672812', 'mp-1782688', 'mp-1588636', 'mp-1061788']",0.0002654,"{'Ca': 1.0, 'Si': 2.0}",67.66097055355195,[],NM,False,166,0,"[0, 0, 0]",3.922497679662201e-06,0.0002654,0,0.0002654,MP,data/source/MP/cleaned/cifs/MP-mp-2700.cif,True,,data/final/MP/graphs/Ca1Si1.9-MP-mp-2700-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ni0.1Si1.9Sr1,3,0.0666666666666667,2.0,False,Ni0.2Si3.8Sr2,Si4Sr2,2.3,Other,True,Ni3.333Si63.333Sr33.333,Ni-Si-Sr,3,Supercon,Sr1Si1.9Ni0.1,MP-mp-1727,Sr2Si4,Si-Sr,Si66.667Sr33.333,I 41/a m d,tetragonal,4.437676001403473,4.437676001403473,7.655674089999999,data/final/MP/cifs/Ni0.1Si1.9Sr1-MP-mp-1727-synth_doped.cif,data/source/MP/raw/cifs/mp-1727.cif,mp-1727,0.0,,2011-05-12 21:45:19,3.472602102241727,10.17188/1192424,"@misc{osti_1192424,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SrSi2 (SG:141) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1192424"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697760'}},0.0,5.17909165,520.0,-27.27432404,-4.545720673333333,"{'tags': ['Strontium silicide (1/2)', 'Strontium silicide (1/2) - HP', 'Strontium silicide (1/2) - beta']}",-27.27432404,-4.545720673333333,-0.318346842222222,"['xas', 'elasticity', 'bandstructure']",True,"[659992, 99238, 37185, 1455, 154436]",True,2021-05-12 10:56:14.760000,NM,6,10,mp-1727,,SrSi2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Si'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Si': 2.0}",GGA,mp-1727,"['mp-919769', 'mp-918777', 'mp-905802', 'mp-1727', 'mp-1125152', 'mp-1146522', 'mp-1441695', 'mp-1697760', 'mp-1778624', 'mp-1588369']",0.0014147,"{'Sr': 2.0, 'Si': 4.0}",137.5168049177549,[],NM,False,141,0,"[0, 0, 0, 0, 0, 0]",2.057493992601259e-05,0.0014147,0,0.0028294,MP,data/source/MP/cleaned/cifs/MP-mp-1727.cif,True,,data/final/MP/graphs/Ni0.1Si1.9Sr1-MP-mp-1727-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
N0.82V1,3,0.0989010989010989,1.0,True,N0.82V1,N1V1,2.9,Other,True,N45.055V54.945,N-V,2,Supercon,N0.82V1,MP-mp-1018027,V1N1,N-V,N50V50,P -6 m 2,hexagonal,2.650884,2.7441139966135384,2.74411362,data/final/MP/cifs/N0.82V1-MP-mp-1018027-synth_doped.cif,data/source/MP/raw/cifs/mp-1018027.cif,mp-1018027,0.0,,2017-04-06 22:50:08,6.238650289574885,10.17188/1350109,"@article{osti_1350109,
    author = ""Persson, Kristin"",
    title = ""Materials Data on VN (SG:187) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1350109"",
    place = ""United States"",
    year = ""2017"",
    month = ""4""
}
",{'GGA': {'task_id': 'mp-1708543'}},0.0,8.01774245,520.0,-19.7434431,-9.87172155,"{'tags': ['Tantalum nitride', 'Vanadium nitride', 'Niobium nitride']}",-19.7434431,-9.87172155,-1.3420210524999998,"['xas', 'bandstructure']",True,"[169820, 236426, 236427, 236425, 191061]",True,2021-05-12 10:56:51.169000,NM,2,29,mp-1018027,,VN,"{'functional': 'PBE', 'labels': ['V_pv', 'N'], 'pot_type': 'paw'}","{'V': 1.0, 'N': 1.0}",GGA,mp-1018027,"['mp-1018027', 'mp-1018232', 'mp-1018180', 'mp-1018364', 'mp-1057791', 'mp-1057832', 'mp-1057871', 'mp-1058279', 'mp-1058305', 'mp-1058336', 'mp-1058343', 'mp-1058365', 'mp-1058410', 'mp-1059217', 'mp-1059301', 'mp-1059342', 'mp-1059261', 'mp-1059121', 'mp-1059171', 'mp-1115473', 'mp-1423003', 'mp-1708543', 'mp-1790797', 'mp-1607807', 'mp-1059185', 'mp-1058318', 'mp-1058380', 'mp-1057845', 'mp-1059319']",0.0042068,"{'V': 1.0, 'N': 1.0}",17.287236565507055,[],NM,False,187,0,"[0, 0]",0.0002433471644851,0.0042068,0,0.0042068,MP,data/source/MP/cleaned/cifs/MP-mp-1018027.cif,True,,data/final/MP/graphs/N0.82V1-MP-mp-1018027-synth_doped.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Ga0.4Si0.6V3,2,0.0499999999999999,2.0,False,Ga0.8Si1.2V6,Ga1Si1V6,8.7,Other,True,Ga10Si15V75,Ga-Si-V,3,Supercon,V3Ga0.4Si0.6,MP-mp-1216440,V6Ga1Si1,Ga-Si-V,Ga12.5Si12.5V75,P m -3,cubic,4.747019,4.747019,4.747019,data/final/MP/cifs/Ga0.4Si0.6V3-MP-mp-1216440-synth_doped.cif,data/source/MP/raw/cifs/mp-1216440.cif,mp-1216440,0.0,,2019-01-12 17:56:57.356000,6.263022625398905,,,{'GGA': {'task_id': 'mp-1752355'}},0.0012115512499999,6.46444818,520.0,-65.49539593,-8.18692449125,{'tags': []},-65.49539593,-8.18692449125,-0.3084436834374999,['bandstructure'],True,[],True,2021-05-12 10:58:39.488000,FM,8,5,mp-1216440,,V6GaSi,"{'functional': 'PBE', 'labels': ['V_pv', 'Ga_d', 'Si'], 'pot_type': 'paw'}","{'V': 6.0, 'Ga': 1.0, 'Si': 1.0}",GGA,mp-1216440,"['mp-1216440', 'mp-1444194', 'mp-1752355', 'mp-1875781', 'mp-1620045']",2.0268443,"{'V': 6.0, 'Ga': 1.0, 'Si': 1.0}",106.970225166654,[],FM,True,47,1,"[0.2, 0.3, 0.3, 0.2, 0.3, 0.3, 0.0, 0.0]",0.0189477426717788,2.0268443,6,2.0268443,MP,data/source/MP/cleaned/cifs/MP-mp-1216440.cif,True,,data/final/MP/graphs/Ga0.4Si0.6V3-MP-mp-1216440-synth_doped.json,0,True,m-3,2,0,0,0,0,0,0,1,0,0,0,1.0,False
Cr0.201Ga1V2.799,3,0.1005,2.0,False,Cr0.402Ga2V5.598,Ga2V6,12.6,Other,True,Cr5.025Ga25V69.975,Cr-Ga-V,3,Supercon,V2.799Cr0.201Ga1,MP-mp-22568,V6Ga2,Ga-V,Ga25V75,P m -3 n,cubic,4.789645,4.789645,4.789645,data/final/MP/cifs/Cr0.201Ga1V2.799-MP-mp-22568-synth_doped.cif,data/source/MP/raw/cifs/mp-22568.cif,mp-22568,0.0,,2014-02-22 11:36:40,6.726541666276222,10.17188/1198793,"@misc{osti_1198793,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Ga (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198793"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686867'}},0.0,5.67452231,520.0,-61.95244347,-7.74405543375,{'tags': ['Gallium vanadium (1/3)']},-61.95244347,-7.74405543375,-0.1741018756249994,"['xas', 'elasticity', 'bandstructure']",True,"[635643, 635628, 635619, 635634, 104021, 635646, 635604, 635610, 635617, 635624, 635626, 635605, 635631, 635625, 635636, 635603, 104020, 635616, 635607]",True,2021-05-12 10:56:16.728000,FM,8,9,mp-22568,,V3Ga,"{'functional': 'PBE', 'labels': ['V_pv', 'Ga_d'], 'pot_type': 'paw'}","{'V': 3.0, 'Ga': 1.0}",GGA,mp-22568,"['mp-941343', 'mp-941663', 'mp-934924', 'mp-22568', 'mp-1440749', 'mp-1686867', 'mp-1804076', 'mp-1593784', 'mp-1595713']",0.09063635,"{'V': 6.0, 'Ga': 2.0}",109.87780534443452,[],FM,True,131,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.0, -0.0, -0.0]",0.0016497662965852,0.09063635,2,0.1812727,MP,data/source/MP/cleaned/cifs/MP-mp-22568.cif,True,,data/final/MP/graphs/Cr0.201Ga1V2.799-MP-mp-22568-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba2.02Cu1.01Tl1.97O6.16,2,0.0130335614206581,1.9482024879427755,False,Ba3.935Cu1.968Tl3.838O12,Ba4Cu2Tl4O12,0.0,Cuprate,True,Ba18.1Cu9.05Tl17.652O55.19713261648746,Ba-Cu-Tl-O,4,Supercon,Tl1.97Ba2.02Cu1.01O6.16,MP-mp-6027,Ba4Tl4Cu2O12,Ba-Cu-Tl-O,Ba18.182Cu9.091Tl18.182O54.54545454545455,C m c a,orthorhombic,5.504110002693673,5.585743,12.28312762,data/final/MP/cifs/Ba2.02Cu1.01Tl1.97O6.16-MP-mp-6027-synth_doped.cif,data/source/MP/raw/cifs/mp-6027.cif,mp-6027,0.0,,2011-05-19 00:05:23,7.606665315628389,10.17188/1277350,"@misc{osti_1277350,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Tl2CuO6 (SG:64) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277350"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1673478'}},0.0059215576010052,4.10961464,520.0,-115.75418737,-5.261553971363636,"{'tags': ['Dithallium dibarium cuprate', 'Dithallium(III) dibarium copper oxide']}",-115.75418737,-5.261553971363636,-1.7862630028787878,"['xas', 'bandstructure']",True,"[202723, 202724, 202722]",True,2021-05-12 10:57:28.836000,NM,22,8,mp-6027,oxide,Ba2Tl2CuO6,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Tl_d', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Tl': 2.0, 'Cu': 1.0, 'O': 6.0}",GGA,mp-6027,"['mp-925246', 'mp-909581', 'mp-924678', 'mp-6027', 'mp-1504634', 'mp-1673478', 'mp-1837163', 'mp-1605186']",2.9e-05,"{'Ba': 4.0, 'Tl': 4.0, 'Cu': 2.0, 'O': 12.0}",368.0385386017736,[],NM,False,64,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.5759219189476614e-07,2.9e-05,0,5.8e-05,MP,data/source/MP/cleaned/cifs/MP-mp-6027.cif,True,,data/final/MP/graphs/Ba2.02Cu1.01Tl1.97O6.16-MP-mp-6027-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Br2C2La2,1,0.0,1.0,True,Br2C2La2,Br2C2La2,7.03,Other,True,Br33.333C33.333La33.333,Br-C-La,3,Supercon,La2C2Br2,MP-mp-1206284,La2C2Br2,Br-C-La,Br33.333C33.333La33.333,C 1 2/m 1,monoclinic,4.118465997685511,4.27266811,10.19668288,data/final/MP/cifs/Br2C2La2-MP-mp-1206284.cif,data/source/MP/raw/cifs/mp-1206284.cif,mp-1206284,0.0,,2019-01-12 09:37:35.357000,4.888836074044071,,,{'GGA': {'task_id': 'mp-1751833'}},0.0326952979166668,4.99333627,520.0,-38.32231144,-6.387051906666667,"{'tags': ['GdCBr-a', 'LaCBr']}",-38.32231144,-6.387051906666667,-1.2984783408333331,['bandstructure'],True,[],True,2021-05-12 10:58:37.524000,NM,6,5,mp-1206284,,LaCBr,"{'functional': 'PBE', 'labels': ['La', 'C', 'Br'], 'pot_type': 'paw'}","{'La': 1.0, 'C': 1.0, 'Br': 1.0}",GGA,mp-1206284,"['mp-1206284', 'mp-1395011', 'mp-1751833', 'mp-1780656', 'mp-1625163']",0.0102233,"{'La': 2.0, 'C': 2.0, 'Br': 2.0}",156.80047513935037,[],NM,False,12,0,"[0, 0, 0, 0, 0, 0]",0.0001303988395559,0.0102233,0,0.0204466,MP,data/source/MP/cleaned/cifs/MP-mp-1206284.cif,False,,data/final/MP/graphs/Br2C2La2-MP-mp-1206284.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
B2C1Ce1Co2,1,0.0,1.0,True,B2C1Ce1Co2,B2C1Ce1Co2,0.0,Heavy_fermion,True,B33.333C16.667Ce16.667Co33.333,B-C-Ce-Co,4,Supercon,Ce1Co2B2C1,MP-mp-1025095,Ce1Co2B2C1,B-C-Ce-Co,B33.333C16.667Ce16.667Co33.333,I 4/m m m,tetragonal,3.6342460031868655,3.6342460031868655,5.606764259999999,data/final/MP/cifs/B2C1Ce1Co2-MP-mp-1025095.cif,data/source/MP/raw/cifs/mp-1025095.cif,mp-1025095,0.0,,2016-10-01 07:41:18,7.357413774338385,10.17188/1355322,"@article{osti_1355322,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeCo2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1355322"",
    place = ""United States"",
    year = ""2017"",
    month = ""5""
}
",{'GGA': {'task_id': 'mp-1761619'}},0.0,7.51817177,520.0,-45.54559168,-7.590931946666667,"{'tags': ['LuNi2B2C', 'CeCo2B2C']}",-45.54559168,-7.590931946666667,-0.4683837822222223,['bandstructure'],True,[],True,2021-05-12 10:58:09.072000,NM,6,5,mp-1025095,,CeCo2B2C,"{'functional': 'PBE', 'labels': ['Ce', 'Co', 'B', 'C'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Co': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-1025095,"['mp-1025095', 'mp-1409972', 'mp-1761619', 'mp-1782203', 'mp-1624736']",0.1621528,"{'Ce': 1.0, 'Co': 2.0, 'B': 2.0, 'C': 1.0}",65.81636757253334,[],NM,False,139,0,"[-0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.00246371542491,0.1621528,0,0.1621528,MP,data/source/MP/cleaned/cifs/MP-mp-1025095.cif,False,,data/final/MP/graphs/B2C1Ce1Co2-MP-mp-1025095.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ag0.7Al0.3,3,0.0666666666666666,6.0,False,Ag4.2Al1.8,Ag4Al2,0.11,Other,True,Ag70Al30,Ag-Al,2,Supercon,Ag0.7Al0.3,MP-mp-985805,Al2Ag4,Ag-Al,Ag66.667Al33.333,C m c m,orthorhombic,4.569113,5.097394001168852,5.10979643,data/final/MP/cifs/Ag0.7Al0.3-MP-mp-985805-synth_doped.cif,data/source/MP/raw/cifs/mp-985805.cif,mp-985805,0.0,,2017-11-17 15:09:37,7.814765925012479,10.17188/1316751,"@misc{osti_1316751,
    author = ""Persson, Kristin"",
    title = ""Materials Data on AlAg2 (SG:63) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1316751"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1760271'}},0.0,5.04571075,520.0,-19.27423641,-3.212372735,{'tags': []},-19.27423641,-3.212372735,-0.0754767894444441,"['xas', 'elasticity', 'bandstructure']",True,[],True,2021-05-12 10:56:37.246000,NM,6,9,mp-985805,,AlAg2,"{'functional': 'PBE', 'labels': ['Al', 'Ag'], 'pot_type': 'paw'}","{'Al': 1.0, 'Ag': 2.0}",GGA,mp-985805,"['mp-1040769', 'mp-1040772', 'mp-985805', 'mp-1256890', 'mp-1398492', 'mp-1760271', 'mp-1928111', 'mp-1627544', 'mp-1040771']",1.33e-05,"{'Al': 2.0, 'Ag': 4.0}",103.14899334858234,[],NM,False,63,0,"[0, 0, 0, 0, 0, 0]",2.578793950039609e-07,1.33e-05,0,2.66e-05,MP,data/source/MP/cleaned/cifs/MP-mp-985805.cif,True,,data/final/MP/graphs/Ag0.7Al0.3-MP-mp-985805-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
As1Co0.075Fe0.925Sm1O1,2,0.0374999999999999,2.0,False,As2Co0.15Fe1.85Sm2O2,As2Fe2Sm2O2,13.3,Ferrite,True,As25Co1.875Fe23.125Sm25O25,As-Co-Fe-Sm-O,5,Supercon,Sm1Fe0.925Co0.075As1O1,MP-mp-20349,Sm2Fe2As2O2,As-Fe-Sm-O,As25Fe25Sm25O25,P 4/n m m,tetragonal,4.026492,4.026492,9.046755,data/final/MP/cifs/As1Co0.075Fe0.925Sm1O1-MP-mp-20349-synth_doped.cif,data/source/MP/raw/cifs/mp-20349.cif,mp-20349,0.0,,2014-02-19 11:24:42,6.727802583283198,,,{'GGA+U': {'task_id': 'mp-1695938'}},0.3015723809374986,3.77685593,520.0,-52.73407138,-6.5917589225,{'tags': ['Samarium iron arsenic oxide (1/1/1/1)']},-52.73407138,-6.5917589225,-1.6285904237499995,"['xas', 'elasticity', 'bandstructure']",True,"[236652, 236653, 422002, 163457, 163458]",True,2021-05-12 10:56:16.728000,FM,8,10,mp-20349,oxide,SmFeAsO,"{'functional': 'PBE', 'labels': ['Sm_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Sm': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-20349,"['mp-24944', 'mp-1078897', 'mp-1079866', 'mp-1173321', 'mp-20349', 'mp-1425472', 'mp-1695938', 'mp-1772503', 'mp-1789694', 'mp-1588381']",3.75729895,"{'Sm': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",146.67176231613362,[],FM,True,129,1,"[0.0, 0.0, 3.5, 3.5, -0.0, -0.0, -0.0, -0.0]",0.0512341147425717,3.75729895,2,7.5145979,MP,data/source/MP/cleaned/cifs/MP-mp-20349.cif,True,,data/final/MP/graphs/As1Co0.075Fe0.925Sm1O1-MP-mp-20349-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
As1Ca1Co0.26F1Fe0.74,3,0.13,2.0,False,As2Ca2Co0.52F2Fe1.48,As2Ca2F2Fe2,3.49,Ferrite,True,As25Ca25Co6.5F25Fe18.5,As-Ca-Co-F-Fe,5,Supercon,Ca1Fe0.74Co0.26As1F1,MP-mp-1079859,Ca2Fe2As2F2,As-Ca-F-Fe,As25Ca25F25Fe25,P m m n,orthorhombic,3.933336,3.981276,9.018918,data/final/MP/cifs/As1Ca1Co0.26F1Fe0.74-MP-mp-1079859-synth_doped.cif,data/source/MP/raw/cifs/mp-1079859.cif,mp-1079859,0.0,,2018-04-16 14:43:21,4.464120586611354,,,{'GGA+U': {'task_id': 'mp-1695365'}},0.2859614887499973,4.27317878,520.0,-41.71531675,-5.21441459375,"{'tags': ['Calcium iron arsenide fluoride', 'High pressure experimental phase']}",-41.71531675,-5.21441459375,-1.632363168125,['bandstructure'],True,[186505],True,2021-05-12 10:58:16.596000,FM,8,6,mp-1079859,,CaFeAsF,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Fe_pv', 'As', 'F'], 'pot_type': 'paw'}","{'Ca': 1.0, 'Fe': 1.0, 'As': 1.0, 'F': 1.0}",GGA+U,mp-1079859,"['mp-1079859', 'mp-1475687', 'mp-1695365', 'mp-1785040', 'mp-1938652', 'mp-1594699']",3.7150606,"{'Ca': 2.0, 'Fe': 2.0, 'As': 2.0, 'F': 2.0}",141.2335160836522,[],FM,True,59,1,"[0.0, 0.0, 3.6, 3.6, 0.0, 0.0, 0.0, 0.0]",0.0526087674231601,3.7150606,2,7.4301212,MP,data/source/MP/cleaned/cifs/MP-mp-1079859.cif,True,,data/final/MP/graphs/As1Ca1Co0.26F1Fe0.74-MP-mp-1079859-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Mo6Pb1S8,1,0.0,1.0,True,Mo6Pb1S8,Mo6Pb1S8,12.45,Chevrel,True,Mo40Pb6.667S53.333,Mo-Pb-S,3,Supercon,Pb1Mo6S8,MP-mp-555066,Mo6Pb1S8,Mo-Pb-S,Mo40Pb6.667S53.333,R -3,trigonal,6.604759610000001,6.60475961,6.60475991,data/final/MP/cifs/Mo6Pb1S8-MP-mp-555066.cif,data/source/MP/raw/cifs/mp-555066.cif,mp-555066,0.0,,2015-02-15 04:04:11,5.9922996903150745,10.17188/1268605,"@misc{osti_1268605,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Mo6PbS8 (SG:148) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1268605"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677735'}},0.0316114793333346,6.0650123,520.0,-111.7986263,-7.453241753333333,"{'tags': ['Lead molybdenum(II/III) sulfide (1/6/8)', 'Lead molybdenum sulfide (1/6/8)', 'Molybdenum lead sulfide (6/1/8)', 'Molydenum lead sulfide (6/1/8)']}",-111.7986263,-7.453241753333333,-0.9296348076666656,"['xas', 'bandstructure']",True,"[644107, 644111, 658976, 644103, 644102, 644106, 603595, 644101, 644113]",True,2021-05-12 10:57:17.297000,NM,15,14,mp-555066,,Mo6PbS8,"{'functional': 'PBE', 'labels': ['Mo_pv', 'Pb_d', 'S'], 'pot_type': 'paw'}","{'Mo': 6.0, 'Pb': 1.0, 'S': 8.0}",GGA,mp-555066,"['mp-933723', 'mp-944521', 'mp-943864', 'mp-1103984', 'mp-1103988', 'mp-1104195', 'mp-1104213', 'mp-1104553', 'mp-1104897', 'mp-555066', 'mp-1442630', 'mp-1677735', 'mp-1929843', 'mp-1600772']",0.0043917,"{'Mo': 6.0, 'Pb': 1.0, 'S': 8.0}",288.0192869944107,[],NM,False,148,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.5247937198335002e-05,0.0043917,0,0.0043917,MP,data/source/MP/cleaned/cifs/MP-mp-555066.cif,False,,data/final/MP/graphs/Mo6Pb1S8-MP-mp-555066.json,0,True,-3,0,0,0,0,0,0,2,1,0,0,0,1.0,False
Fe1Se0.075Te0.925,3,0.0749999999999999,2.0,False,Fe2Se0.15Te1.85,Fe2Te2,11.5,Ferrite,True,Fe50Se3.75Te46.25,Fe-Se-Te,3,Supercon,Fe1Te0.925Se0.075,MP-mp-21273,Fe2Te2,Fe-Te,Fe50Te50,P 4/n m m,tetragonal,3.65601,3.65601,6.514508,data/final/MP/cifs/Fe1Se0.075Te0.925-MP-mp-21273-synth_doped.cif,data/source/MP/raw/cifs/mp-21273.cif,mp-21273,0.0,,2015-11-26 15:42:53,6.996625048410066,10.17188/1196541,"@misc{osti_1196541,
    author = ""Persson, Kristin"",
    title = ""Materials Data on FeTe (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196541"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687548'}},0.0764545287500002,6.29104431,520.0,-23.46280856,-5.86570214,"{'tags': ['Iron telluride', 'Iron telluride - beta', 'Iron telluride (1/1)']}",-23.46280856,-5.86570214,-0.2700474499999998,"['xas', 'elasticity', 'bandstructure']",True,"[44753, 633877, 180602, 169974]",True,2021-05-12 10:56:16.728000,FM,4,9,mp-21273,,FeTe,"{'functional': 'PBE', 'labels': ['Fe_pv', 'Te'], 'pot_type': 'paw'}","{'Fe': 1.0, 'Te': 1.0}",GGA,mp-21273,"['mp-991220', 'mp-987578', 'mp-992375', 'mp-21273', 'mp-1439792', 'mp-1687548', 'mp-1800961', 'mp-993959', 'mp-1596778']",1.99364605,"{'Fe': 2.0, 'Te': 2.0}",87.07557914416442,[],FM,True,129,1,"[2.0, 2.0, 0.0, 0.0]",0.0457911637130606,1.99364605,2,3.9872921,MP,data/source/MP/cleaned/cifs/MP-mp-21273.cif,True,,data/final/MP/graphs/Fe1Se0.075Te0.925-MP-mp-21273-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
As2Ba1Ti2O1,1,0.0,1.0,True,As2Ba1Ti2O1,As2Ba1Ti2O1,0.0,Oxide,True,As33.333Ba16.667Ti33.333O16.666666666666668,As-Ba-Ti-O,4,Supercon,Ba1Ti2As2O1,MP-mp-1018735,Ba1Ti2As2O1,As-Ba-Ti-O,As33.333Ba16.667Ti33.333O16.666666666666668,P 4/m m m,tetragonal,4.064971,4.064971,7.367393,data/final/MP/cifs/As2Ba1Ti2O1-MP-mp-1018735.cif,data/source/MP/raw/cifs/mp-1018735.cif,mp-1018735,0.0,,2016-09-26 00:43:59,5.441120109587204,10.17188/1350462,"@article{osti_1350462,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BaTi2As2O (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1350462"",
    place = ""United States"",
    year = ""2017"",
    month = ""4""
}
",{'GGA': {'task_id': 'mp-1699090'}},0.0,5.14962646,520.0,-41.4793002,-6.9132167,{'tags': []},-41.4793002,-6.9132167,-1.6983579202777772,['bandstructure'],True,[169074],True,2021-05-12 10:58:09.072000,NM,6,8,mp-1018735,oxide,BaTi2As2O,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ti_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Ti': 2.0, 'As': 2.0, 'O': 1.0}",GGA,mp-1018735,"['mp-1019369', 'mp-1018735', 'mp-1019191', 'mp-1019021', 'mp-1416985', 'mp-1699090', 'mp-1802874', 'mp-1593599']",0.0042409,"{'Ba': 1.0, 'Ti': 2.0, 'As': 2.0, 'O': 1.0}",121.73872259137336,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0]",3.483608099154244e-05,0.0042409,0,0.0042409,MP,data/source/MP/cleaned/cifs/MP-mp-1018735.cif,False,,data/final/MP/graphs/As2Ba1Ti2O1-MP-mp-1018735.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B2C1Ir2La1,1,0.0,1.0,True,B2C1Ir2La1,B2C1Ir2La1,0.0,Other,True,B33.333C16.667Ir33.333La16.667,B-C-Ir-La,4,Supercon,La1Ir2B2C1,MP-mp-5992,La1B2Ir2C1,B-C-Ir-La,B33.333C16.667Ir33.333La16.667,I 4/m m m,tetragonal,3.8937420019877007,3.8937420019877007,5.933946499999999,data/final/MP/cifs/B2C1Ir2La1-MP-mp-5992.cif,data/source/MP/raw/cifs/mp-5992.cif,mp-5992,0.0,,2011-05-12 23:09:43,11.605105747983783,10.17188/1277219,"@misc{osti_1277219,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaB2Ir2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277219"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700315'}},0.0,8.52623222,520.0,-48.64461138,-8.10743523,{'tags': ['Lanthanum iridium boride carbide (1/2/2/1)']},-48.64461138,-8.10743523,-0.5743631988888881,"['xas', 'bandstructure']",True,"[79567, 78283]",True,2021-05-12 10:57:26.891000,NM,6,8,mp-5992,,LaB2Ir2C,"{'functional': 'PBE', 'labels': ['La', 'B', 'Ir', 'C'], 'pot_type': 'paw'}","{'La': 1.0, 'B': 2.0, 'Ir': 2.0, 'C': 1.0}",GGA,mp-5992,"['mp-1007144', 'mp-5992', 'mp-1000686', 'mp-1442011', 'mp-1700315', 'mp-1800999', 'mp-1011890', 'mp-1594366']",0.0048767,"{'La': 1.0, 'B': 2.0, 'Ir': 2.0, 'C': 1.0}",79.69544331422054,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",6.1191704283171e-05,0.0048767,0,0.0048767,MP,data/source/MP/cleaned/cifs/MP-mp-5992.cif,False,,data/final/MP/graphs/B2C1Ir2La1-MP-mp-5992.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Fe3Lu1.86Sc0.14Si5,2,0.0279999999999999,4.0,False,Fe12Lu7.44Sc0.56Si20,Fe12Lu8Si20,3.51,Other,True,Fe30Lu18.6Sc1.4Si50,Fe-Lu-Sc-Si,4,Supercon,Lu1.86Sc0.14Fe3Si5,MP-mp-541557,Lu8Fe12Si20,Fe-Lu-Si,Fe30Lu20Si50,P 4/m n c,tetragonal,5.385917,10.270814,10.270814,data/final/MP/cifs/Fe3Lu1.86Sc0.14Si5-MP-mp-541557-synth_doped.cif,data/source/MP/raw/cifs/mp-541557.cif,mp-541557,0.0,,2014-03-04 18:23:36,7.69125622397548,10.17188/1265154,"@misc{osti_1265154,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Lu2Fe3Si5 (SG:128) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1265154"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1746411'}},0.0,7.47471245,520.0,-273.951322,-6.84878305,{'tags': ['Lutetium iron silicide (2/3/5)']},-273.951322,-6.84878305,-0.6554334009999998,"['xas', 'bandstructure']",True,"[84198, 247832, 632470]",True,2021-05-12 10:57:10.838000,NM,40,10,mp-541557,,Lu2Fe3Si5,"{'functional': 'PBE', 'labels': ['Lu_3', 'Fe_pv', 'Si'], 'pot_type': 'paw'}","{'Lu': 2.0, 'Fe': 3.0, 'Si': 5.0}",GGA,mp-541557,"['mp-939885', 'mp-916724', 'mp-937397', 'mp-541557', 'mp-1170743', 'mp-1200451', 'mp-1255960', 'mp-1383694', 'mp-1746411', 'mp-1892871']",0.000409375,"{'Lu': 8.0, 'Fe': 12.0, 'Si': 20.0}",568.1583388804236,[],NM,False,90,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",2.8821190994516645e-06,0.000409375,0,0.0016375,MP,data/source/MP/cleaned/cifs/MP-mp-541557.cif,True,,data/final/MP/graphs/Fe3Lu1.86Sc0.14Si5-MP-mp-541557-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B6Y0.99Yb0.01,2,0.0028571428571428,1.0,True,B6Y0.99Yb0.01,B6Y1,0.0,Other,True,B85.714Y14.143Yb0.143,B-Y-Yb,3,Supercon,B6Y0.99Yb0.01,MP-mp-2203,Y1B6,B-Y,B85.714Y14.286,P m -3 m,cubic,4.1021,4.1021,4.1021,data/final/MP/cifs/B6Y0.99Yb0.01-MP-mp-2203-synth_doped.cif,data/source/MP/raw/cifs/mp-2203.cif,mp-2203,0.0,,2011-05-12 20:11:15,3.699194842606093,10.17188/1197299,"@misc{osti_1197299,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YB6 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197299"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686414'}},0.0285229421428576,6.62579631,520.0,-49.33978236,-7.048540337142858,"{'tags': ['Yttrium boride (1/6)', 'Yttrium octahedro-hexaboride', 'Yttrium hexaboride']}",-49.33978236,-7.048540337142858,-0.3995658030952376,"['xas', 'elasticity', 'bandstructure']",True,"[194635, 615723, 54730, 615726, 615714, 659505, 76126, 615728, 615710]",True,2021-05-12 10:56:16.728000,NM,7,9,mp-2203,,YB6,"{'functional': 'PBE', 'labels': ['Y_sv', 'B'], 'pot_type': 'paw'}","{'Y': 1.0, 'B': 6.0}",GGA,mp-2203,"['mp-1000404', 'mp-1006875', 'mp-2203', 'mp-1077859', 'mp-1440131', 'mp-1686414', 'mp-1801281', 'mp-1011609', 'mp-1592923']",3.48e-05,"{'Y': 1.0, 'B': 6.0}",69.026957252261,[],NM,False,221,0,"[0, 0, 0, 0, 0, 0, 0]",5.041508620005138e-07,3.48e-05,0,3.48e-05,MP,data/source/MP/cleaned/cifs/MP-mp-2203.cif,True,,data/final/MP/graphs/B6Y0.99Yb0.01-MP-mp-2203-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
As1F0.3Fe1Nd1O0.7,3,0.15,2.0,False,As2F0.6Fe2Nd2O1.4,As2Fe2Nd2O2,46.0,Ferrite,True,As25F7.5Fe25Nd25O17.5,As-F-Fe-Nd-O,5,Supercon,Nd1Fe1As1F0.3O0.7,MP-mp-622621,Nd2Fe2As2O2,As-Fe-Nd-O,As25Fe25Nd25O25,P 4/n m m,tetragonal,4.074653,4.074653,9.170967,data/final/MP/cifs/As1F0.3Fe1Nd1O0.7-MP-mp-622621-synth_doped.cif,data/source/MP/raw/cifs/mp-622621.cif,mp-622621,0.0,,2014-02-16 22:28:25,6.347279619112142,10.17188/1278150,"@misc{osti_1278150,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NdFeAsO (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278150"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-1677677'}},0.2809314202083302,3.74777613,520.0,-52.70842543,-6.58855317875,{'tags': ['Neodymium iron arsenic oxide (1/1/1/1)']},-52.70842543,-6.58855317875,-1.61299541125,"['xas', 'bandstructure']",True,"[163547, 164679, 422001, 163546, 236651, 236650, 602466, 164680, 164676]",True,2021-05-12 10:57:28.836000,FM,8,8,mp-622621,oxide,NdFeAsO,"{'functional': 'PBE', 'labels': ['Nd_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Nd': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-622621,"['mp-622621', 'mp-1079381', 'mp-1173401', 'mp-1438697', 'mp-1677677', 'mp-1772072', 'mp-1926310', 'mp-1592869']",3.83954265,"{'Nd': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",152.26370404041757,[],FM,True,129,1,"[0.0, 0.0, 3.6, 3.6, -0.0, -0.0, -0.0, -0.0]",0.0504328024094411,3.83954265,2,7.6790853,MP,data/source/MP/cleaned/cifs/MP-mp-622621.cif,True,,data/final/MP/graphs/As1F0.3Fe1Nd1O0.7-MP-mp-622621-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Bi1Pd1,1,0.0,2.0,False,Bi2Pd2,Bi2Pd2,3.746666667,Other,True,Bi50Pd50,Bi-Pd,2,Supercon,Bi1Pd1,MP-mp-1008488,Bi2Pd2,Bi-Pd,Bi50Pd50,P 63/m m c,hexagonal,4.306640002752324,4.30664031,5.795504,data/final/MP/cifs/Bi1Pd1-MP-mp-1008488.cif,data/source/MP/raw/cifs/mp-1008488.cif,mp-1008488,0.0,,2016-09-17 01:43:16,11.2523261137824,10.17188/1325041,"@misc{osti_1325041,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BiPd (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1325041"",
    place = ""United States"",
    year = ""2016"",
    month = ""9"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695273'}},0.0,6.07237172,520.0,-19.42315857,-4.8557896425,"{'tags': ['Sobolevskite', 'Bismuth palladium (1/1)']}",-19.42315857,-4.8557896425,-0.3208315824999994,"['xas', 'elasticity', 'bandstructure']",True,[108171],True,2021-05-12 10:56:08.727000,NM,4,9,mp-1008488,,BiPd,"{'functional': 'PBE', 'labels': ['Bi', 'Pd'], 'pot_type': 'paw'}","{'Bi': 1.0, 'Pd': 1.0}",GGA,mp-1008488,"['mp-1008488', 'mp-1064848', 'mp-1064779', 'mp-1064817', 'mp-1438297', 'mp-1695273', 'mp-1795925', 'mp-1587294', 'mp-1064847']",0.0014413,"{'Bi': 2.0, 'Pd': 2.0}",93.08914095189095,[],NM,False,194,0,"[0, 0, 0, 0]",3.096601784616044e-05,0.0014413,0,0.0028826,MP,data/source/MP/cleaned/cifs/MP-mp-1008488.cif,False,,data/final/MP/graphs/Bi1Pd1-MP-mp-1008488.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Pb0.28Sn0.72,3,0.06,8.0,False,Pb2.24Sn5.76,Pb2Sn6,7.05,Other,True,Pb28Sn72,Pb-Sn,2,Supercon,Pb0.28Sn0.72,MP-mp-1187117,Sn6Pb2,Pb-Sn,Pb25Sn75,P 63/m m c,hexagonal,5.838991,6.7637880024245405,6.7637878,data/final/MP/cifs/Pb0.28Sn0.72-MP-mp-1187117-synth_doped.cif,data/source/MP/raw/cifs/mp-1187117.cif,mp-1187117,0.0,,2019-01-11 14:50:34.045000,8.087114262021451,,,{'GGA': {'task_id': 'mp-1743557'}},0.0527599149999993,7.487631,520.0,-31.06064595,-3.88258074375,{'tags': []},-31.06064595,-3.88258074375,0.0527599149999993,['bandstructure'],True,[],True,2021-05-12 10:58:31.620000,NM,8,5,mp-1187117,,Sn3Pb,"{'functional': 'PBE', 'labels': ['Sn_d', 'Pb_d'], 'pot_type': 'paw'}","{'Sn': 3.0, 'Pb': 1.0}",GGA,mp-1187117,"['mp-1187117', 'mp-1405142', 'mp-1743557', 'mp-1775807', 'mp-1620902']",0.00126025,"{'Sn': 6.0, 'Pb': 2.0}",231.3387549822889,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.0895277793783265e-05,0.00126025,0,0.0025205,MP,data/source/MP/cleaned/cifs/MP-mp-1187117.cif,True,,data/final/MP/graphs/Pb0.28Sn0.72-MP-mp-1187117-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ce1Ir2,1,0.0,2.0,False,Ce2Ir4,Ce2Ir4,0.0,Heavy_fermion,True,Ce33.333Ir66.667,Ce-Ir,2,Supercon,Ce1Ir2,MP-mp-582,Ce2Ir4,Ce-Ir,Ce33.333Ir66.667,F d -3 m,cubic,5.394202259999999,5.394202259999999,5.394202259999999,data/final/MP/cifs/Ce1Ir2-MP-mp-582.cif,data/source/MP/raw/cifs/mp-582.cif,mp-582,0.0,,2011-05-13 08:18:24,15.696372671571046,10.17188/1276929,"@misc{osti_1276929,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeIr2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1276929"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1674264'}},0.0,9.39945928,520.0,-51.99598444,-8.665997406666667,{'tags': ['Cerium iridium (1/2)']},-51.99598444,-8.665997406666667,-0.7960140749999999,"['xas', 'elasticity', 'bandstructure']",True,"[621397, 621407, 621406, 102194, 621398, 621408]",True,2021-05-12 10:56:27.046000,FM,6,8,mp-582,,CeIr2,"{'functional': 'PBE', 'labels': ['Ce', 'Ir'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Ir': 2.0}",GGA,mp-582,"['mp-582', 'mp-931237', 'mp-915532', 'mp-932213', 'mp-1438491', 'mp-1674264', 'mp-1789529', 'mp-1596852']",0.28706875,"{'Ce': 2.0, 'Ir': 4.0}",110.98561248646097,[],FM,True,227,1,"[0.2, 0.2, 0.0, 0.0, 0.0, 0.0]",0.0051730804303128,0.28706875,2,0.5741375,MP,data/source/MP/cleaned/cifs/MP-mp-582.cif,False,,data/final/MP/graphs/Ce1Ir2-MP-mp-582.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Fe0.36Ni0.64Zr2,3,0.0933333333333333,2.0,False,Fe0.72Ni1.28Zr4,Fe1Ni1Zr4,2.04,Other,True,Fe12Ni21.333Zr66.667,Fe-Ni-Zr,3,Supercon,Fe0.36Ni0.64Zr2,MP-mp-1215366,Zr4Fe1Ni1,Fe-Ni-Zr,Fe16.667Ni16.667Zr66.667,I 4 2 2,tetragonal,5.277062429600079,5.27706243,5.27706243,data/final/MP/cifs/Fe0.36Ni0.64Zr2-MP-mp-1215366-synth_doped.cif,data/source/MP/raw/cifs/mp-1215366.cif,mp-1215366,0.0,,2019-01-12 17:04:02.444000,7.137405118353338,,,{'GGA': {'task_id': 'mp-1735927'}},0.0198735593333339,4.811196,520.0,-49.72189863,-8.286983105,{'tags': []},-49.72189863,-8.286983105,-0.21349183,['bandstructure'],True,[],True,2021-05-12 10:58:39.488000,FM,6,5,mp-1215366,,Zr4FeNi,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Fe_pv', 'Ni_pv'], 'pot_type': 'paw'}","{'Zr': 4.0, 'Fe': 1.0, 'Ni': 1.0}",GGA,mp-1215366,"['mp-1215366', 'mp-1445478', 'mp-1735927', 'mp-1803005', 'mp-1627881']",0.2630035,"{'Zr': 4.0, 'Fe': 1.0, 'Ni': 1.0}",111.54187521523264,[],FM,True,97,1,"[0.0, 0.0, 0.0, 0.0, 0.3, 0.0]",0.0023578902496708,0.2630035,1,0.2630035,MP,data/source/MP/cleaned/cifs/MP-mp-1215366.cif,True,,data/final/MP/graphs/Fe0.36Ni0.64Zr2-MP-mp-1215366-synth_doped.json,0,True,422,0,0,0,0,4,0,0,0,0,1,0,1.0,False
Mo0.28O0.72,3,0.1066666666666666,3.0,False,Mo0.84O2.16,Mo1O2,0.0,Oxide,True,Mo28O72,Mo-O,2,Supercon,Mo0.28O0.72,MP-mp-714883,Mo1O2,Mo-O,Mo33.333O66.66666666666667,C 1 2/m 1,monoclinic,3.124898002799557,3.24730029,5.009238733292867,data/final/MP/cifs/Mo0.28O0.72-MP-mp-714883-synth_doped.cif,data/source/MP/raw/cifs/mp-714883.cif,mp-714883,1.0252,,2013-12-31 06:05:40,5.106622183369134,10.17188/1286641,"@misc{osti_1286641,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MoO2 (SG:12) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1286641"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-1764195'}},0.2098912291666668,3.115308,520.0,-21.60039489,-7.20013163,{'tags': []},-21.60039489,-7.20013163,-1.8116099500000007,['bandstructure'],True,[],True,2021-05-12 10:58:53.520000,FM,3,8,mp-714883,oxide,MoO2,"{'functional': 'PBE', 'labels': ['Mo_pv', 'O'], 'pot_type': 'paw'}","{'Mo': 1.0, 'O': 2.0}",GGA+U,mp-714883,"['mp-796215', 'mp-714883', 'mp-796607', 'mp-1390939', 'mp-1764195', 'mp-1792508', 'mp-797343', 'mp-1617940']",2.0000438,"{'Mo': 1.0, 'O': 2.0}",41.60232887911833,[],FM,True,12,1,"[1.9, 0.0, 0.0]",0.0480752845786931,2.0000438,1,2.0000438,MP,data/source/MP/cleaned/cifs/MP-mp-714883.cif,True,,data/final/MP/graphs/Mo0.28O0.72-MP-mp-714883-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
Sn3Y5,1,0.0,2.0,False,Sn6Y10,Sn6Y10,0.0,Other,True,Sn37.5Y62.5,Sn-Y,2,Supercon,Sn3Y5,MP-mp-567412,Y10Sn6,Sn-Y,Sn37.5Y62.5,P 63/m c m,hexagonal,6.583425,8.983593997716387,8.98359346,data/final/MP/cifs/Sn3Y5-MP-mp-567412.cif,data/source/MP/raw/cifs/mp-567412.cif,mp-567412,0.0,,2014-02-24 18:25:12,5.778885589240009,10.17188/1273858,"@misc{osti_1273858,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Y5Sn3 (SG:193) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1273858"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1709092'}},0.0,5.08684958,520.0,-101.04302832,-6.31518927,"{'tags': ['Tin yttrium (3/5)', 'Yttrium stannide (5/3)']}",-101.04302832,-6.31518927,-0.7700553785416675,"['xas', 'elasticity', 'bandstructure']",True,"[106103, 652833, 652839]",True,2021-05-12 10:56:22.739000,NM,16,8,mp-567412,,Y5Sn3,"{'functional': 'PBE', 'labels': ['Y_sv', 'Sn_d'], 'pot_type': 'paw'}","{'Y': 5.0, 'Sn': 3.0}",GGA,mp-567412,"['mp-932842', 'mp-942105', 'mp-943110', 'mp-567412', 'mp-1430460', 'mp-1709092', 'mp-1815565', 'mp-1607422']",0.0074451,"{'Y': 10.0, 'Sn': 6.0}",460.1323016794676,[],NM,False,193,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.2360692665242724e-05,0.0074451,0,0.0148902,MP,data/source/MP/cleaned/cifs/MP-mp-567412.cif,False,,data/final/MP/graphs/Sn3Y5-MP-mp-567412.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Hf0.7V2Zr0.3,3,0.1333333333333333,2.0,False,Hf1.4V4Zr0.6,Hf1V4Zr1,9.96,Other,True,Hf23.333V66.667Zr10,Hf-V-Zr,3,Supercon,Zr0.3Hf0.7V2,MP-mp-1224085,Hf1Zr1V4,Hf-V-Zr,Hf16.667V66.667Zr16.667,F -4 3 m,cubic,5.18701573,5.187015729999999,5.187015729999999,data/final/MP/cifs/Hf0.7V2Zr0.3-MP-mp-1224085-synth_doped.cif,data/source/MP/raw/cifs/mp-1224085.cif,mp-1224085,0.0,,2019-01-13 00:23:09.162000,7.967334263158579,,,{'GGA': {'task_id': 'mp-1756967'}},0.0410283783333351,5.00695262,520.0,-54.59434349,-9.099057248333333,{'tags': []},-54.59434349,-9.099057248333333,0.0410283783333322,['bandstructure'],True,[],True,2021-05-12 10:58:45.495000,FM,6,5,mp-1224085,,HfZrV4,"{'functional': 'PBE', 'labels': ['Hf_pv', 'Zr_sv', 'V_pv'], 'pot_type': 'paw'}","{'Hf': 1.0, 'Zr': 1.0, 'V': 4.0}",GGA,mp-1224085,"['mp-1224085', 'mp-1444296', 'mp-1756967', 'mp-1796002', 'mp-1624522']",0.362572,"{'Hf': 1.0, 'Zr': 1.0, 'V': 4.0}",98.68194446031352,[],FM,True,160,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.1]",0.0036741473020509,0.362572,3,0.362572,MP,data/source/MP/cleaned/cifs/MP-mp-1224085.cif,True,,data/final/MP/graphs/Hf0.7V2Zr0.3-MP-mp-1224085-synth_doped.json,0,True,-43m,5,0,0,0,0,0,0,0,0,0,1,1.0,False
Mo0.202Zr0.798,2,0.004,10.0,False,Mo2.02Zr7.98,Mo2Zr8,5.25,Other,True,Mo20.2Zr79.8,Mo-Zr,2,Supercon,Mo0.202Zr0.798,MP-mp-1207454,Zr8Mo2,Mo-Zr,Mo20Zr80,F d -3 m,cubic,7.0560828,7.0560828,7.0560828,data/final/MP/cifs/Mo0.202Zr0.798-MP-mp-1207454-synth_doped.cif,data/source/MP/raw/cifs/mp-1207454.cif,mp-1207454,0.0,,2019-01-12 10:33:39.471000,6.160975519984532,,,{'GGA': {'task_id': 'mp-1744128'}},0.9514992149999985,3.91284758,520.0,-80.97364846,-8.097364846000001,"{'tags': ['MgCu2', 'ZrMo2 rt', 'Friauf-Laves phase, Frank-Kasper phase']}",-80.97364846,-8.097364846000001,0.9099242639999986,[],False,[],True,2021-05-12 11:00:19.396000,NM,10,4,mp-1207454,,Zr4Mo,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Mo_pv'], 'pot_type': 'paw'}","{'Zr': 4.0, 'Mo': 1.0}",GGA,mp-1207454,"['mp-1207454', 'mp-1408901', 'mp-1744128', 'mp-1928538']",0.0042847,"{'Zr': 8.0, 'Mo': 2.0}",248.41396587714368,[],NM,False,227,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",3.449645018846527e-05,0.0042847,0,0.0085694,MP,data/source/MP/cleaned/cifs/MP-mp-1207454.cif,True,,data/final/MP/graphs/Mo0.202Zr0.798-MP-mp-1207454-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Cu0.25Pd49.75Sb50,3,0.005,0.04,False,Cu0.01Pd1.99Sb2,Pd2Sb2,1.56,Other,True,Cu0.25Pd49.75Sb50,Cu-Pd-Sb,3,Supercon,Pd49.75Cu0.25Sb50,MP-mp-1769,Sb2Pd2,Pd-Sb,Pd50Sb50,P 63/m m c,hexagonal,4.14379200150878,4.14379188,5.681682,data/final/MP/cifs/Cu0.25Pd49.75Sb50-MP-mp-1769-synth_doped.cif,data/source/MP/raw/cifs/mp-1769.cif,mp-1769,0.0,,2011-05-12 20:23:42,8.969190247481327,10.17188/1192632,"@misc{osti_1192632,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SbPd (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1192632"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672236'}},0.0,7.23050119,520.0,-20.38401466,-5.096003665,"{'tags': ['Palladium antimony (1/1)', 'Sudburyite', 'Palladium antimony', 'Palladium antimonide (1/1)']}",-20.38401466,-5.096003665,-0.5375621399999995,"['xas', 'elasticity', 'bandstructure']",True,"[648770, 42598, 648779, 42597]",True,2021-05-12 10:56:14.760000,NM,4,8,mp-1769,,SbPd,"{'functional': 'PBE', 'labels': ['Sb', 'Pd'], 'pot_type': 'paw'}","{'Sb': 1.0, 'Pd': 1.0}",GGA,mp-1769,"['mp-924880', 'mp-925511', 'mp-909858', 'mp-1769', 'mp-1439686', 'mp-1672236', 'mp-1802229', 'mp-1586197']",0.0044707,"{'Sb': 2.0, 'Pd': 2.0}",84.4896347968957,[],NM,False,194,0,"[0, 0, 0, 0]",0.0001058283660651,0.0044707,0,0.0089414,MP,data/source/MP/cleaned/cifs/MP-mp-1769.cif,True,,data/final/MP/graphs/Cu0.25Pd49.75Sb50-MP-mp-1769-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ir0.7Rh0.3,3,0.1,4.0,False,Ir2.8Rh1.2,Ir3Rh1,0.0,Other,True,Ir70Rh30,Ir-Rh,2,Supercon,Ir0.7Rh0.3,MP-mp-1184771,Ir3Rh1,Ir-Rh,Ir75Rh25,P m -3 m,cubic,3.869173,3.869173,3.869173,data/final/MP/cifs/Ir0.7Rh0.3-MP-mp-1184771-synth_doped.cif,data/source/MP/raw/cifs/mp-1184771.cif,mp-1184771,0.0,,2019-01-11 13:02:54.339000,19.48140265952555,,,{'GGA': {'task_id': 'mp-1733856'}},0.0094591199999989,9.11965125,520.0,-33.92588706,-8.481471765,{'tags': []},-33.92588706,-8.481471765,-0.0115719825000013,['bandstructure'],True,[],True,2021-05-12 10:58:27.755000,NM,4,5,mp-1184771,,Ir3Rh,"{'functional': 'PBE', 'labels': ['Ir', 'Rh_pv'], 'pot_type': 'paw'}","{'Ir': 3.0, 'Rh': 1.0}",GGA,mp-1184771,"['mp-1184771', 'mp-1415898', 'mp-1733856', 'mp-1795000', 'mp-1618109']",0.0007013,"{'Ir': 3.0, 'Rh': 1.0}",57.92345325095008,[],NM,False,221,0,"[0, 0, 0, 0]",1.2107358257140806e-05,0.0007013,0,0.0007013,MP,data/source/MP/cleaned/cifs/MP-mp-1184771.cif,True,,data/final/MP/graphs/Ir0.7Rh0.3-MP-mp-1184771-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ce0.002La0.998Pt1Si1,2,0.0013333333333333,2.0,False,Ce0.004La1.996Pt2Si2,La2Pt2Si2,0.0,Other,True,Ce0.067La33.267Pt33.333Si33.333,Ce-La-Pt-Si,4,Supercon,La0.998Ce0.002Pt1Si1,MP-mp-1206485,La2Si2Pt2,La-Pt-Si,La33.333Pt33.333Si33.333,I 41 m d,tetragonal,4.277808001286174,4.277808001286175,7.94541446,data/final/MP/cifs/Ce0.002La0.998Pt1Si1-MP-mp-1206485-synth_doped.cif,data/source/MP/raw/cifs/mp-1206485.cif,mp-1206485,0.0,,2019-01-12 09:47:13.211000,8.943745313538361,,,{'GGA': {'task_id': 'mp-1734531'}},0.0,7.90579938,520.0,-39.77896993,-6.629828321666667,{'tags': ['LaPtSi']},-39.77896993,-6.629828321666667,-1.1287520433333331,['bandstructure'],True,[],True,2021-05-12 10:58:37.524000,NM,6,5,mp-1206485,,LaSiPt,"{'functional': 'PBE', 'labels': ['La', 'Si', 'Pt'], 'pot_type': 'paw'}","{'La': 1.0, 'Si': 1.0, 'Pt': 1.0}",GGA,mp-1206485,"['mp-1206485', 'mp-1387492', 'mp-1734531', 'mp-1788111', 'mp-1628393']",1.825e-05,"{'La': 2.0, 'Si': 2.0, 'Pt': 2.0}",134.4491846861766,[],NM,False,109,0,"[0, 0, 0, 0, 0, 0]",2.714780315343388e-07,1.825e-05,0,3.65e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1206485.cif,True,,data/final/MP/graphs/Ce0.002La0.998Pt1Si1-MP-mp-1206485-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,0,0,1,0,1.0,False
Pd1Sn1,1,0.0,4.0,False,Pd4Sn4,Pd4Sn4,0.41,Other,True,Pd50Sn50,Pd-Sn,2,Supercon,Pd1Sn1,MP-mp-2369,Sn4Pd4,Pd-Sn,Pd50Sn50,P n m a,orthorhombic,3.909425,6.336056,6.460662,data/final/MP/cifs/Pd1Sn1-MP-mp-2369.cif,data/source/MP/raw/cifs/mp-2369.cif,mp-2369,0.0,,2011-05-14 15:06:53,9.344015419425425,10.17188/1183682,"@misc{osti_1183682,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SnPd (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1183682"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695568'}},0.0,7.66668448,520.0,-41.01233581,-5.12654197625,{'tags': ['Palladium tin (1/1)']},-41.01233581,-5.12654197625,-0.5318151437500003,"['xas', 'elasticity', 'bandstructure']",True,"[109415, 648928, 184999, 105683, 185000, 648929]",True,2021-05-12 10:56:16.728000,NM,8,10,mp-2369,,SnPd,"{'functional': 'PBE', 'labels': ['Sn_d', 'Pd'], 'pot_type': 'paw'}","{'Sn': 1.0, 'Pd': 1.0}",GGA,mp-2369,"['mp-905055', 'mp-919390', 'mp-918392', 'mp-2369', 'mp-1079722', 'mp-1080780', 'mp-1416307', 'mp-1695568', 'mp-1778714', 'mp-1596145']",3.25e-06,"{'Sn': 4.0, 'Pd': 4.0}",160.03276676383982,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0]",8.123336403465477e-08,3.25e-06,0,1.3e-05,MP,data/source/MP/cleaned/cifs/MP-mp-2369.cif,False,,data/final/MP/graphs/Pd1Sn1-MP-mp-2369.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ca0.3Sr0.7Ti1O3,3,0.12,1.0,True,Ca0.3Sr0.7Ti1O3,Sr1Ti1O3,0.525,Oxide,True,Ca6Sr14Ti20O60,Ca-Sr-Ti-O,4,Supercon,Sr0.7Ca0.3Ti1O3,MP-mp-551830,Sr2Ti2O6,Sr-Ti-O,Sr20Ti20O60,P m -3 m,cubic,3.942851452350787,3.942851452692745,3.9464989993092807,data/final/MP/cifs/Ca0.3Sr0.7Ti1O3-MP-mp-551830-synth_doped.cif,data/source/MP/raw/cifs/mp-551830.cif,mp-551830,1.7869999999999997,,2014-02-21 05:23:00,4.966121139868444,,,{'GGA': {'task_id': 'mp-1759822'}},0.0005822479999988,3.22413565,520.0,-80.25240668,-8.025240668,{'tags': []},-80.25240668,-8.025240668,-3.551666971000001,"['bandstructure', 'elasticity']",True,[],True,2021-05-12 10:56:22.739000,NM,10,4,mp-551830,oxide,SrTiO3,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ti_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Ti': 1.0, 'O': 3.0}",GGA,mp-551830,"['mp-551830', 'mp-1406736', 'mp-1759822', 'mp-1627898']",0.00106425,"{'Sr': 2.0, 'Ti': 2.0, 'O': 6.0}",122.70515928291898,[],NM,False,221,0,"[0, 0, 0, 0, 0]",1.7346458881100164e-05,0.00106425,0,0.0021285,MP,data/source/MP/cleaned/cifs/MP-mp-551830.cif,True,,data/final/MP/graphs/Ca0.3Sr0.7Ti1O3-MP-mp-551830-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
As2Fe1.82Ni0.18Sr1,3,0.0719999999999999,1.0,True,As2Fe1.82Ni0.18Sr1,As2Fe2Sr1,9.6,Ferrite,True,As40Fe36.4Ni3.6Sr20,As-Fe-Ni-Sr,4,Supercon,Sr1Fe1.82Ni0.18As2,MP-mp-4488,Sr1Fe2As2,As-Fe-Sr,As40Fe40Sr20,I 4/m m m,tetragonal,3.9729799997357778,3.9729799997357778,6.45523327,data/final/MP/cifs/As2Fe1.82Ni0.18Sr1-MP-mp-4488-synth_doped.cif,data/source/MP/raw/cifs/mp-4488.cif,mp-4488,0.0,,2011-05-13 03:37:13,6.319998834487784,10.17188/1208187,"@misc{osti_1208187,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr(FeAs)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208187"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672865'}},0.0,5.13397273,520.0,-30.61898897,-6.123797794,"{'tags': ['Strontium diiron arsenide - HT', 'Strontium diiron arsenide', 'Strontium diiron diarsenide', 'Iron strontium arsenide (2/1/2)', 'Strontium diiron arsenide - LT']}",-30.61898897,-6.123797794,-0.5342483613333335,"['xas', 'elasticity', 'bandstructure']",True,"[182330, 181993, 610527, 163209, 163208, 163869]",True,2021-05-12 10:56:20.740000,NM,5,8,mp-4488,,Sr(FeAs)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Fe': 2.0, 'As': 2.0}",GGA,mp-4488,"['mp-906356', 'mp-920135', 'mp-919110', 'mp-4488', 'mp-1439153', 'mp-1672865', 'mp-1873948', 'mp-1592272']",0.0029206,"{'Sr': 1.0, 'Fe': 2.0, 'As': 2.0}",91.7377588211838,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",3.183640016422098e-05,0.0029206,0,0.0029206,MP,data/source/MP/cleaned/cifs/MP-mp-4488.cif,True,,data/final/MP/graphs/As2Fe1.82Ni0.18Sr1-MP-mp-4488-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Nb1O1,1,0.0,3.0,False,Nb3O3,Nb3O3,1.38,Oxide,True,Nb50O50,Nb-O,2,Supercon,Nb1O1,MP-mp-2311,Nb3O3,Nb-O,Nb50O50,P m -3 m,cubic,4.261457,4.261457,4.261457,data/final/MP/cifs/Nb1O1-MP-mp-2311.cif,data/source/MP/raw/cifs/mp-2311.cif,mp-2311,0.0,,2011-05-13 03:26:59,7.010467016007708,10.17188/1199242,"@misc{osti_1199242,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbO (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199242"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672446'}},0.0,5.99167739,520.0,-56.81272782,-9.46878797,"{'tags': ['Niobium(II) oxide', 'Niobium oxide (1/1)']}",-56.81272782,-9.46878797,-2.2876549475,"['xas', 'elasticity', 'bandstructure']",True,"[645133, 27574, 29121, 14338, 237585, 40318]",True,2021-05-12 10:56:16.728000,NM,6,10,mp-2311,oxide,NbO,"{'functional': 'PBE', 'labels': ['Nb_pv', 'O'], 'pot_type': 'paw'}","{'Nb': 1.0, 'O': 1.0}",GGA,mp-2311,"['mp-991099', 'mp-993068', 'mp-2311', 'mp-1077435', 'mp-32158', 'mp-1439680', 'mp-1672446', 'mp-1801368', 'mp-994383', 'mp-1595116']",3.2800000000000004e-05,"{'Nb': 3.0, 'O': 3.0}",77.3881262927032,[],NM,False,221,0,"[0, 0, 0, 0, 0, 0]",1.2715128885253548e-06,3.2800000000000004e-05,0,9.84e-05,MP,data/source/MP/cleaned/cifs/MP-mp-2311.cif,False,,data/final/MP/graphs/Nb1O1-MP-mp-2311.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ir1.8Os0.2Th1,3,0.1333333333333333,2.0,False,Ir3.6Os0.4Th2,Ir4Th2,5.66,Other,True,Ir60Os6.667Th33.333,Ir-Os-Th,3,Supercon,Th1Ir1.8Os0.2,MP-mp-1187,Th2Ir4,Ir-Th,Ir66.667Th33.333,F d -3 m,cubic,5.45579126,5.45579126,5.45579126,data/final/MP/cifs/Ir1.8Os0.2Th1-MP-mp-1187-synth_doped.cif,data/source/MP/raw/cifs/mp-1187.cif,mp-1187,0.0,,2011-05-13 08:24:56,17.82929828099463,10.17188/1188440,"@misc{osti_1188440,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ThIr2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188440"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1674377'}},0.0,9.20830531,520.0,-55.18109661,-9.196849435,"{'tags': ['Iridium thorium (2/1)', 'Thorium iridium (1/2)']}",-55.18109661,-9.196849435,-0.8332764049999994,"['xas', 'elasticity', 'bandstructure']",True,"[104572, 641099, 641106, 104571, 641094, 150742, 641102]",True,2021-05-12 10:56:12.755000,NM,6,8,mp-1187,,ThIr2,"{'functional': 'PBE', 'labels': ['Th', 'Ir'], 'pot_type': 'paw'}","{'Th': 1.0, 'Ir': 2.0}",GGA,mp-1187,"['mp-990623', 'mp-1187', 'mp-914552', 'mp-1439466', 'mp-1674377', 'mp-1803101', 'mp-992717', 'mp-1597100']",0.00093205,"{'Th': 2.0, 'Ir': 4.0}",114.83076035455412,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",1.6233455166928805e-05,0.00093205,0,0.0018641,MP,data/source/MP/cleaned/cifs/MP-mp-1187.cif,True,,data/final/MP/graphs/Ir1.8Os0.2Th1-MP-mp-1187-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ta0.53Ti0.47,3,0.06,2.0,False,Ta1.06Ti0.94,Ta1Ti1,0.0,Other,True,Ta53Ti47,Ta-Ti,2,Supercon,Ta0.53Ti0.47,MP-mp-1217887,Ta1Ti1,Ta-Ti,Ta50Ti50,C m m m,orthorhombic,2.83159279,2.83159221,4.659713,data/final/MP/cifs/Ta0.53Ti0.47-MP-mp-1217887-synth_doped.cif,data/source/MP/raw/cifs/mp-1217887.cif,mp-1217887,0.0,,2019-01-12 19:08:56.125000,10.746615063570298,,,{'GGA': {'task_id': 'mp-1675318'}},0.0605979833333325,5.58352202,520.0,-19.63207368,-9.81603684,{'tags': []},-19.63207368,-9.81603684,0.0605979833333325,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,2,5,mp-1217887,,TaTi,"{'functional': 'PBE', 'labels': ['Ta_pv', 'Ti_pv'], 'pot_type': 'paw'}","{'Ta': 1.0, 'Ti': 1.0}",GGA,mp-1217887,"['mp-1217887', 'mp-1425780', 'mp-1675318', 'mp-1790597', 'mp-1611384']",0.0591736,"{'Ta': 1.0, 'Ti': 1.0}",35.35588136467223,[],NM,False,65,0,"[0, 0]",0.0016736564813549,0.0591736,0,0.0591736,MP,data/source/MP/cleaned/cifs/MP-mp-1217887.cif,True,,data/final/MP/graphs/Ta0.53Ti0.47-MP-mp-1217887-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ge0.976Te1,2,0.0121457489878542,1.0,True,Ge0.976Te1,Ge1Te1,0.0855,Other,True,Ge49.393Te50.607,Ge-Te,2,Supercon,Ge0.976Te1,MP-mp-938,Ge1Te1,Ge-Te,Ge50Te50,R 3 m,trigonal,4.2306661843580935,4.2306661843580935,4.37516386,data/final/MP/cifs/Ge0.976Te1-MP-mp-938-synth_doped.cif,data/source/MP/raw/cifs/mp-938.cif,mp-938,0.8215000000000003,,2011-05-12 18:44:01,5.9096523360046005,10.17188/1272924,"@misc{osti_1272924,
    author = ""Persson, Kristin"",
    title = ""Materials Data on GeTe (SG:160) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1272924"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668824'}},0.0,5.39520466,520.0,-7.95077254,-3.97538627,"{'tags': ['Germanium telluride', 'Germanium telluride (1/1) - alpha', 'Germanium(II) telluride', 'Germanium telluride (1/1)']}",-7.95077254,-3.97538627,-0.3032218774999995,"['piezo', 'xas', 'bandstructure', 'diel', 'elasticity']",True,"[159907, 188458, 56039, 56040, 56041, 659806, 659808, 43202, 655497, 659805, 165414, 56038]",True,2021-05-12 10:56:35.166000,NM,2,20,mp-938,,GeTe,"{'functional': 'PBE', 'labels': ['Ge_d', 'Te'], 'pot_type': 'paw'}","{'Ge': 1.0, 'Te': 1.0}",GGA,mp-938,"['mp-655245', 'mp-655250', 'mp-655231', 'mp-938', 'mp-1057193', 'mp-1057199', 'mp-1057210', 'mp-1060737', 'mp-1060747', 'mp-1060770', 'mp-1141488', 'mp-1119920', 'mp-1440604', 'mp-1668824', 'mp-1790742', 'mp-1863530', 'mp-1595868', 'mp-1596468', 'mp-1057206', 'mp-1060757']",1.27e-05,"{'Ge': 1.0, 'Te': 1.0}",56.264958374993846,[],NM,False,160,0,"[0, 0]",2.257177534080312e-07,1.27e-05,0,1.27e-05,MP,data/source/MP/cleaned/cifs/MP-mp-938.cif,True,,data/final/MP/graphs/Ge0.976Te1-MP-mp-938-synth_doped.json,0,True,3m,0,0,0,0,0,0,5,1,0,0,0,1.0,False
Ir0.7Re0.3,3,0.1,8.0,False,Ir5.6Re2.4,Ir6Re2,1.7,Other,True,Ir70Re30,Ir-Re,2,Supercon,Ir0.7Re0.3,MP-mp-867792,Re2Ir6,Ir-Re,Ir75Re25,P 63/m m c,hexagonal,4.398325,5.539354000417853,5.53935462,data/final/MP/cifs/Ir0.7Re0.3-MP-mp-867792-synth_doped.cif,data/source/MP/raw/cifs/mp-867792.cif,mp-867792,0.0,,2014-10-19 22:58:25,21.67636943705842,10.17188/1312161,"@misc{osti_1312161,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ReIr3 (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1312161"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1750841'}},0.0,9.71710215,520.0,-79.13783465,-9.89222933125,{'tags': []},-79.13783465,-9.89222933125,-0.1522747200000012,"['xas', 'elasticity', 'bandstructure']",True,[],True,2021-05-12 10:56:33.121000,NM,8,8,mp-867792,,ReIr3,"{'functional': 'PBE', 'labels': ['Re_pv', 'Ir'], 'pot_type': 'paw'}","{'Re': 1.0, 'Ir': 3.0}",GGA,mp-867792,"['mp-867792', 'mp-1055385', 'mp-1055429', 'mp-1393279', 'mp-1750841', 'mp-1805345', 'mp-1618753', 'mp-1055432']",7.65e-06,"{'Re': 2.0, 'Ir': 6.0}",116.87893721747226,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.3090468106782886e-07,7.65e-06,0,1.53e-05,MP,data/source/MP/cleaned/cifs/MP-mp-867792.cif,True,,data/final/MP/graphs/Ir0.7Re0.3-MP-mp-867792-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
B2Rh3Sm1,1,0.0,1.0,True,B2Rh3Sm1,B2Rh3Sm1,0.0,Other,True,B33.333Rh50Sm16.667,B-Rh-Sm,3,Supercon,Sm1Rh3B2,MP-mp-2947,Sm1B2Rh3,B-Rh-Sm,B33.333Rh50Sm16.667,P 6/m m m,hexagonal,3.135946,5.478314001148592,5.478313920000001,data/final/MP/cifs/B2Rh3Sm1-MP-mp-2947.cif,data/source/MP/raw/cifs/mp-2947.cif,mp-2947,0.0,,2011-05-13 09:35:10,9.793294700935258,10.17188/1203952,"@misc{osti_1203952,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SmB2Rh3 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1203952"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677459'}},0.0,5.9413408,520.0,-44.22411554,-7.370685923333333,{'tags': ['Rhodium samarium boride (3/1/2)']},-44.22411554,-7.370685923333333,-0.6756370422222228,"['xas', 'elasticity', 'bandstructure']",True,"[615315, 615313, 615310, 44564]",True,2021-05-12 10:56:18.721000,NM,6,8,mp-2947,,SmB2Rh3,"{'functional': 'PBE', 'labels': ['Sm_3', 'B', 'Rh_pv'], 'pot_type': 'paw'}","{'Sm': 1.0, 'B': 2.0, 'Rh': 3.0}",GGA,mp-2947,"['mp-910295', 'mp-2947', 'mp-926147', 'mp-925743', 'mp-1437905', 'mp-1677459', 'mp-1801892', 'mp-1596709']",0.0001681,"{'Sm': 1.0, 'B': 2.0, 'Rh': 3.0}",81.50664948638688,[],NM,False,191,0,"[0, 0, 0, 0, 0, 0]",2.0624084177092303e-06,0.0001681,0,0.0001681,MP,data/source/MP/cleaned/cifs/MP-mp-2947.cif,False,,data/final/MP/graphs/B2Rh3Sm1-MP-mp-2947.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ba1Bi3,1,0.0,1.0,True,Ba1Bi3,Ba1Bi3,5.745,Other,True,Ba25Bi75,Ba-Bi,2,Supercon,Ba1Bi3,MP-mp-23201,Ba1Bi3,Ba-Bi,Ba25Bi75,P m -3 m,cubic,5.176967,5.176967,5.176967,data/final/MP/cifs/Ba1Bi3-MP-mp-23201.cif,data/source/MP/raw/cifs/mp-23201.cif,mp-23201,0.0,,2014-02-21 07:26:44,9.146789767071224,10.17188/1199320,"@misc{osti_1199320,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BaBi3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199320"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699504'}},0.0179925612500002,5.01549614,520.0,-15.43241612,-3.85810403,{'tags': ['Barium bismuth (1/3)']},-15.43241612,-3.85810403,-0.4608355900000003,"['xas', 'elasticity', 'bandstructure']",True,"[615782, 58634]",True,2021-05-12 10:56:16.728000,NM,4,8,mp-23201,,BaBi3,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Bi'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Bi': 3.0}",GGA,mp-23201,"['mp-991392', 'mp-993335', 'mp-23201', 'mp-1441824', 'mp-1699504', 'mp-1935094', 'mp-994643', 'mp-1597081']",0.0024583,"{'Ba': 1.0, 'Bi': 3.0}",138.74782691834224,[],NM,False,221,0,"[0, 0, 0, 0]",1.771775497029436e-05,0.0024583,0,0.0024583,MP,data/source/MP/cleaned/cifs/MP-mp-23201.cif,False,,data/final/MP/graphs/Ba1Bi3-MP-mp-23201.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ge3Nb5,1,0.0,2.0,False,Ge6Nb10,Ge6Nb10,0.303333333,Other,True,Ge37.5Nb62.5,Ge-Nb,2,Supercon,Ge3Nb5,MP-mp-1188215,Nb10Ge6,Ge-Nb,Ge37.5Nb62.5,I 4/m c m,tetragonal,6.734650000000001,6.73465,7.679396248237487,data/final/MP/cifs/Ge3Nb5-MP-mp-1188215.cif,data/source/MP/raw/cifs/mp-1188215.cif,mp-1188215,0.0,,2019-01-11 19:16:29.003000,8.294600189831986,,,,0.0,5.69466353,520.0,-136.43086855,-8.526929284375,{'tags': ['Niobium germanide (5/3)']},-136.43086855,-8.526929284375,-0.4799781887500014,[],False,[600642],True,2021-05-12 10:59:52.436000,NM,16,3,mp-1188215,,Nb5Ge3,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Ge_d'], 'pot_type': 'paw'}","{'Nb': 5.0, 'Ge': 3.0}",GGA,mp-1188215,"['mp-1188215', 'mp-1872341', 'mp-1984868']",0.00178545,"{'Nb': 10.0, 'Ge': 6.0}",273.2471764979311,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.3068387552129151e-05,0.00178545,0,0.0035709,MP,data/source/MP/cleaned/cifs/MP-mp-1188215.cif,False,,data/final/MP/graphs/Ge3Nb5-MP-mp-1188215.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Co1La3,1,0.0,4.0,False,Co4La12,Co4La12,4.226666667,Other,True,Co25La75,Co-La,2,Supercon,Co1La3,MP-mp-640095,La12Co4,Co-La,Co25La75,P n m a,orthorhombic,6.535868,7.058111,10.044587,data/final/MP/cifs/Co1La3-MP-mp-640095.cif,data/source/MP/raw/cifs/mp-640095.cif,mp-640095,0.0,,2013-06-24 23:31:19,6.818241629176538,10.17188/1279902,"@misc{osti_1279902,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La3Co (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1279902"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1675998'}},0.0,8.10130467,520.0,-89.28791482,-5.58049467625,{'tags': ['Lanthanum cobalt (3/1)']},-89.28791482,-5.58049467625,-0.10140989875,"['xas', 'elasticity', 'bandstructure']",True,"[623980, 624005, 623997, 603189, 150531]",True,2021-05-12 10:56:27.046000,NM,16,8,mp-640095,,La3Co,"{'functional': 'PBE', 'labels': ['La', 'Co'], 'pot_type': 'paw'}","{'La': 3.0, 'Co': 1.0}",GGA,mp-640095,"['mp-640095', 'mp-930826', 'mp-914027', 'mp-1381441', 'mp-1675998', 'mp-1815949', 'mp-977718', 'mp-1637853']",1.5e-06,"{'La': 12.0, 'Co': 4.0}",463.3656558814268,[],NM,False,62,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",1.2948736972287331e-08,1.5e-06,0,6e-06,MP,data/source/MP/cleaned/cifs/MP-mp-640095.cif,False,,data/final/MP/graphs/Co1La3-MP-mp-640095.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Al2Ca1,1,0.0,2.0,False,Al4Ca2,Al4Ca2,0.0,Other,True,Al66.667Ca33.333,Al-Ca,2,Supercon,Al2Ca1,MP-mp-2404,Ca2Al4,Al-Ca,Al66.667Ca33.333,F d -3 m,cubic,5.66825847,5.668258469999999,5.668258469999999,data/final/MP/cifs/Al2Ca1-MP-mp-2404.cif,data/source/MP/raw/cifs/mp-2404.cif,mp-2404,0.0,,2011-05-12 20:40:04,2.425284826496,10.17188/1199876,"@misc{osti_1199876,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CaAl2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199876"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696647'}},0.0,5.295815,520.0,-20.96070844,-3.493451406666667,"{'tags': ['Aluminium calcium (2/1)', 'Calcium aluminide (1/2)']}",-20.96070844,-3.493451406666667,-0.3278675600000002,"['xas', 'elasticity', 'bandstructure']",True,"[606299, 30213, 151190, 57530, 418966]",True,2021-05-12 10:56:16.728000,NM,6,9,mp-2404,,CaAl2,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Al'], 'pot_type': 'paw'}","{'Ca': 1.0, 'Al': 2.0}",GGA,mp-2404,"['mp-919648', 'mp-905546', 'mp-918642', 'mp-2404', 'mp-1257102', 'mp-1441243', 'mp-1696647', 'mp-1869510', 'mp-1594932']",0.00388185,"{'Ca': 2.0, 'Al': 4.0}",128.77570572307712,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",6.028854554829835e-05,0.00388185,0,0.0077637,MP,data/source/MP/cleaned/cifs/MP-mp-2404.cif,False,,data/final/MP/graphs/Al2Ca1-MP-mp-2404.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
C1Mo3Re2,1,0.0,4.0,False,C4Mo12Re8,C4Mo12Re8,0.0,Other,True,C16.667Mo50Re33.333,C-Mo-Re,3,Supercon,C1Mo3Re2,MP-mp-1190846,Re8Mo12C4,C-Mo-Re,C16.667Mo50Re33.333,P 41 3 2,cubic,6.948375,6.948375,6.948375,data/final/MP/cifs/C1Mo3Re2-MP-mp-1190846.cif,data/source/MP/raw/cifs/mp-1190846.cif,mp-1190846,0.0,,2019-01-11 21:15:30.711000,13.310265810824026,,,{'GGA': {'task_id': 'mp-1672190'}},0.0721589512500013,8.07704508,520.0,-266.37109687,-11.098795702916666,{'tags': ['Molybdenum rhenium carbide (3/2/1)']},-266.37109687,-11.098795702916666,0.0099983237500017,[],False,[618337],True,2021-05-12 10:59:54.607000,NM,24,4,mp-1190846,,Re2Mo3C,"{'functional': 'PBE', 'labels': ['Re_pv', 'Mo_pv', 'C'], 'pot_type': 'paw'}","{'Re': 2.0, 'Mo': 3.0, 'C': 1.0}",GGA,mp-1190846,"['mp-1190846', 'mp-1425483', 'mp-1672190', 'mp-1809832']",0.00012885,"{'Re': 8.0, 'Mo': 12.0, 'C': 4.0}",335.4669553652403,[],NM,False,213,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.5363659274245274e-06,0.00012885,0,0.0005154,MP,data/source/MP/cleaned/cifs/MP-mp-1190846.cif,False,,data/final/MP/graphs/C1Mo3Re2-MP-mp-1190846.json,0,True,432,4,0,0,0,0,0,0,1,0,0,0,1.0,False
Cu1La1.955Sr0.045O4,2,0.0128571428571428,1.0,True,Cu1La1.955Sr0.045O4,Cu1La2O4,0.0,Cuprate,True,Cu14.286La27.929Sr0.643O57.142857142857146,Cu-La-Sr-O,4,Supercon,La1.955Sr0.045Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La1.955Sr0.045O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La1.955Sr0.045O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B2Mg0.88Sc0.12,3,0.08,1.0,True,B2Mg0.88Sc0.12,B2Mg1,30.0,Other,True,B66.667Mg29.333Sc4,B-Mg-Sc,3,Supercon,Mg0.88Sc0.12B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B2Mg0.88Sc0.12-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B2Mg0.88Sc0.12-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ce0.156Cu1Sm1.844O4,3,0.0445714285714285,1.0,True,Ce0.156Cu1Sm1.844O4,Cu1Sm2O4,16.4,Cuprate,True,Ce2.229Cu14.286Sm26.343O57.142857142857146,Ce-Cu-Sm-O,4,Supercon,Sm1.844Ce0.156Cu1O4,MP-mp-4210,Sm2Cu1O4,Cu-Sm-O,Cu14.286Sm28.571O57.142857142857146,I 4/m m m,tetragonal,3.936481999770292,3.936481999770292,6.66682973,data/final/MP/cifs/Ce0.156Cu1Sm1.844O4-MP-mp-4210-synth_doped.cif,data/source/MP/raw/cifs/mp-4210.cif,mp-4210,0.0,,2011-05-13 10:20:22,7.575626216473968,10.17188/1207966,"@misc{osti_1207966,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sm2CuO4 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207966"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-670158'}},0.0084157301785579,3.24265454,520.0,-51.71666507,-7.38809501,"{'tags': ['Samarium cuprate', 'Disamarium copper oxide', 'Disamarium copper tetraoxide']}",-51.71666507,-7.38809501,-3.0194917299999995,"['xas', 'elasticity', 'bandstructure']",True,"[261378, 72243, 71182, 95371, 261377]",True,2021-05-12 10:56:20.740000,NM,7,8,mp-4210,oxide,Sm2CuO4,"{'functional': 'PBE', 'labels': ['Sm_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sm': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-4210,"['mp-660482', 'mp-670158', 'mp-4210', 'mp-1412888', 'mp-1702500', 'mp-1798108', 'mp-1589420', 'mp-688388']",0.0004776,"{'Sm': 2.0, 'Cu': 1.0, 'O': 4.0}",93.8732216032902,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",5.087712894507291e-06,0.0004776,0,0.0004776,MP,data/source/MP/cleaned/cifs/MP-mp-4210.cif,True,,data/final/MP/graphs/Ce0.156Cu1Sm1.844O4-MP-mp-4210-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ba2Bi3,1,0.0,1.0,True,Ba2Bi3,Ba2Bi3,4.44,Other,True,Ba40Bi60,Ba-Bi,2,Supercon,Ba2Bi3,MP-mp-569529,Ba2Bi3,Ba-Bi,Ba40Bi60,I m m m,orthorhombic,4.973019997173574,6.93648192,6.936481918800777,data/final/MP/cifs/Ba2Bi3-MP-mp-569529.cif,data/source/MP/raw/cifs/mp-569529.cif,mp-569529,0.0,,2016-01-04 15:12:49,7.452895901220964,10.17188/1275143,"@misc{osti_1275143,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Bi3 (SG:71) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1275143"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704219'}},0.0,3.89187362,520.0,-19.3386698,-3.86773396,{'tags': ['Dibarium tribismuthide']},-19.3386698,-3.86773396,-0.7661250420000005,"['xas', 'bandstructure']",True,[170218],True,2021-05-12 10:57:24.969000,NM,5,8,mp-569529,,Ba2Bi3,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Bi'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Bi': 3.0}",GGA,mp-569529,"['mp-990219', 'mp-990235', 'mp-569529', 'mp-1423704', 'mp-1704219', 'mp-1882894', 'mp-990247', 'mp-1592787']",0.0023832,"{'Ba': 2.0, 'Bi': 3.0}",200.87950666448643,[],NM,False,71,0,"[0, 0, 0, 0, 0]",1.1863828419194972e-05,0.0023832,0,0.0023832,MP,data/source/MP/cleaned/cifs/MP-mp-569529.cif,False,,data/final/MP/graphs/Ba2Bi3-MP-mp-569529.json,0,True,mmm,0,0,0,7,0,0,0,0,0,1,0,1.0,False
Al0.3Ga2.7Pd2U1,3,0.0999999999999999,1.0,True,Al0.3Ga2.7Pd2U1,Ga3Pd2U1,0.0,Heavy_fermion,True,Al5Ga45Pd33.333U16.667,Al-Ga-Pd-U,4,Supercon,U1Pd2Al0.3Ga2.7,MP-mp-20899,U1Ga3Pd2,Ga-Pd-U,Ga50Pd33.333U16.667,P 6/m m m,hexagonal,4.307727,5.335528004688491,5.33552732,data/final/MP/cifs/Al0.3Ga2.7Pd2U1-MP-mp-20899-synth_doped.cif,data/source/MP/raw/cifs/mp-20899.cif,mp-20899,0.0,,2014-02-22 16:47:26,10.320112735627264,10.17188/1196093,"@misc{osti_1196093,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UGa3Pd2 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196093"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1694975'}},0.0415313735606055,6.61536964,520.0,-33.48471722,-5.580786203333333,{'tags': ['Uranium palladium gallide (1/2/3)']},-33.48471722,-5.580786203333333,-0.45820925375,"['xas', 'bandstructure']",True,[246595],True,2021-05-12 10:56:57.051000,FM,6,9,mp-20899,,UGa3Pd2,"{'functional': 'PBE', 'labels': ['U', 'Ga_d', 'Pd'], 'pot_type': 'paw'}","{'U': 1.0, 'Ga': 3.0, 'Pd': 2.0}",GGA,mp-20899,"['mp-992967', 'mp-990980', 'mp-20899', 'mp-1178869', 'mp-1413591', 'mp-1694975', 'mp-1795689', 'mp-994326', 'mp-1594545']",2.294485,"{'U': 1.0, 'Ga': 3.0, 'Pd': 2.0}",106.20220564144816,[],FM,True,191,1,"[2.3, 0.0, 0.0, 0.0, 0.0, 0.0]",0.021604871444445,2.294485,1,2.294485,MP,data/source/MP/cleaned/cifs/MP-mp-20899.cif,True,,data/final/MP/graphs/Al0.3Ga2.7Pd2U1-MP-mp-20899-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ba1Ga0.78Si1.22,3,0.1466666666666666,1.0,True,Ba1Ga0.78Si1.22,Ba1Ga1Si1,4.0,Other,True,Ba33.333Ga26Si40.667,Ba-Ga-Si,3,Supercon,Ba1Ga0.78Si1.22,MP-mp-1227940,Ba1Ga1Si1,Ba-Ga-Si,Ba33.333Ga33.333Si33.333,P -6 m 2,hexagonal,4.272082000941928,4.2720824,5.13248,data/final/MP/cifs/Ba1Ga0.78Si1.22-MP-mp-1227940-synth_doped.cif,data/source/MP/raw/cifs/mp-1227940.cif,mp-1227940,0.0,,2019-01-13 03:42:50.271000,4.81315877375094,,,{'GGA': {'task_id': 'mp-1732125'}},0.0,3.79403141,520.0,-11.72891623,-3.909638743333333,{'tags': []},-11.72891623,-3.909638743333333,-0.4285117858333335,['bandstructure'],True,[],True,2021-05-12 10:58:49.477000,NM,3,5,mp-1227940,,BaGaSi,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ga_d', 'Si'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Ga': 1.0, 'Si': 1.0}",GGA,mp-1227940,"['mp-1227940', 'mp-1435807', 'mp-1732125', 'mp-1799653', 'mp-1613506']",0.0015669,"{'Ba': 1.0, 'Ga': 1.0, 'Si': 1.0}",81.12171279781855,[],NM,False,187,0,"[0, 0, 0]",1.9315420569400697e-05,0.0015669,0,0.0015669,MP,data/source/MP/cleaned/cifs/MP-mp-1227940.cif,True,,data/final/MP/graphs/Ba1Ga0.78Si1.22-MP-mp-1227940-synth_doped.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
B6Eu0.01Y0.99,2,0.0028571428571428,1.0,True,B6Eu0.01Y0.99,B6Y1,0.0,Other,True,B85.714Eu0.143Y14.143,B-Eu-Y,3,Supercon,B6Eu0.01Y0.99,MP-mp-2203,Y1B6,B-Y,B85.714Y14.286,P m -3 m,cubic,4.1021,4.1021,4.1021,data/final/MP/cifs/B6Eu0.01Y0.99-MP-mp-2203-synth_doped.cif,data/source/MP/raw/cifs/mp-2203.cif,mp-2203,0.0,,2011-05-12 20:11:15,3.699194842606093,10.17188/1197299,"@misc{osti_1197299,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YB6 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197299"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686414'}},0.0285229421428576,6.62579631,520.0,-49.33978236,-7.048540337142858,"{'tags': ['Yttrium boride (1/6)', 'Yttrium octahedro-hexaboride', 'Yttrium hexaboride']}",-49.33978236,-7.048540337142858,-0.3995658030952376,"['xas', 'elasticity', 'bandstructure']",True,"[194635, 615723, 54730, 615726, 615714, 659505, 76126, 615728, 615710]",True,2021-05-12 10:56:16.728000,NM,7,9,mp-2203,,YB6,"{'functional': 'PBE', 'labels': ['Y_sv', 'B'], 'pot_type': 'paw'}","{'Y': 1.0, 'B': 6.0}",GGA,mp-2203,"['mp-1000404', 'mp-1006875', 'mp-2203', 'mp-1077859', 'mp-1440131', 'mp-1686414', 'mp-1801281', 'mp-1011609', 'mp-1592923']",3.48e-05,"{'Y': 1.0, 'B': 6.0}",69.026957252261,[],NM,False,221,0,"[0, 0, 0, 0, 0, 0, 0]",5.041508620005138e-07,3.48e-05,0,3.48e-05,MP,data/source/MP/cleaned/cifs/MP-mp-2203.cif,True,,data/final/MP/graphs/B6Eu0.01Y0.99-MP-mp-2203-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
As1Fe1Li0.8,3,0.0952380952380952,2.0,False,As2Fe2Li1.6,As2Fe2Li2,17.6,Ferrite,True,As35.714Fe35.714Li28.571,As-Fe-Li,3,Supercon,Li0.8Fe1As1,MP-mp-21471,Li2Fe2As2,As-Fe-Li,As33.333Fe33.333Li33.333,P 4/n m m,tetragonal,3.790629,3.790629,6.107451,data/final/MP/cifs/As1Fe1Li0.8-MP-mp-21471-synth_doped.cif,data/source/MP/raw/cifs/mp-21471.cif,mp-21471,0.0,,2013-10-29 11:57:13,5.21140049061562,10.17188/1196927,"@misc{osti_1196927,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LiFeAs (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196927"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686578'}},0.0,4.20304559,520.0,-32.72438031,-5.454063385,"{'tags': ['Lithium iron arsenide', 'Iron lithium arsenide']}",-32.72438031,-5.454063385,-0.4413801444444445,"['xas', 'elasticity']",False,"[290700, 168206, 610480, 169175, 162250, 162056, 166457, 163870]",True,2021-05-12 10:56:16.728000,FM,6,18,mp-21471,,LiFeAs,"{'functional': 'PBE', 'labels': ['Li_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Li': 1.0, 'Fe': 1.0, 'As': 1.0}",GGA,mp-21471,"['mp-917215', 'mp-674647', 'mp-919059', 'mp-920059', 'mp-1071407', 'mp-21471', 'mp-1071451', 'mp-38403', 'mp-33848', 'mp-37001', 'mp-34336', 'mp-36599', 'mp-36822', 'mp-36276', 'mp-1439936', 'mp-1686578', 'mp-1784376', 'mp-1071444']",0.2682074,"{'Li': 2.0, 'Fe': 2.0, 'As': 2.0}",87.75715855248485,[],FM,True,129,1,"[-0.0, -0.0, 0.3, 0.3, -0.0, -0.0]",0.0061124905232567,0.2682074,2,0.5364148,MP,data/source/MP/cleaned/cifs/MP-mp-21471.cif,True,,data/final/MP/graphs/As1Fe1Li0.8-MP-mp-21471-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Fe0.4Ni0.6Zr2,3,0.0666666666666666,2.0,False,Fe0.8Ni1.2Zr4,Fe1Ni1Zr4,1.78,Other,True,Fe13.333Ni20Zr66.667,Fe-Ni-Zr,3,Supercon,Fe0.4Ni0.6Zr2,MP-mp-1215366,Zr4Fe1Ni1,Fe-Ni-Zr,Fe16.667Ni16.667Zr66.667,I 4 2 2,tetragonal,5.277062429600079,5.27706243,5.27706243,data/final/MP/cifs/Fe0.4Ni0.6Zr2-MP-mp-1215366-synth_doped.cif,data/source/MP/raw/cifs/mp-1215366.cif,mp-1215366,0.0,,2019-01-12 17:04:02.444000,7.137405118353338,,,{'GGA': {'task_id': 'mp-1735927'}},0.0198735593333339,4.811196,520.0,-49.72189863,-8.286983105,{'tags': []},-49.72189863,-8.286983105,-0.21349183,['bandstructure'],True,[],True,2021-05-12 10:58:39.488000,FM,6,5,mp-1215366,,Zr4FeNi,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Fe_pv', 'Ni_pv'], 'pot_type': 'paw'}","{'Zr': 4.0, 'Fe': 1.0, 'Ni': 1.0}",GGA,mp-1215366,"['mp-1215366', 'mp-1445478', 'mp-1735927', 'mp-1803005', 'mp-1627881']",0.2630035,"{'Zr': 4.0, 'Fe': 1.0, 'Ni': 1.0}",111.54187521523264,[],FM,True,97,1,"[0.0, 0.0, 0.0, 0.0, 0.3, 0.0]",0.0023578902496708,0.2630035,1,0.2630035,MP,data/source/MP/cleaned/cifs/MP-mp-1215366.cif,True,,data/final/MP/graphs/Fe0.4Ni0.6Zr2-MP-mp-1215366-synth_doped.json,0,True,422,0,0,0,0,4,0,0,0,0,1,0,1.0,False
Al1Hf0.081Nb2.919,2,0.0404999999999999,2.0,False,Al2Hf0.162Nb5.838,Al2Nb6,16.5,Other,True,Al25Hf2.025Nb72.975,Al-Hf-Nb,3,Supercon,Nb2.919Hf0.081Al1,MP-mp-796,Nb6Al2,Al-Nb,Al25Nb75,P m -3 n,cubic,5.215254,5.215254,5.215254,data/final/MP/cifs/Al1Hf0.081Nb2.919-MP-mp-796-synth_doped.cif,data/source/MP/raw/cifs/mp-796.cif,mp-796,0.0,,2011-05-13 16:07:37,7.157298025966356,,,{'GGA': {'task_id': 'mp-1686893'}},0.0460773865000003,5.52947534,520.0,-69.48918494,-8.6861481175,"{'tags': ['Aluminium niobium (1/3)', 'Niobium aluminide (3/1)', 'Aluminum niobium (1/3)']}",-69.48918494,-8.6861481175,-0.1737753800000003,"['bandstructure', 'elasticity']",True,"[608675, 608654, 608688, 608668, 608669, 608685, 608676, 608683, 58014, 608657, 107856, 608655, 608666, 608691, 608656, 608665, 608673, 608653, 608661]",True,2021-05-12 10:56:31.128000,NM,8,10,mp-796,,Nb3Al,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Al': 1.0}",GGA,mp-796,"['mp-911586', 'mp-927906', 'mp-796', 'mp-927472', 'mp-1260512', 'mp-1440919', 'mp-1686893', 'mp-1927652', 'mp-1591599', 'mp-1587739']",0.16323955,"{'Nb': 6.0, 'Al': 2.0}",141.8490379078192,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0023015954483396,0.16323955,0,0.3264791,MP,data/source/MP/cleaned/cifs/MP-mp-796.cif,True,,data/final/MP/graphs/Al1Hf0.081Nb2.919-MP-mp-796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ir0.75Rh0.25,1,0.0,4.0,False,Ir3Rh1,Ir3Rh1,0.026,Other,True,Ir75Rh25,Ir-Rh,2,Supercon,Ir0.75Rh0.25,MP-mp-863709,Ir3Rh1,Ir-Rh,Ir75Rh25,I 4/m m m,tetragonal,3.8687819979134415,3.8687819979134415,4.73698175,data/final/MP/cifs/Ir0.75Rh0.25-MP-mp-863709.cif,data/source/MP/raw/cifs/mp-863709.cif,mp-863709,0.0,,2014-08-25 13:34:50,19.495266718306937,10.17188/1309898,"@misc{osti_1309898,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ir3Rh (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1309898"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1736410'}},0.0,9.12996087,520.0,-33.96372354,-8.490930885,{'tags': []},-33.96372354,-8.490930885,-0.0210311025000002,"['xas', 'elasticity', 'bandstructure']",True,[],True,2021-05-12 10:56:31.128000,NM,4,11,mp-863709,,Ir3Rh,"{'functional': 'PBE', 'labels': ['Ir', 'Rh_pv'], 'pot_type': 'paw'}","{'Ir': 3.0, 'Rh': 1.0}",GGA,mp-863709,"['mp-863709', 'mp-1002907', 'mp-1004490', 'mp-1051083', 'mp-1051124', 'mp-1418068', 'mp-1736410', 'mp-1795487', 'mp-1010171', 'mp-1584871', 'mp-1051105']",9.26e-05,"{'Ir': 3.0, 'Rh': 1.0}",57.8822609876025,[],NM,False,139,0,"[0, 0, 0, 0]",1.599799289454735e-06,9.26e-05,0,9.26e-05,MP,data/source/MP/cleaned/cifs/MP-mp-863709.cif,False,,data/final/MP/graphs/Ir0.75Rh0.25-MP-mp-863709.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ga0.25Nb0.75,1,0.0,8.0,False,Ga2Nb6,Ga2Nb6,18.16296296333333,Other,True,Ga25Nb75,Ga-Nb,2,Supercon,Ga0.25Nb0.75,MP-mp-2670,Nb6Ga2,Ga-Nb,Ga25Nb75,P m -3 n,cubic,5.189021,5.189021,5.189021,data/final/MP/cifs/Ga0.25Nb0.75-MP-mp-2670.cif,data/source/MP/raw/cifs/mp-2670.cif,mp-2670,0.0,,2011-05-14 07:55:50,8.28234811962253,10.17188/1201220,"@misc{osti_1201220,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Ga (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201220"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686575'}},0.0550303606249986,4.96610647,520.0,-68.03986833,-8.50498354125,"{'tags': ['Gallium niobium (1/3)', 'Niobium gallide (3/1)']}",-68.03986833,-8.50498354125,-0.1719807556250003,"['xas', 'elasticity', 'bandstructure']",True,"[634772, 634745, 634746, 634774, 634731, 634748, 634762, 634767, 108484, 634734, 634761, 103831]",True,2021-05-12 10:56:18.721000,NM,8,9,mp-2670,,Nb3Ga,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Ga_d'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Ga': 1.0}",GGA,mp-2670,"['mp-928915', 'mp-912435', 'mp-929292', 'mp-2670', 'mp-1078851', 'mp-1440107', 'mp-1686575', 'mp-1781117', 'mp-1594502']",0.0001134,"{'Nb': 6.0, 'Ga': 2.0}",139.71926259628808,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.6232550600794926e-06,0.0001134,0,0.0002268,MP,data/source/MP/cleaned/cifs/MP-mp-2670.cif,False,,data/final/MP/graphs/Ga0.25Nb0.75-MP-mp-2670.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Bi1La1S2O1,1,0.0,2.0,False,Bi2La2S4O2,Bi2La2S4O2,0.0,Oxide,True,Bi20La20S40O20,Bi-La-S-O,4,Supercon,La1Bi1S2O1,MP-mp-1078397,La2Bi2S4O2,Bi-La-S-O,Bi20La20S40O20,P 4/n m m,tetragonal,4.055497,4.055497,14.173265,data/final/MP/cifs/Bi1La1S2O1-MP-mp-1078397.cif,data/source/MP/raw/cifs/mp-1078397.cif,mp-1078397,1.0743999999999998,,2018-04-11 10:57:38,6.097899749460756,,,{'GGA': {'task_id': 'mp-1676377'}},0.0053330699999989,4.69184382,520.0,-61.66700475,-6.166700475,{'tags': ['Lanthanum bismuth oxodisulphate']},-61.66700475,-6.166700475,-2.09592004425,['bandstructure'],True,[196231],True,2021-05-12 10:58:14.654000,NM,10,5,mp-1078397,oxide,LaBiS2O,"{'functional': 'PBE', 'labels': ['La', 'Bi', 'S', 'O'], 'pot_type': 'paw'}","{'La': 1.0, 'Bi': 1.0, 'S': 2.0, 'O': 1.0}",GGA,mp-1078397,"['mp-1078397', 'mp-1380859', 'mp-1676377', 'mp-1776923', 'mp-1600973']",6.57e-05,"{'La': 2.0, 'Bi': 2.0, 'S': 4.0, 'O': 2.0}",233.1084819815865,[],NM,False,129,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.636860524465146e-07,6.57e-05,0,0.0001314,MP,data/source/MP/cleaned/cifs/MP-mp-1078397.cif,False,,data/final/MP/graphs/Bi1La1S2O1-MP-mp-1078397.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
As1Co0.061Fe0.939Na1,2,0.0406666666666666,2.0,False,As2Co0.122Fe1.878Na2,As2Fe2Na2,13.4,Ferrite,True,As33.333Co2.033Fe31.3Na33.333,As-Co-Fe-Na,4,Supercon,Na1Fe0.939Co0.061As1,MP-mp-22152,Na2Fe2As2,As-Fe-Na,As33.333Fe33.333Na33.333,P 4/n m m,tetragonal,3.923688,3.923688,6.918844,data/final/MP/cifs/As1Co0.061Fe0.939Na1-MP-mp-22152-synth_doped.cif,data/source/MP/raw/cifs/mp-22152.cif,mp-22152,0.0,,2014-02-21 10:51:39,4.793908463406792,10.17188/1197381,"@misc{osti_1197381,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NaFeAs (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197381"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704688'}},0.0,4.10723066,520.0,-30.57538864,-5.095898106666667,{'tags': ['Sodium iron arsenide']},-30.57538864,-5.095898106666667,-0.2786807238505749,"['xas', 'elasticity', 'bandstructure']",True,"[163144, 163143]",True,2021-05-12 10:56:16.728000,FM,6,8,mp-22152,,NaFeAs,"{'functional': 'PBE', 'labels': ['Na_pv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Na': 1.0, 'Fe': 1.0, 'As': 1.0}",GGA,mp-22152,"['mp-906352', 'mp-920130', 'mp-919102', 'mp-22152', 'mp-1413190', 'mp-1704688', 'mp-1797758', 'mp-1594769']",0.0693226,"{'Na': 2.0, 'Fe': 2.0, 'As': 2.0}",106.5178694490858,[],FM,True,129,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.0]",0.0013016144682303,0.0693226,2,0.1386452,MP,data/source/MP/cleaned/cifs/MP-mp-22152.cif,True,,data/final/MP/graphs/As1Co0.061Fe0.939Na1-MP-mp-22152-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B2C1Er1Fe0.02Ni1.98,2,0.0066666666666666,1.0,True,B2C1Er1Fe0.02Ni1.98,B2C1Er1Ni2,9.535,Other,True,B33.333C16.667Er16.667Fe0.333Ni33,B-C-Er-Fe-Ni,5,Supercon,Er1Ni1.98Fe0.02B2C1,MP-mp-6098,Er1Ni2B2C1,B-C-Er-Ni,B33.333C16.667Er16.667Ni33.333,I 4/m m m,tetragonal,3.5122880026935177,3.5122880026935173,5.77805085,data/final/MP/cifs/B2C1Er1Fe0.02Ni1.98-MP-mp-6098-synth_doped.cif,data/source/MP/raw/cifs/mp-6098.cif,mp-6098,0.0,,2011-05-13 04:24:02,8.212015229638553,10.17188/1277667,"@misc{osti_1277667,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ErNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277667"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700042'}},0.0,6.72687579,520.0,-41.84324782,-6.973874636666667,{'tags': []},-41.84324782,-6.973874636666667,-0.5216152347222227,"['xas', 'elasticity', 'bandstructure']",True,"[246431, 79576, 56651]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-6098,,ErNi2B2C,"{'functional': 'PBE', 'labels': ['Er_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Er': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6098,"['mp-1006980', 'mp-1000513', 'mp-6098', 'mp-1441533', 'mp-1700042', 'mp-1793903', 'mp-1011723', 'mp-1589040']",0.0020747,"{'Er': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",64.35860973581151,[],NM,False,139,0,"[0.0, -0.0, -0.0, 0.0, 0.0, 0.0]",3.2236557136900987e-05,0.0020747,0,0.0020747,MP,data/source/MP/cleaned/cifs/MP-mp-6098.cif,True,,data/final/MP/graphs/B2C1Er1Fe0.02Ni1.98-MP-mp-6098-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
C3Ho0.2Th1.8,3,0.0799999999999999,4.0,False,C12Ho0.8Th7.2,C12Th8,5.4,Other,True,C60Ho4Th36,C-Ho-Th,3,Supercon,Th1.8Ho0.2C3,MP-mp-1188514,Th8C12,C-Th,C60Th40,I -4 3 d,cubic,7.414620251643706,7.41462025,7.41462025,data/final/MP/cifs/C3Ho0.2Th1.8-MP-mp-1188514-synth_doped.cif,data/source/MP/raw/cifs/mp-1188514.cif,mp-1188514,0.0,,2019-01-11 19:30:01.530000,10.585910862659652,,,{'GGA': {'task_id': 'mp-1669546'}},0.0,8.12401413,520.0,-175.32363419,-8.7661817095,"{'tags': ['Pu2C3', 'Th2C3 hp', 'Thorium carbide (2/3)']}",-175.32363419,-8.7661817095,-0.2645699894999992,['bandstructure'],True,[618903],True,2021-05-12 10:58:33.577000,NM,20,5,mp-1188514,,Th2C3,"{'functional': 'PBE', 'labels': ['Th', 'C'], 'pot_type': 'paw'}","{'Th': 2.0, 'C': 3.0}",GGA,mp-1188514,"['mp-1188514', 'mp-1415692', 'mp-1669546', 'mp-1811506', 'mp-1605961']",0.000101475,"{'Th': 8.0, 'C': 12.0}",313.7941543668512,[],NM,False,220,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.2935231404134748e-06,0.000101475,0,0.0004059,MP,data/source/MP/cleaned/cifs/MP-mp-1188514.cif,True,,data/final/MP/graphs/C3Ho0.2Th1.8-MP-mp-1188514-synth_doped.json,0,True,-43m,5,0,0,0,0,0,0,0,0,1,0,1.0,False
Co1.8Cr0.2Cu1S4,3,0.0571428571428571,2.0,False,Co3.6Cr0.4Cu2S8,Co4Cu2S8,2.7,Other,True,Co25.714Cr2.857Cu14.286S57.143,Co-Cr-Cu-S,4,Supercon,Cu1Co1.8Cr0.2S4,MP-mp-3925,Co4Cu2S8,Co-Cu-S,Co28.571Cu14.286S57.143,F d -3 m,cubic,6.69987918,6.699879179999999,6.699879179999999,data/final/MP/cifs/Co1.8Cr0.2Cu1S4-MP-mp-3925-synth_doped.cif,data/source/MP/raw/cifs/mp-3925.cif,mp-3925,0.0,,2011-05-15 03:07:38,4.836104359598833,10.17188/1207634,"@misc{osti_1207634,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Co2CuS4 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207634"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698326'}},0.0,5.68331854,520.0,-75.59837827,-5.399884162142857,"{'tags': ['Cobalt copper sulfide (2/1/4)', 'Carrollite', 'Dicobalt(III) copper sulfide']}",-75.59837827,-5.399884162142857,-0.7070782010714284,"['xas', 'bandstructure']",True,"[622571, 31107, 52943]",True,2021-05-12 10:57:08.928000,NM,14,8,mp-3925,,Co2CuS4,"{'functional': 'PBE', 'labels': ['Co', 'Cu_pv', 'S'], 'pot_type': 'paw'}","{'Co': 2.0, 'Cu': 1.0, 'S': 4.0}",GGA,mp-3925,"['mp-931396', 'mp-915858', 'mp-932359', 'mp-3925', 'mp-1425952', 'mp-1698326', 'mp-1833413', 'mp-1599756']",0.00593025,"{'Co': 4.0, 'Cu': 2.0, 'S': 8.0}",212.6600516474575,[],NM,False,227,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",5.5772110972972206e-05,0.00593025,0,0.0118605,MP,data/source/MP/cleaned/cifs/MP-mp-3925.cif,True,,data/final/MP/graphs/Co1.8Cr0.2Cu1S4-MP-mp-3925-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ba0.542Bi1K0.458O3,2,0.0498666666666666,3.0,False,Ba1.626Bi3K1.374O9,Ba2Bi3K1O9,23.1,Oxide,True,Ba10.84Bi20K9.16O60,Ba-Bi-K-O,4,Supercon,Ba0.542K0.458Bi1O3,MP-mp-1223518,K1Ba2Bi3O9,Ba-Bi-K-O,Ba13.333Bi20K6.667O60,P -3 m 1,trigonal,6.18756400330999,6.187564340000001,7.581401,data/final/MP/cifs/Ba0.542Bi1K0.458O3-MP-mp-1223518-synth_doped.cif,data/source/MP/raw/cifs/mp-1223518.cif,mp-1223518,0.0,,2019-01-12 23:54:06.965000,7.16530091201999,,,{'GGA': {'task_id': 'mp-1729135'}},0.001551682833333,3.46143017,520.0,-85.22271396,-5.681514264,{'tags': []},-85.22271396,-5.681514264,-2.0170414252000004,[],False,[],True,2021-05-12 11:00:52.054000,NM,15,4,mp-1223518,oxide,KBa2(BiO3)3,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Bi', 'O'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 2.0, 'Bi': 3.0, 'O': 9.0}",GGA,mp-1223518,"['mp-1223518', 'mp-1391182', 'mp-1729135', 'mp-1775199']",4.99e-05,"{'K': 1.0, 'Ba': 2.0, 'Bi': 3.0, 'O': 9.0}",251.37352739849624,[],NM,False,164,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.9850936777799505e-07,4.99e-05,0,4.99e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1223518.cif,True,,data/final/MP/graphs/Ba0.542Bi1K0.458O3-MP-mp-1223518-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ba2Cd0.3Cu3Y0.7O7,3,0.0461538461538461,1.0,True,Ba2Cd0.3Cu3Y0.7O7,Ba2Cu3Y1O7,92.8,Cuprate,True,Ba15.385Cd2.308Cu23.077Y5.385O53.84615384615385,Ba-Cd-Cu-Y-O,5,Supercon,Y0.7Cd0.3Ba2Cu3O7,MP-mp-20674,Ba2Y1Cu3O7,Ba-Cu-Y-O,Ba15.385Cu23.077Y7.692O53.84615384615385,P m m m,orthorhombic,3.844668,3.926152,11.823664,data/final/MP/cifs/Ba2Cd0.3Cu3Y0.7O7-MP-mp-20674-synth_doped.cif,data/source/MP/raw/cifs/mp-20674.cif,mp-20674,0.0,,2014-02-22 18:23:22,6.198285186087997,10.17188/1195834,"@misc{osti_1195834,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2YCu3O7 (SG:47) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195834"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686609'}},0.0313759126602519,3.28295453,520.0,-80.7708035,-6.213138730769231,"{'tags': ['Yttrium barium copper oxide (1/2/3/7)', 'Dibarium yttrium dicopper copper(III) oxide', 'Yttrium barium copper oxide (1/2/3/6.93)', 'Dibarium yttrium copper(III) dicopper oxide', 'High pressure experimental phase', 'Yttrium dibarium dicopper copper(III) oxide']}",-80.7708035,-6.213138730769231,-2.180157206282052,"['xas', 'elasticity', 'bandstructure']",True,"[196266, 196264, 196265, 71423, 66620, 63483, 66621, 164530, 56507, 63487, 66602, 66601, 68394, 63486, 63485, 202774, 62466, 62465, 41646, 65224, 202773, 66600, 63335, 66611, 78598, 66617, 81175, 66610, 66619, 66615, 63484, 86958, 262809, 66609, 184677, 202775, 66616, 63488, 66618, 66623, 202771, 66622, 202772, 77737, 202770, 62928, 77745]",True,2021-05-12 10:56:14.760000,NM,13,14,mp-20674,oxide,Ba2YCu3O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Cu': 3.0, 'O': 7.0}",GGA,mp-20674,"['mp-923155', 'mp-917354', 'mp-922372', 'mp-20674', 'mp-1103385', 'mp-1103741', 'mp-1103748', 'mp-1104329', 'mp-1104589', 'mp-1440689', 'mp-1686609', 'mp-1832558', 'mp-1596594', 'mp-1592890']",0.0001806,"{'Ba': 2.0, 'Y': 1.0, 'Cu': 3.0, 'O': 7.0}",178.47526348558395,[],NM,False,47,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.0119049355799813e-06,0.0001806,0,0.0001806,MP,data/source/MP/cleaned/cifs/MP-mp-20674.cif,True,,data/final/MP/graphs/Ba2Cd0.3Cu3Y0.7O7-MP-mp-20674-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Co1P1,1,0.0,4.0,False,Co4P4,Co4P4,0.0,Other,True,Co50P50,Co-P,2,Supercon,Co1P1,MP-mp-22270,Co4P4,Co-P,Co50P50,P n m a,orthorhombic,3.269058,5.072209,5.555129,data/final/MP/cifs/Co1P1-MP-mp-22270.cif,data/source/MP/raw/cifs/mp-22270.cif,mp-22270,0.0,,2014-02-21 11:14:34,6.483185869590008,10.17188/1197496,"@misc{osti_1197496,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CoP (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197496"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697379'}},0.0,9.25755366,520.0,-54.75537059,-6.84442132375,"{'tags': ['Cobalt phosphide (1/1)', 'Cobalt(III) phosphide', 'Cobalt phosphide']}",-54.75537059,-6.84442132375,-0.5836111729166671,"['xas', 'elasticity', 'bandstructure']",True,"[624584, 43249, 624588, 43401]",True,2021-05-12 10:56:16.728000,NM,8,8,mp-22270,,CoP,"{'functional': 'PBE', 'labels': ['Co', 'P'], 'pot_type': 'paw'}","{'Co': 1.0, 'P': 1.0}",GGA,mp-22270,"['mp-925543', 'mp-925959', 'mp-909987', 'mp-22270', 'mp-1434764', 'mp-1697379', 'mp-1798118', 'mp-1595438']",0.0003393,"{'Co': 4.0, 'P': 4.0}",92.11151274123048,[],NM,False,6,0,"[0.0, 0.0, 0.0, -0.0, 0.0, 0.0, 0.0, 0.0]",1.4734314523883583e-05,0.0003393,0,0.0013572,MP,data/source/MP/cleaned/cifs/MP-mp-22270.cif,False,,data/final/MP/graphs/Co1P1-MP-mp-22270.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ce0.091Cu1La1.909O4,2,0.0259999999999999,1.0,True,Ce0.091Cu1La1.909O4,Cu1La2O4,30.3,Cuprate,True,Ce1.3Cu14.286La27.271O57.142857142857146,Ce-Cu-La-O,4,Supercon,La1.909Ce0.091Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ce0.091Cu1La1.909O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ce0.091Cu1La1.909O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Fe0.75Ni0.25U6,3,0.0714285714285714,2.0,False,Fe1.5Ni0.5U12,Fe2U12,1.4,Heavy_fermion,True,Fe10.714Ni3.571U85.714,Fe-Ni-U,3,Supercon,Fe0.75Ni0.25U6,MP-mp-21108,U12Fe2,Fe-U,Fe14.286U85.714,I 4/m c m,tetragonal,5.253242000907672,7.6369545005846255,7.6369545,data/final/MP/cifs/Fe0.75Ni0.25U6-MP-mp-21108-synth_doped.cif,data/source/MP/raw/cifs/mp-21108.cif,mp-21108,0.0,,2014-02-19 11:56:24,18.24423563918276,10.17188/1196387,"@misc{osti_1196387,
    author = ""Persson, Kristin"",
    title = ""Materials Data on U6Fe (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196387"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695170'}},0.0163147910714283,13.83249918,520.0,-152.51387764,-10.893848402857143,{'tags': ['Iron uranium (1/6)']},-152.51387764,-10.893848402857143,-0.0054957585714297,"['xas', 'bandstructure']",True,"[103675, 103674, 103678, 103676, 103677, 150485, 103673]",True,2021-05-12 10:56:57.051000,NM,14,8,mp-21108,,U6Fe,"{'functional': 'PBE', 'labels': ['U', 'Fe_pv'], 'pot_type': 'paw'}","{'U': 6.0, 'Fe': 1.0}",GGA,mp-21108,"['mp-919573', 'mp-905336', 'mp-918548', 'mp-21108', 'mp-1426891', 'mp-1695170', 'mp-1925522', 'mp-1597921']",0.16630455,"{'U': 12.0, 'Fe': 2.0}",270.1423810919332,[],NM,False,140,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0012312362786452,0.16630455,0,0.3326091,MP,data/source/MP/cleaned/cifs/MP-mp-21108.cif,True,,data/final/MP/graphs/Fe0.75Ni0.25U6-MP-mp-21108-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Si1Ti0.3V2.7,3,0.1499999999999999,2.0,False,Si2Ti0.6V5.4,Si2V6,10.9,Other,True,Si25Ti7.5V67.5,Si-Ti-V,3,Supercon,V2.7Ti0.3Si1,MP-mp-2567,V6Si2,Si-V,Si25V75,P m -3 n,cubic,4.702381,4.702381,4.702381,data/final/MP/cifs/Si1Ti0.3V2.7-MP-mp-2567-synth_doped.cif,data/source/MP/raw/cifs/mp-2567.cif,mp-2567,0.0,,2011-05-13 19:15:43,5.778142190030859,10.17188/1200874,"@misc{osti_1200874,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Si (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1200874"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668672'}},0.0,7.30599425,520.0,-69.05773321,-8.63221665125,{'tags': ['Vanadium silicide (3/1)']},-69.05773321,-8.63221665125,-0.4452085937499994,"['xas', 'elasticity', 'bandstructure']",True,"[652491, 87328, 652522, 652502, 652510, 652520, 600518, 186003, 652507, 652513, 652497, 601150, 652514, 652487, 22412, 652509, 652529, 652532, 652499, 652539, 652537, 652533, 652512, 652538, 652490, 652493, 652494, 652511, 652519, 87329, 652526, 652500]",True,2021-05-12 10:56:18.721000,FM,8,13,mp-2567,,V3Si,"{'functional': 'PBE', 'labels': ['V_pv', 'Si'], 'pot_type': 'paw'}","{'V': 3.0, 'Si': 1.0}",GGA,mp-2567,"['mp-920081', 'mp-906309', 'mp-919083', 'mp-2567', 'mp-1078474', 'mp-1078852', 'mp-1138781', 'mp-1145907', 'mp-1440678', 'mp-1668672', 'mp-1795955', 'mp-1593554', 'mp-1596575']",0.8382519,"{'V': 6.0, 'Si': 2.0}",103.98086881866836,[],FM,True,131,1,"[0.2, 0.3, 0.3, 0.2, 0.3, 0.3, 0.0, 0.0]",0.0161231947669493,0.8382519,6,1.6765038,MP,data/source/MP/cleaned/cifs/MP-mp-2567.cif,True,,data/final/MP/graphs/Si1Ti0.3V2.7-MP-mp-2567-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ge3Y1,1,0.0,2.0,False,Ge6Y2,Ge6Y2,2.35,Other,True,Ge75Y25,Ge-Y,2,Supercon,Ge3Y1,MP-mp-29772,Y2Ge6,Ge-Y,Ge75Y25,C m c m,orthorhombic,3.942302,4.0534240004906446,10.70880118,data/final/MP/cifs/Ge3Y1-MP-mp-29772.cif,data/source/MP/raw/cifs/mp-29772.cif,mp-29772,0.0,,2014-02-25 22:33:38,6.064273338856981,10.17188/1204234,"@misc{osti_1204234,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YGe3 (SG:63) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1204234"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695579'}},0.0203751462499992,3.77729505,520.0,-44.35441406,-5.5443017575,{'tags': ['Yttrium germanide (1/3)']},-44.35441406,-5.5443017575,-0.4604130879166668,"['xas', 'elasticity', 'bandstructure']",True,[88075],True,2021-05-12 10:56:18.721000,NM,8,9,mp-29772,,YGe3,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ge_d'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ge': 3.0}",GGA,mp-29772,"['mp-926330', 'mp-910553', 'mp-926864', 'mp-29772', 'mp-505605', 'mp-1435827', 'mp-1695579', 'mp-1831199', 'mp-1602510']",0.0069295,"{'Y': 2.0, 'Ge': 6.0}",168.03210610680802,[],NM,False,63,0,"[0, 0, 0, 0, 0, 0, 0, 0]",8.247828537714488e-05,0.0069295,0,0.013859,MP,data/source/MP/cleaned/cifs/MP-mp-29772.cif,False,,data/final/MP/graphs/Ge3Y1-MP-mp-29772.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
B1.958C0.042Mg1,2,0.028,1.0,True,B1.958C0.042Mg1,B2Mg1,37.7,Other,True,B65.267C1.4Mg33.333,B-C-Mg,3,Supercon,Mg1B1.958C0.042,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B1.958C0.042Mg1-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B1.958C0.042Mg1-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ge0.18Nb0.82,3,0.1399999999999999,8.0,False,Ge1.44Nb6.56,Ge2Nb6,5.7925,Other,True,Ge18Nb82,Ge-Nb,2,Supercon,Ge0.18Nb0.82,MP-mp-1373,Nb6Ge2,Ge-Nb,Ge25Nb75,P m -3 n,cubic,5.175188,5.175188,5.175188,data/final/MP/cifs/Ge0.18Nb0.82-MP-mp-1373-synth_doped.cif,data/source/MP/raw/cifs/mp-1373.cif,mp-1373,0.0,,2011-05-14 10:04:58,8.418834172896334,10.17188/1189733,"@misc{osti_1189733,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Ge (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189733"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687944'}},0.0536666316666671,5.20674172,520.0,-71.98443657,-8.99805457125,"{'tags': ['Niobium germanide (3/1)', 'Germanium niobium (1/3)']}",-71.98443657,-8.99805457125,-0.2663188274999992,"['xas', 'elasticity', 'bandstructure']",True,"[637197, 637221, 637219, 637190, 637220, 637224, 637204, 637193, 637198, 637223, 26573, 637222, 637214, 53719]",True,2021-05-12 10:56:12.755000,NM,8,9,mp-1373,,Nb3Ge,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Ge_d'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Ge': 1.0}",GGA,mp-1373,"['mp-913712', 'mp-930518', 'mp-930009', 'mp-1373', 'mp-1079804', 'mp-1476243', 'mp-1687944', 'mp-1926238', 'mp-1590510']",0.5080796,"{'Nb': 6.0, 'Ge': 2.0}",138.60483919622226,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0073313399870651,0.5080796,0,1.0161592,MP,data/source/MP/cleaned/cifs/MP-mp-1373.cif,True,,data/final/MP/graphs/Ge0.18Nb0.82-MP-mp-1373-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Cu1Sr0.7Y0.3O2,3,0.15,2.0,False,Cu2Sr1.4Y0.6O4,Cu2Sr2O4,32.6,Cuprate,True,Cu25Sr17.5Y7.5O50,Cu-Sr-Y-O,4,Supercon,Sr0.7Y0.3Cu1O2,MP-mp-5787,Sr2Cu2O4,Cu-Sr-O,Cu25Sr25O50,C m c m,orthorhombic,3.644437999912225,3.974263,8.32909336,data/final/MP/cifs/Cu1Sr0.7Y0.3O2-MP-mp-5787-synth_doped.cif,data/source/MP/raw/cifs/mp-5787.cif,mp-5787,0.0,,2011-05-13 22:43:08,5.167573150857569,10.17188/1276630,"@misc{osti_1276630,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SrCuO2 (SG:63) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1276630"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703560'}},0.0,3.45760864,520.0,-45.24374469,-5.65546808625,"{'tags': ['Strontium cuprate', 'Strontium copper oxide']}",-45.24374469,-5.65546808625,-2.0778125529166664,"['xas', 'elasticity', 'bandstructure']",True,"[77291, 93653, 202992, 16217, 83051, 77293]",True,2021-05-12 10:56:27.046000,NM,8,8,mp-5787,oxide,SrCuO2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Cu': 1.0, 'O': 2.0}",GGA,mp-5787,"['mp-924142', 'mp-909103', 'mp-5787', 'mp-924940', 'mp-1475985', 'mp-1703560', 'mp-1802910', 'mp-1593696']",4e-07,"{'Sr': 2.0, 'Cu': 2.0, 'O': 4.0}",117.71572347282628,[],NM,False,63,0,"[0, 0, 0, 0, 0, 0, 0, 0]",6.796033498317439e-09,4e-07,0,8e-07,MP,data/source/MP/cleaned/cifs/MP-mp-5787.cif,True,,data/final/MP/graphs/Cu1Sr0.7Y0.3O2-MP-mp-5787-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
As1Fe1Pr0.95Sr0.05O1,2,0.025,2.0,False,As2Fe2Pr1.9Sr0.1O2,As2Fe2Pr2O2,4.86,Ferrite,True,As25Fe25Pr23.75Sr1.25O25,As-Fe-Pr-Sr-O,5,Supercon,Pr0.95Sr0.05Fe1As1O1,MP-mp-22491,Pr2Fe2As2O2,As-Fe-Pr-O,As25Fe25Pr25O25,P 4/n m m,tetragonal,4.094889,4.094889,9.258722,data/final/MP/cifs/As1Fe1Pr0.95Sr0.05O1-MP-mp-22491-synth_doped.cif,data/source/MP/raw/cifs/mp-22491.cif,mp-22491,0.0,,2014-02-25 19:17:30,6.153806906111091,,,{'GGA+U': {'task_id': 'mp-1695715'}},0.3808778432291664,4.12348168,520.0,-51.7633941,-6.4704242625,{'tags': ['Praseodymium iron arsenic oxide (1/1/1/1)']},-51.7633941,-6.4704242625,-1.491677511249999,"['xas', 'bandstructure']",True,"[162830, 162833, 246832, 90316, 422000, 236649, 236648, 602491]",True,2021-05-12 10:57:10.838000,FM,8,8,mp-22491,oxide,PrFeAsO,"{'functional': 'PBE', 'labels': ['Pr_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Pr': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-22491,"['mp-510622', 'mp-1079608', 'mp-1079857', 'mp-22491', 'mp-1476145', 'mp-1695715', 'mp-1778524', 'mp-1596397']",3.7947681,"{'Pr': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",155.25132378854377,[],FM,True,129,1,"[0.0, 0.0, 3.5, 3.5, 0.0, 0.0, 0.0, 0.0]",0.0488854846116297,3.7947681,2,7.5895362,MP,data/source/MP/cleaned/cifs/MP-mp-22491.cif,True,,data/final/MP/graphs/As1Fe1Pr0.95Sr0.05O1-MP-mp-22491-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ir3Lu2Si5,1,0.0,2.0,False,Ir6Lu4Si10,Ir6Lu4Si10,4.425,Other,True,Ir30Lu20Si50,Ir-Lu-Si,3,Supercon,Lu2Ir3Si5,MP-mp-568336,Lu4Si10Ir6,Ir-Lu-Si,Ir30Lu20Si50,I b a m,orthorhombic,5.768945997058916,8.10316065,8.103160651054345,data/final/MP/cifs/Ir3Lu2Si5-MP-mp-568336.cif,data/source/MP/raw/cifs/mp-568336.cif,mp-568336,0.0,,2014-02-24 19:50:32,10.79445647040026,10.17188/1274373,"@misc{osti_1274373,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Lu2Si5Ir3 (SG:72) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1274373"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1708810'}},0.0,7.95526215,520.0,-144.18930957,-7.2094654785,{'tags': ['Lutetium iridium silicide (2/3/5)']},-144.18930957,-7.2094654785,-0.9055892385,"['xas', 'bandstructure']",True,[153662],True,2021-05-12 10:57:23.123000,NM,20,10,mp-568336,,Lu2Si5Ir3,"{'functional': 'PBE', 'labels': ['Lu_3', 'Si', 'Ir'], 'pot_type': 'paw'}","{'Lu': 2.0, 'Si': 5.0, 'Ir': 3.0}",GGA,mp-568336,"['mp-1001425', 'mp-914666', 'mp-568336', 'mp-1144001', 'mp-1249981', 'mp-1432720', 'mp-1708810', 'mp-1813304', 'mp-1007934', 'mp-1607265']",0.00085745,"{'Lu': 4.0, 'Si': 10.0, 'Ir': 6.0}",328.2825671971667,[],NM,False,72,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.223853385336877e-06,0.00085745,0,0.0017149,MP,data/source/MP/cleaned/cifs/MP-mp-568336.cif,False,,data/final/MP/graphs/Ir3Lu2Si5-MP-mp-568336.json,0,True,mmm,0,0,0,7,0,0,0,0,0,1,0,1.0,False
Ge3Ti5,1,0.0,2.0,False,Ge6Ti10,Ge6Ti10,0.0,Other,True,Ge37.5Ti62.5,Ge-Ti,2,Supercon,Ge3Ti5,MP-mp-568151,Ti10Ge6,Ge-Ti,Ge37.5Ti62.5,P 63/m c m,hexagonal,5.22672,7.590718001861709,7.590718329999999,data/final/MP/cifs/Ge3Ti5-MP-mp-568151.cif,data/source/MP/raw/cifs/mp-568151.cif,mp-568151,0.0,,2014-02-24 18:08:55,5.822532877451226,10.17188/1274275,"@misc{osti_1274275,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ti5Ge3 (SG:193) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1274275"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1669048'}},0.0,5.8637515,520.0,-117.82597191,-7.364123244375,{'tags': ['Titanium germanide (5/3)']},-117.82597191,-7.364123244375,-0.6958052883333332,"['xas', 'bandstructure']",True,"[638051, 638048, 638054]",True,2021-05-12 10:57:23.123000,NM,16,8,mp-568151,,Ti5Ge3,"{'functional': 'PBE', 'labels': ['Ti_pv', 'Ge_d'], 'pot_type': 'paw'}","{'Ti': 5.0, 'Ge': 3.0}",GGA,mp-568151,"['mp-944477', 'mp-943829', 'mp-933659', 'mp-568151', 'mp-1418890', 'mp-1669048', 'mp-1877558', 'mp-1598577']",5.46e-05,"{'Ti': 10.0, 'Ge': 6.0}",260.81082129691873,[],NM,False,193,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.186942836841952e-07,5.46e-05,0,0.0001092,MP,data/source/MP/cleaned/cifs/MP-mp-568151.cif,False,,data/final/MP/graphs/Ge3Ti5-MP-mp-568151.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Rb0.33W1O3,2,0.0014212115828743,3.0,False,Rb0.99W3O9,Rb1W3O9,4.985,Oxide,True,Rb7.621W23.095O69.28406466512702,Rb-W-O,3,Supercon,O3Rb0.33W1,MP-mp-565431,Rb1W3O9,Rb-W-O,Rb7.692W23.077O69.23076923076923,P 6/m m m,hexagonal,3.882989,7.530094003231798,7.530093400000001,data/final/MP/cifs/Rb0.33W1O3-MP-mp-565431-synth_doped.cif,data/source/MP/raw/cifs/mp-565431.cif,mp-565431,0.0,,2014-02-23 19:51:49,6.801313653620402,10.17188/1272509,"@misc{osti_1272509,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Rb(WO3)3 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1272509"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-1672885'}},0.0038003846153671,3.17423124,520.0,-93.98226341,-7.229404877692308,{'tags': ['Rubidium tungsten oxide (0.33/1/3)']},-93.98226341,-7.229404877692308,-2.2379000678846164,"['xas', 'bandstructure']",True,[96419],True,2021-05-12 10:57:23.123000,FM,13,15,mp-565431,oxide,Rb(WO3)3,"{'functional': 'PBE', 'labels': ['Rb_sv', 'W_pv', 'O'], 'pot_type': 'paw'}","{'Rb': 1.0, 'W': 3.0, 'O': 9.0}",GGA+U,mp-565431,"['mp-704837', 'mp-932684', 'mp-940813', 'mp-940952', 'mp-565431', 'mp-1179797', 'mp-1192870', 'mp-1414087', 'mp-1427299', 'mp-1672885', 'mp-1670084', 'mp-1833003', 'mp-1609186', 'mp-1605159', 'mp-1984777']",0.8587592,"{'Rb': 1.0, 'W': 3.0, 'O': 9.0}",190.6766621234564,[],FM,True,65,1,"[0.0, 0.4, 0.4, 0.3, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0045037457150575,0.8587592,3,0.8587592,MP,data/source/MP/cleaned/cifs/MP-mp-565431.cif,True,,data/final/MP/graphs/Rb0.33W1O3-MP-mp-565431-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ag0.81Se2Sn1.19,3,0.0949999999999999,1.0,True,Ag0.81Se2Sn1.19,Ag1Se2Sn1,6.415,Other,True,Ag20.25Se50Sn29.75,Ag-Se-Sn,3,Supercon,Ag0.81Sn1.19Se2,MP-mp-1229011,Ag1Sn1Se2,Ag-Se-Sn,Ag25Se50Sn25,R -3 m,trigonal,4.0598026973764,4.0598026973764,7.0325229,data/final/MP/cifs/Ag0.81Se2Sn1.19-MP-mp-1229011-synth_doped.cif,data/source/MP/raw/cifs/mp-1229011.cif,mp-1229011,0.0,,2019-01-13 04:39:21.201000,6.746249424080593,,,{'GGA': {'task_id': 'mp-1766738'}},0.0,4.6965768,520.0,-14.98910359,-3.7472758975,{'tags': []},-14.98910359,-3.7472758975,-0.5247881940885413,['bandstructure'],True,[],True,2021-05-12 10:58:49.477000,NM,4,5,mp-1229011,,AgSnSe2,"{'functional': 'PBE', 'labels': ['Ag', 'Sn_d', 'Se'], 'pot_type': 'paw'}","{'Ag': 1.0, 'Sn': 1.0, 'Se': 2.0}",GGA,mp-1229011,"['mp-1229011', 'mp-1422543', 'mp-1766738', 'mp-1796245', 'mp-1612963']",0.0080447,"{'Ag': 1.0, 'Sn': 1.0, 'Se': 2.0}",94.64136915222257,[],NM,False,166,0,"[0, 0, 0, 0]",8.50019401881305e-05,0.0080447,0,0.0080447,MP,data/source/MP/cleaned/cifs/MP-mp-1229011.cif,True,,data/final/MP/graphs/Ag0.81Se2Sn1.19-MP-mp-1229011-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Cr1Ge1,1,0.0,4.0,False,Cr4Ge4,Cr4Ge4,0.0,Other,True,Cr50Ge50,Cr-Ge,2,Supercon,Cr1Ge1,MP-mp-20861,Cr4Ge4,Cr-Ge,Cr50Ge50,P 21 3,cubic,4.767543,4.767543,4.767543,data/final/MP/cifs/Cr1Ge1-MP-mp-20861.cif,data/source/MP/raw/cifs/mp-20861.cif,mp-20861,0.0,,2014-02-22 08:42:31,7.639572970045499,10.17188/1196057,"@misc{osti_1196057,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CrGe (SG:198) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196057"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702099'}},0.0895945225000005,6.21594329,520.0,-56.98453704,-7.12306713,{'tags': ['Chromium germanide (1/1)']},-56.98453704,-7.12306713,0.0149705325000004,"['xas', 'bandstructure']",True,"[626077, 626099, 42417, 602162, 626090]",True,2021-05-12 10:56:57.051000,FM,8,8,mp-20861,,CrGe,"{'functional': 'PBE', 'labels': ['Cr_pv', 'Ge_d'], 'pot_type': 'paw'}","{'Cr': 1.0, 'Ge': 1.0}",GGA,mp-20861,"['mp-924854', 'mp-909811', 'mp-925396', 'mp-20861', 'mp-1441983', 'mp-1702099', 'mp-1802984', 'mp-1590385']",0.930409025,"{'Cr': 4.0, 'Ge': 4.0}",108.36370774657664,[],FM,True,198,1,"[1.0, 1.0, 1.0, 1.0, 0.0, 0.0, 0.0, 0.0]",0.0343439346750994,0.930409025,4,3.7216361,MP,data/source/MP/cleaned/cifs/MP-mp-20861.cif,False,,data/final/MP/graphs/Cr1Ge1-MP-mp-20861.json,0,True,23,1,0,0,0,0,0,0,1,0,0,0,1.0,False
B2C1Dy0.8Ho0.2Ni2,3,0.0666666666666666,1.0,True,B2C1Dy0.8Ho0.2Ni2,B2C1Dy1Ni2,6.215,Other,True,B33.333C16.667Dy13.333Ho3.333Ni33.333,B-C-Dy-Ho-Ni,5,Supercon,Ho0.2Dy0.8Ni2B2C1,MP-mp-6223,Dy1Ni2B2C1,B-C-Dy-Ni,B33.333C16.667Dy16.667Ni33.333,I 4/m m m,tetragonal,3.5485979995620824,3.548597999562083,5.74460959,data/final/MP/cifs/B2C1Dy0.8Ho0.2Ni2-MP-mp-6223-synth_doped.cif,data/source/MP/raw/cifs/mp-6223.cif,mp-6223,0.0,,2011-05-13 04:15:09,8.00036369104547,10.17188/1278123,"@misc{osti_1278123,
    author = ""Persson, Kristin"",
    title = ""Materials Data on DyNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278123"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687390'}},0.0,6.75219219,520.0,-41.84976027,-6.974960045,{'tags': []},-41.84976027,-6.974960045,-0.5161893047222215,"['xas', 'elasticity', 'bandstructure']",True,"[56596, 56593, 56595, 79573, 56649, 56594]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-6223,,DyNi2B2C,"{'functional': 'PBE', 'labels': ['Dy_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Dy': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6223,"['mp-1007344', 'mp-1000899', 'mp-6223', 'mp-1439353', 'mp-1687390', 'mp-1795426', 'mp-1012086', 'mp-1593735']",0.004911,"{'Dy': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.07346390684725,[],NM,False,139,0,"[0.0, -0.0, -0.0, 0.0, 0.0, 0.0]",7.546855054512086e-05,0.004911,0,0.004911,MP,data/source/MP/cleaned/cifs/MP-mp-6223.cif,True,,data/final/MP/graphs/B2C1Dy0.8Ho0.2Ni2-MP-mp-6223-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
C1Mo0.95Ta0.05,2,0.05,1.0,True,C1Mo0.95Ta0.05,C1Mo1,11.8,Other,True,C50Mo47.5Ta2.5,C-Mo-Ta,3,Supercon,Ta0.05Mo0.95C1,MP-mp-2305,Mo1C1,C-Mo,C50Mo50,P -6 m 2,hexagonal,2.835086,2.92410600478411,2.92410507,data/final/MP/cifs/C1Mo0.95Ta0.05-MP-mp-2305-synth_doped.cif,data/source/MP/raw/cifs/mp-2305.cif,mp-2305,0.0,,2011-05-12 17:49:42,8.538697979393088,10.17188/1199194,"@misc{osti_1199194,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MoC (SG:187) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199194"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668222'}},0.0010243049999996,8.62658168,520.0,-20.24014809,-10.120074045,{'tags': ['Molybdenum carbide (1/1)']},-20.24014809,-10.120074045,-0.0838621800000005,"['xas', 'elasticity', 'bandstructure']",True,"[77156, 618300]",True,2021-05-12 10:56:16.728000,NM,2,9,mp-2305,,MoC,"{'functional': 'PBE', 'labels': ['Mo_pv', 'C'], 'pot_type': 'paw'}","{'Mo': 1.0, 'C': 1.0}",GGA,mp-2305,"['mp-927633', 'mp-927239', 'mp-911174', 'mp-2305', 'mp-1116092', 'mp-1440368', 'mp-1668222', 'mp-1791400', 'mp-1638434']",0.0001977,"{'Mo': 1.0, 'C': 1.0}",20.99340614335182,[],NM,False,187,0,"[0, 0]",9.417242664197564e-06,0.0001977,0,0.0001977,MP,data/source/MP/cleaned/cifs/MP-mp-2305.cif,True,,data/final/MP/graphs/C1Mo0.95Ta0.05-MP-mp-2305-synth_doped.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Al1Si1Sr1,1,0.0,1.0,True,Al1Si1Sr1,Al1Si1Sr1,4.75,Other,True,Al33.333Si33.333Sr33.333,Al-Si-Sr,3,Supercon,Sr1Al1Si1,MP-mp-3698,Sr1Al1Si1,Al-Si-Sr,Al33.333Si33.333Sr33.333,P -6 m 2,hexagonal,4.267566002167266,4.26756551,4.749876,data/final/MP/cifs/Al1Si1Sr1-MP-mp-3698.cif,data/source/MP/raw/cifs/mp-3698.cif,mp-3698,0.0,,2011-05-12 18:06:26,3.162716702320716,10.17188/1207287,"@misc{osti_1207287,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SrAlSi (SG:187) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207287"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1001320'}},0.0,4.62078931,520.0,-12.05737377,-4.01912459,"{'tags': ['Strontium aluminium silicide (1/1/1)', 'Strontium aluminium silicide (1/1/1) - (SrPtSb)-type']}",-12.05737377,-4.01912459,-0.3753301555555559,"['xas', 'elasticity', 'bandstructure']",True,"[158842, 162865]",True,2021-05-12 10:56:20.740000,NM,3,9,mp-3698,,SrAlSi,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Al', 'Si'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Al': 1.0, 'Si': 1.0}",GGA,mp-3698,"['mp-1000389', 'mp-1001320', 'mp-3698', 'mp-1171235', 'mp-1256536', 'mp-1437631', 'mp-1798616', 'mp-1007670', 'mp-1596868']",0.0015381,"{'Sr': 1.0, 'Al': 1.0, 'Si': 1.0}",74.91578417975403,[],NM,False,187,0,"[0, 0, 0]",2.053105386055174e-05,0.0015381,0,0.0015381,MP,data/source/MP/cleaned/cifs/MP-mp-3698.cif,False,,data/final/MP/graphs/Al1Si1Sr1-MP-mp-3698.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Bi1La0.7S2Ti0.3O1,3,0.12,2.0,False,Bi2La1.4S4Ti0.6O2,Bi2La2S4O2,2.22,Oxide,True,Bi20La14S40Ti6O20,Bi-La-S-Ti-O,5,Supercon,La0.7Ti0.3Bi1S2O1,MP-mp-1078397,La2Bi2S4O2,Bi-La-S-O,Bi20La20S40O20,P 4/n m m,tetragonal,4.055497,4.055497,14.173265,data/final/MP/cifs/Bi1La0.7S2Ti0.3O1-MP-mp-1078397-synth_doped.cif,data/source/MP/raw/cifs/mp-1078397.cif,mp-1078397,1.0743999999999998,,2018-04-11 10:57:38,6.097899749460756,,,{'GGA': {'task_id': 'mp-1676377'}},0.0053330699999989,4.69184382,520.0,-61.66700475,-6.166700475,{'tags': ['Lanthanum bismuth oxodisulphate']},-61.66700475,-6.166700475,-2.09592004425,['bandstructure'],True,[196231],True,2021-05-12 10:58:14.654000,NM,10,5,mp-1078397,oxide,LaBiS2O,"{'functional': 'PBE', 'labels': ['La', 'Bi', 'S', 'O'], 'pot_type': 'paw'}","{'La': 1.0, 'Bi': 1.0, 'S': 2.0, 'O': 1.0}",GGA,mp-1078397,"['mp-1078397', 'mp-1380859', 'mp-1676377', 'mp-1776923', 'mp-1600973']",6.57e-05,"{'La': 2.0, 'Bi': 2.0, 'S': 4.0, 'O': 2.0}",233.1084819815865,[],NM,False,129,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.636860524465146e-07,6.57e-05,0,0.0001314,MP,data/source/MP/cleaned/cifs/MP-mp-1078397.cif,True,,data/final/MP/graphs/Bi1La0.7S2Ti0.3O1-MP-mp-1078397-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
La0.96Nd0.04Pt1Si1,2,0.0266666666666666,2.0,False,La1.92Nd0.08Pt2Si2,La2Pt2Si2,3.04,Other,True,La32Nd1.333Pt33.333Si33.333,La-Nd-Pt-Si,4,Supercon,La0.96Nd0.04Pt1Si1,MP-mp-1206485,La2Si2Pt2,La-Pt-Si,La33.333Pt33.333Si33.333,I 41 m d,tetragonal,4.277808001286174,4.277808001286175,7.94541446,data/final/MP/cifs/La0.96Nd0.04Pt1Si1-MP-mp-1206485-synth_doped.cif,data/source/MP/raw/cifs/mp-1206485.cif,mp-1206485,0.0,,2019-01-12 09:47:13.211000,8.943745313538361,,,{'GGA': {'task_id': 'mp-1734531'}},0.0,7.90579938,520.0,-39.77896993,-6.629828321666667,{'tags': ['LaPtSi']},-39.77896993,-6.629828321666667,-1.1287520433333331,['bandstructure'],True,[],True,2021-05-12 10:58:37.524000,NM,6,5,mp-1206485,,LaSiPt,"{'functional': 'PBE', 'labels': ['La', 'Si', 'Pt'], 'pot_type': 'paw'}","{'La': 1.0, 'Si': 1.0, 'Pt': 1.0}",GGA,mp-1206485,"['mp-1206485', 'mp-1387492', 'mp-1734531', 'mp-1788111', 'mp-1628393']",1.825e-05,"{'La': 2.0, 'Si': 2.0, 'Pt': 2.0}",134.4491846861766,[],NM,False,109,0,"[0, 0, 0, 0, 0, 0]",2.714780315343388e-07,1.825e-05,0,3.65e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1206485.cif,True,,data/final/MP/graphs/La0.96Nd0.04Pt1Si1-MP-mp-1206485-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,0,0,1,0,1.0,False
Fe1Se0.328Te0.492,3,0.1395604395604395,2.0,False,Fe2Se0.656Te0.984,Fe2Se1Te1,13.8,Ferrite,True,Fe54.945Se18.022Te27.033,Fe-Se-Te,3,Supercon,Fe1Se0.328Te0.492,MP-mp-1225136,Fe2Te1Se1,Fe-Se-Te,Fe50Se25Te25,P 4 m m,tetragonal,3.755398,3.755398,5.937717,data/final/MP/cifs/Fe1Se0.328Te0.492-MP-mp-1225136-synth_doped.cif,data/source/MP/raw/cifs/mp-1225136.cif,mp-1225136,0.0,,2019-01-13 01:17:25.998000,6.310824077785493,,,{'GGA': {'task_id': 'mp-1764167'}},0.0802741556250001,4.86336573,520.0,-24.0729629,-6.018240725,{'tags': []},-24.0729629,-6.018240725,-0.3469333980859375,['bandstructure'],True,[],True,2021-05-12 10:58:45.495000,FM,4,5,mp-1225136,,Fe2TeSe,"{'functional': 'PBE', 'labels': ['Fe_pv', 'Te', 'Se'], 'pot_type': 'paw'}","{'Fe': 2.0, 'Te': 1.0, 'Se': 1.0}",GGA,mp-1225136,"['mp-1225136', 'mp-1425562', 'mp-1764167', 'mp-1784460', 'mp-1615275']",0.1061773,"{'Fe': 2.0, 'Te': 1.0, 'Se': 1.0}",83.73970680084179,[],FM,True,99,1,"[0.1, 0.1, -0.0, -0.0]",0.0012679444920021,0.1061773,2,0.1061773,MP,data/source/MP/cleaned/cifs/MP-mp-1225136.cif,True,,data/final/MP/graphs/Fe1Se0.328Te0.492-MP-mp-1225136-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
Ca1.7Cl2Cu1K0.3O2,3,0.0857142857142857,1.0,True,Ca1.7Cl2Cu1K0.3O2,Ca2Cl2Cu1O2,24.0,Cuprate,True,Ca24.286Cl28.571Cu14.286K4.286O28.571428571428573,Ca-Cl-Cu-K-O,5,Supercon,Ca1.7K0.3Cu1Cl2O2,MP-mp-23143,Ca2Cu1Cl2O2,Ca-Cl-Cu-O,Ca28.571Cl28.571Cu14.286O28.571428571428573,I 4/m m m,tetragonal,3.88024600076171,3.880246000761709,8.12907187,data/final/MP/cifs/Ca1.7Cl2Cu1K0.3O2-MP-mp-23143-synth_doped.cif,data/source/MP/raw/cifs/mp-23143.cif,mp-23143,0.0,,2014-02-21 09:50:06,3.554337150605878,10.17188/1199263,"@misc{osti_1199263,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ca2Cu(ClO)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199263"",
    place = ""United States"",
    year = ""2016"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700223'}},0.0191527683333321,4.19679796,520.0,-35.95348475,-5.136212107142858,"{'tags': ['Dicalcium copper dioxide dichloride', 'Dicalcium dichlorodioxocuprate']}",-35.95348475,-5.136212107142858,-2.407440427142858,"['xas', 'elasticity', 'bandstructure']",True,"[1027, 83117, 41581]",True,2021-05-12 10:56:16.728000,NM,7,8,mp-23143,oxide,Ca2Cu(ClO)2,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Cu_pv', 'Cl', 'O'], 'pot_type': 'paw'}","{'Ca': 2.0, 'Cu': 1.0, 'Cl': 2.0, 'O': 2.0}",GGA,mp-23143,"['mp-992231', 'mp-990553', 'mp-23143', 'mp-1436301', 'mp-1700223', 'mp-1803462', 'mp-993865', 'mp-1592909']",0.0134962,"{'Ca': 2.0, 'Cu': 1.0, 'Cl': 2.0, 'O': 2.0}",115.21141865211318,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001171429026557,0.0134962,0,0.0134962,MP,data/source/MP/cleaned/cifs/MP-mp-23143.cif,True,,data/final/MP/graphs/Ca1.7Cl2Cu1K0.3O2-MP-mp-23143-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Hf0.13V2Zr0.87,3,0.0866666666666666,4.0,False,Hf0.52V8Zr3.48,V8Zr4,9.45,Other,True,Hf4.333V66.667Zr29,Hf-V-Zr,3,Supercon,Zr0.87Hf0.13V2,MP-mp-1103264,Zr4V8,V-Zr,V66.667Zr33.333,P 63/m m c,hexagonal,5.208193229598517,5.20819373,8.45714,data/final/MP/cifs/Hf0.13V2Zr0.87-MP-mp-1103264-synth_doped.cif,data/source/MP/raw/cifs/mp-1103264.cif,mp-1103264,0.0,,2018-07-18 17:51:18,6.456226553557358,,,,0.0325666608333339,4.94123829,520.0,-106.47125115,-8.8726042625,{'tags': ['Vanadium zirconium (2/1)']},-106.47125115,-8.8726042625,0.0325666608333321,[],False,[653414],True,2021-05-12 10:59:31.014000,FM,12,3,mp-1103264,,ZrV2,"{'functional': 'PBE', 'labels': ['Zr_sv', 'V_pv'], 'pot_type': 'paw'}","{'Zr': 1.0, 'V': 2.0}",GGA,mp-1103264,"['mp-1103264', 'mp-1834547', 'mp-1986833']",0.158094725,"{'Zr': 4.0, 'V': 8.0}",198.6681941061952,[],FM,True,194,2,"[0.0, 0.0, 0.0, 0.0, -0.0, -0.0, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1]",0.0031830907954092,0.158094725,6,0.6323789,MP,data/source/MP/cleaned/cifs/MP-mp-1103264.cif,True,,data/final/MP/graphs/Hf0.13V2Zr0.87-MP-mp-1103264-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Cr0.03N1Nb0.97,2,0.03,1.0,True,Cr0.03N1Nb0.97,N1Nb1,0.6,Other,True,Cr1.5N50Nb48.5,Cr-N-Nb,3,Supercon,Cr0.03N1Nb0.97,MP-mp-2634,Nb1N1,N-Nb,N50Nb50,P -6 m 2,hexagonal,2.898656,2.9761920047347994,2.97619211,data/final/MP/cifs/Cr0.03N1Nb0.97-MP-mp-2634-synth_doped.cif,data/source/MP/raw/cifs/mp-2634.cif,mp-2634,0.0,,2011-05-12 17:49:04,7.984187332554685,10.17188/1201157,"@misc{osti_1201157,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbN (SG:187) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201157"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671304'}},0.0,7.12357548,520.0,-20.57319827,-10.286599135,"{'tags': ['Niobium nitride (1/1)', 'Niobium nitride', 'Niobium nitride (1/1) - gamma']}",-20.57319827,-10.286599135,-1.2481991524999998,"['xas', 'elasticity', 'bandstructure']",True,"[185569, 644536, 76385, 191062]",True,2021-05-12 10:56:18.721000,NM,2,17,mp-2634,,NbN,"{'functional': 'PBE', 'labels': ['Nb_pv', 'N'], 'pot_type': 'paw'}","{'Nb': 1.0, 'N': 1.0}",GGA,mp-2634,"['mp-926732', 'mp-910421', 'mp-926222', 'mp-2634', 'mp-1058402', 'mp-1058440', 'mp-1058487', 'mp-1061535', 'mp-1061589', 'mp-1061648', 'mp-1116126', 'mp-1442283', 'mp-1671304', 'mp-1924826', 'mp-1594881', 'mp-1061618', 'mp-1058457']",0.0002504,"{'Nb': 1.0, 'N': 1.0}",22.23561881453577,[],NM,False,187,0,"[0, 0]",1.1261211216496917e-05,0.0002504,0,0.0002504,MP,data/source/MP/cleaned/cifs/MP-mp-2634.cif,True,,data/final/MP/graphs/Cr0.03N1Nb0.97-MP-mp-2634-synth_doped.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
B2Mg0.98Sc0.02,2,0.0133333333333333,1.0,True,B2Mg0.98Sc0.02,B2Mg1,39.0,Other,True,B66.667Mg32.667Sc0.667,B-Mg-Sc,3,Supercon,Mg0.98Sc0.02B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B2Mg0.98Sc0.02-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B2Mg0.98Sc0.02-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Fe1Ti1,1,0.0,1.0,True,Fe1Ti1,Fe1Ti1,0.0,Other,True,Fe50Ti50,Fe-Ti,2,Supercon,Fe1Ti1,MP-mp-305,Ti1Fe1,Fe-Ti,Fe50Ti50,P m -3 m,cubic,2.959777,2.959777,2.959777,data/final/MP/cifs/Fe1Ti1-MP-mp-305.cif,data/source/MP/raw/cifs/mp-305.cif,mp-305,0.0,,2011-05-12 19:25:54,6.642034602201166,10.17188/1204904,"@misc{osti_1204904,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TiFe (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1204904"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668668'}},0.0,6.52416442,520.0,-17.20717353,-8.603586765,"{'tags': ['Titanium iron (1/1)', 'Iron titanium (1/1)', 'Titanium iron hydrogen (1/1/0.06)', 'High pressure experimental phase']}",-17.20717353,-8.603586765,-0.4208365316666658,"['xas', 'elasticity', 'bandstructure']",True,"[103661, 633946, 633950, 103660, 189112, 96139, 189113, 190972, 633925, 100533, 633930, 189111, 150938, 633937]",True,2021-05-12 10:56:18.721000,NM,2,29,mp-305,,TiFe,"{'functional': 'PBE', 'labels': ['Ti_pv', 'Fe_pv'], 'pot_type': 'paw'}","{'Ti': 1.0, 'Fe': 1.0}",GGA,mp-305,"['mp-905481', 'mp-919593', 'mp-918602', 'mp-305', 'mp-1058742', 'mp-1058998', 'mp-1059012', 'mp-1058696', 'mp-1058710', 'mp-1059048', 'mp-1059195', 'mp-1059224', 'mp-1059179', 'mp-1060004', 'mp-1060018', 'mp-1060047', 'mp-1060498', 'mp-1060508', 'mp-1060546', 'mp-1440570', 'mp-1668668', 'mp-1795534', 'mp-1591566', 'mp-1595202', 'mp-1059213', 'mp-1060037', 'mp-1060535', 'mp-1059040', 'mp-1058728']",0.0001967,"{'Ti': 1.0, 'Fe': 1.0}",25.928474931182425,[],NM,False,221,0,"[0.0, 0.0]",7.586254128793445e-06,0.0001967,0,0.0001967,MP,data/source/MP/cleaned/cifs/MP-mp-305.cif,False,,data/final/MP/graphs/Fe1Ti1-MP-mp-305.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ce1Co0.8In5Ni0.2,3,0.0571428571428571,1.0,True,Ce1Co0.8In5Ni0.2,Ce1Co1In5,0.88,Heavy_fermion,True,Ce14.286Co11.429In71.429Ni2.857,Ce-Co-In-Ni,4,Supercon,Ce1Co0.8Ni0.2In5,MP-mp-19961,Ce1In5Co1,Ce-Co-In,Ce14.286Co14.286In71.429,P 4/m m m,tetragonal,4.635989,4.635989,7.564124,data/final/MP/cifs/Ce1Co0.8In5Ni0.2-MP-mp-19961-synth_doped.cif,data/source/MP/raw/cifs/mp-19961.cif,mp-19961,0.0,,2014-02-21 14:08:25,7.897022127398995,10.17188/1195145,"@misc{osti_1195145,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeIn5Co (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195145"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701944'}},0.0,7.80626318,520.0,-28.52795357,-4.075421938571429,{'tags': ['Cerium cobalt indium (1/1/5)']},-28.52795357,-4.075421938571429,-0.2468754242857146,"['xas', 'bandstructure']",True,[102108],True,2021-05-12 10:56:57.051000,FM,7,8,mp-19961,,CeIn5Co,"{'functional': 'PBE', 'labels': ['Ce', 'In_d', 'Co'], 'pot_type': 'paw'}","{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",GGA,mp-19961,"['mp-928775', 'mp-912209', 'mp-928270', 'mp-19961', 'mp-1504062', 'mp-1701944', 'mp-1785253', 'mp-1593180']",0.9310323,"{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",162.57113333428427,[],FM,True,123,1,"[0.7, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0057269226147644,0.9310323,1,0.9310323,MP,data/source/MP/cleaned/cifs/MP-mp-19961.cif,True,,data/final/MP/graphs/Ce1Co0.8In5Ni0.2-MP-mp-19961-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ba1Pt2,1,0.0,2.0,False,Ba2Pt4,Ba2Pt4,0.0,Other,True,Ba33.333Pt66.667,Ba-Pt,2,Supercon,Ba1Pt2,MP-mp-747,Ba2Pt4,Ba-Pt,Ba33.333Pt66.667,F d -3 m,cubic,5.71509439,5.715094389999999,5.71509439,data/final/MP/cifs/Ba1Pt2-MP-mp-747.cif,data/source/MP/raw/cifs/mp-747.cif,mp-747,0.0,,2011-05-13 08:19:44,13.272178536079355,10.17188/1288473,"@misc{osti_1288473,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BaPt2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1288473"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698099'}},0.0,5.38081434,520.0,-32.47947217,-5.413245361666667,{'tags': ['Barium platinum (1/2)']},-32.47947217,-5.413245361666667,-0.726316611666667,"['bandstructure', 'elasticity']",True,"[616039, 616040, 58675]",True,2021-05-12 10:56:29.056000,NM,6,8,mp-747,,BaPt2,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Pt'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Pt': 2.0}",GGA,mp-747,"['mp-941057', 'mp-941373', 'mp-747', 'mp-934515', 'mp-1413497', 'mp-1698099', 'mp-1861643', 'mp-1589445']",0.00010585,"{'Ba': 2.0, 'Pt': 4.0}",131.99431465678856,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",1.6038569581611304e-06,0.00010585,0,0.0002117,MP,data/source/MP/cleaned/cifs/MP-mp-747.cif,False,,data/final/MP/graphs/Ba1Pt2-MP-mp-747.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
As1Co0.023Fe0.977Na1,2,0.0153333333333333,2.0,False,As2Co0.046Fe1.954Na2,As2Fe2Na2,15.7,Ferrite,True,As33.333Co0.767Fe32.567Na33.333,As-Co-Fe-Na,4,Supercon,Na1Fe0.977Co0.023As1,MP-mp-22152,Na2Fe2As2,As-Fe-Na,As33.333Fe33.333Na33.333,P 4/n m m,tetragonal,3.923688,3.923688,6.918844,data/final/MP/cifs/As1Co0.023Fe0.977Na1-MP-mp-22152-synth_doped.cif,data/source/MP/raw/cifs/mp-22152.cif,mp-22152,0.0,,2014-02-21 10:51:39,4.793908463406792,10.17188/1197381,"@misc{osti_1197381,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NaFeAs (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197381"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704688'}},0.0,4.10723066,520.0,-30.57538864,-5.095898106666667,{'tags': ['Sodium iron arsenide']},-30.57538864,-5.095898106666667,-0.2786807238505749,"['xas', 'elasticity', 'bandstructure']",True,"[163144, 163143]",True,2021-05-12 10:56:16.728000,FM,6,8,mp-22152,,NaFeAs,"{'functional': 'PBE', 'labels': ['Na_pv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Na': 1.0, 'Fe': 1.0, 'As': 1.0}",GGA,mp-22152,"['mp-906352', 'mp-920130', 'mp-919102', 'mp-22152', 'mp-1413190', 'mp-1704688', 'mp-1797758', 'mp-1594769']",0.0693226,"{'Na': 2.0, 'Fe': 2.0, 'As': 2.0}",106.5178694490858,[],FM,True,129,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.0]",0.0013016144682303,0.0693226,2,0.1386452,MP,data/source/MP/cleaned/cifs/MP-mp-22152.cif,True,,data/final/MP/graphs/As1Co0.023Fe0.977Na1-MP-mp-22152-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B2C1Dy0.95Lu0.05Ni2,2,0.0166666666666666,1.0,True,B2C1Dy0.95Lu0.05Ni2,B2C1Dy1Ni2,5.325,Other,True,B33.333C16.667Dy15.833Lu0.833Ni33.333,B-C-Dy-Lu-Ni,5,Supercon,Lu0.05Dy0.95Ni2B2C1,MP-mp-6223,Dy1Ni2B2C1,B-C-Dy-Ni,B33.333C16.667Dy16.667Ni33.333,I 4/m m m,tetragonal,3.5485979995620824,3.548597999562083,5.74460959,data/final/MP/cifs/B2C1Dy0.95Lu0.05Ni2-MP-mp-6223-synth_doped.cif,data/source/MP/raw/cifs/mp-6223.cif,mp-6223,0.0,,2011-05-13 04:15:09,8.00036369104547,10.17188/1278123,"@misc{osti_1278123,
    author = ""Persson, Kristin"",
    title = ""Materials Data on DyNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278123"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687390'}},0.0,6.75219219,520.0,-41.84976027,-6.974960045,{'tags': []},-41.84976027,-6.974960045,-0.5161893047222215,"['xas', 'elasticity', 'bandstructure']",True,"[56596, 56593, 56595, 79573, 56649, 56594]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-6223,,DyNi2B2C,"{'functional': 'PBE', 'labels': ['Dy_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Dy': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6223,"['mp-1007344', 'mp-1000899', 'mp-6223', 'mp-1439353', 'mp-1687390', 'mp-1795426', 'mp-1012086', 'mp-1593735']",0.004911,"{'Dy': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.07346390684725,[],NM,False,139,0,"[0.0, -0.0, -0.0, 0.0, 0.0, 0.0]",7.546855054512086e-05,0.004911,0,0.004911,MP,data/source/MP/cleaned/cifs/MP-mp-6223.cif,True,,data/final/MP/graphs/B2C1Dy0.95Lu0.05Ni2-MP-mp-6223-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Bi2Ca0.85Cu2Pr0.15Sr2O8,2,0.02,2.0,False,Bi4Ca1.7Cu4Pr0.3Sr4O16,Bi4Ca2Cu4Sr4O16,68.35,Cuprate,True,Bi13.333Ca5.667Cu13.333Pr1Sr13.333O53.333333333333336,Bi-Ca-Cu-Pr-Sr-O,6,Supercon,Bi2Sr2Ca0.85Pr0.15Cu2O8,MP-mp-1218930,Sr4Ca2Cu4Bi4O16,Bi-Ca-Cu-Sr-O,Bi13.333Ca6.667Cu13.333Sr13.333O53.333333333333336,C c c 2,orthorhombic,5.417115,5.472898000129128,16.11398919,data/final/MP/cifs/Bi2Ca0.85Cu2Pr0.15Sr2O8-MP-mp-1218930-synth_doped.cif,data/source/MP/raw/cifs/mp-1218930.cif,mp-1218930,0.0,,2019-01-12 20:01:06.544000,6.266668983881059,,,,0.039252223722225,4.51768334,520.0,-173.15021002,-5.771673667333333,{'tags': []},-173.15021002,-5.771673667333333,-2.074956548222222,[],False,[],True,2021-05-12 11:00:42.526000,NM,30,3,mp-1218930,oxide,Sr2CaCu2(BiO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",GGA,mp-1218930,"['mp-1218930', 'mp-1359698', 'mp-1817714']",0.00011165,"{'Sr': 4.0, 'Ca': 2.0, 'Cu': 4.0, 'Bi': 4.0, 'O': 16.0}",470.7976286073367,[],NM,False,37,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.743014544498498e-07,0.00011165,0,0.0002233,MP,data/source/MP/cleaned/cifs/MP-mp-1218930.cif,True,,data/final/MP/graphs/Bi2Ca0.85Cu2Pr0.15Sr2O8-MP-mp-1218930-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Ru1Sb1,1,0.0,4.0,False,Ru4Sb4,Ru4Sb4,0.6,Other,True,Ru50Sb50,Ru-Sb,2,Supercon,Ru1Sb1,MP-mp-7565,Sb4Ru4,Ru-Sb,Ru50Sb50,P n m a,orthorhombic,3.799166,5.959017,6.660255,data/final/MP/cifs/Ru1Sb1-MP-mp-7565.cif,data/source/MP/raw/cifs/mp-7565.cif,mp-7565,0.0,,2011-05-29 09:37:48,9.815874508363276,10.17188/1290535,"@misc{osti_1290535,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SbRu (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1290535"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697553'}},0.0490160212500008,8.82050663,520.0,-54.74428516,-6.843035645,{'tags': ['Ruthenium(III) antimonide']},-54.74428516,-6.843035645,-0.2373401974999991,"['bandstructure', 'elasticity']",True,[990],True,2021-05-12 10:56:29.056000,NM,8,8,mp-7565,,SbRu,"{'functional': 'PBE', 'labels': ['Sb', 'Ru_pv'], 'pot_type': 'paw'}","{'Sb': 1.0, 'Ru': 1.0}",GGA,mp-7565,"['mp-909332', 'mp-925074', 'mp-924301', 'mp-7565', 'mp-1423227', 'mp-1697553', 'mp-1784564', 'mp-1593835']",0.009875375,"{'Sb': 4.0, 'Ru': 4.0}",150.7834762537834,[],NM,False,62,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0002619749920973,0.009875375,0,0.0395015,MP,data/source/MP/cleaned/cifs/MP-mp-7565.cif,False,,data/final/MP/graphs/Ru1Sb1-MP-mp-7565.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Er5Ir4Si10,1,0.0,2.0,False,Er10Ir8Si20,Er10Ir8Si20,0.0,Other,True,Er26.316Ir21.053Si52.632,Er-Ir-Si,3,Supercon,Er5Ir4Si10,MP-mp-1195957,Er10Si20Ir8,Er-Ir-Si,Er26.316Ir21.053Si52.632,P 4/m b m,tetragonal,4.246035,12.617104,12.617104,data/final/MP/cifs/Er5Ir4Si10-MP-mp-1195957.cif,data/source/MP/raw/cifs/mp-1195957.cif,mp-1195957,0.0,,2019-01-12 01:13:21.381000,9.266633588794765,,,{'GGA': {'task_id': 'mp-1683383'}},0.0,7.05217824,520.0,-258.89594896,-6.813051288421053,"{'tags': ['Er5Ir4Si10 rt', 'Sc5Co4Si10', 'Erbium iridium silicide (5/4/10)']}",-258.89594896,-6.813051288421053,-0.8575009763157886,[],False,[630722],True,2021-05-12 10:59:59.077000,NM,38,3,mp-1195957,,Er5(Si5Ir2)2,"{'functional': 'PBE', 'labels': ['Er_3', 'Si', 'Ir'], 'pot_type': 'paw'}","{'Er': 5.0, 'Si': 10.0, 'Ir': 4.0}",GGA,mp-1195957,"['mp-1195957', 'mp-1373932', 'mp-1683383']",0.00527825,"{'Er': 10.0, 'Si': 20.0, 'Ir': 8.0}",675.9318881665478,[],NM,False,6,0,"[0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",1.5617697855081674e-05,0.00527825,0,0.0105565,MP,data/source/MP/cleaned/cifs/MP-mp-1195957.cif,False,,data/final/MP/graphs/Er5Ir4Si10-MP-mp-1195957.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
As1Co0.3Fe0.7Pr1O1,3,0.15,2.0,False,As2Co0.6Fe1.4Pr2O2,As2Fe2Pr2O2,4.0,Ferrite,True,As25Co7.5Fe17.5Pr25O25,As-Co-Fe-Pr-O,5,Supercon,Pr1Fe0.7Co0.3As1O1,MP-mp-22491,Pr2Fe2As2O2,As-Fe-Pr-O,As25Fe25Pr25O25,P 4/n m m,tetragonal,4.094889,4.094889,9.258722,data/final/MP/cifs/As1Co0.3Fe0.7Pr1O1-MP-mp-22491-synth_doped.cif,data/source/MP/raw/cifs/mp-22491.cif,mp-22491,0.0,,2014-02-25 19:17:30,6.153806906111091,,,{'GGA+U': {'task_id': 'mp-1695715'}},0.3808778432291664,4.12348168,520.0,-51.7633941,-6.4704242625,{'tags': ['Praseodymium iron arsenic oxide (1/1/1/1)']},-51.7633941,-6.4704242625,-1.491677511249999,"['xas', 'bandstructure']",True,"[162830, 162833, 246832, 90316, 422000, 236649, 236648, 602491]",True,2021-05-12 10:57:10.838000,FM,8,8,mp-22491,oxide,PrFeAsO,"{'functional': 'PBE', 'labels': ['Pr_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Pr': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-22491,"['mp-510622', 'mp-1079608', 'mp-1079857', 'mp-22491', 'mp-1476145', 'mp-1695715', 'mp-1778524', 'mp-1596397']",3.7947681,"{'Pr': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",155.25132378854377,[],FM,True,129,1,"[0.0, 0.0, 3.5, 3.5, 0.0, 0.0, 0.0, 0.0]",0.0488854846116297,3.7947681,2,7.5895362,MP,data/source/MP/cleaned/cifs/MP-mp-22491.cif,True,,data/final/MP/graphs/As1Co0.3Fe0.7Pr1O1-MP-mp-22491-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
P1Ru1Ta1,1,0.0,4.0,False,P4Ru4Ta4,P4Ru4Ta4,0.0,Other,True,P33.333Ru33.333Ta33.333,P-Ru-Ta,3,Supercon,Ta1Ru1P1,MP-mp-1103180,Ta4P4Ru4,P-Ru-Ta,P33.333Ru33.333Ta33.333,P n m a,orthorhombic,3.736005,6.335596,7.207608,data/final/MP/cifs/P1Ru1Ta1-MP-mp-1103180.cif,data/source/MP/raw/cifs/mp-1103180.cif,mp-1103180,0.0,,2018-07-18 17:28:55,12.185847698030832,,,{'GGA': {'task_id': 'mp-1702121'}},0.0,9.20732252,520.0,-115.52204539,-9.626837115833334,"{'tags': ['Ruthenium tantalum phosphide (1/1/1)', 'AlB2 family', 'TiNiSi', 'TaRuP']}",-115.52204539,-9.626837115833334,-0.7783471852777785,['bandstructure'],True,[648031],True,2021-05-12 10:58:20.361000,NM,12,5,mp-1103180,,TaPRu,"{'functional': 'PBE', 'labels': ['Ta_pv', 'P', 'Ru_pv'], 'pot_type': 'paw'}","{'Ta': 1.0, 'P': 1.0, 'Ru': 1.0}",GGA,mp-1103180,"['mp-1103180', 'mp-1422097', 'mp-1702121', 'mp-1784995', 'mp-1599813']",3.925e-06,"{'Ta': 4.0, 'P': 4.0, 'Ru': 4.0}",170.6027719825409,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",9.20266407019852e-08,3.925e-06,0,1.57e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1103180.cif,False,,data/final/MP/graphs/P1Ru1Ta1-MP-mp-1103180.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ba2Co1Cu2Sm1O7.12,2,0.0084427767354596,0.983029213483146,True,Ba1.966Co0.983Cu1.966Sm0.983O7,Ba2Co1Cu2Sm1O7,0.0,Cuprate,True,Ba15.244Co7.622Cu15.244Sm7.622O54.26829268292683,Ba-Co-Cu-Sm-O,5,Supercon,Sm1Ba2Cu2Co1O7.12,MP-mp-1214586,Ba2Sm1Co1Cu2O7,Ba-Co-Cu-Sm-O,Ba15.385Co7.692Cu15.385Sm7.692O53.84615384615385,P m m m,orthorhombic,3.90166,3.937522,11.894772,data/final/MP/cifs/Ba2Co1Cu2Sm1O7.12-MP-mp-1214586-synth_doped.cif,data/source/MP/raw/cifs/mp-1214586.cif,mp-1214586,0.0,,2019-01-12 16:24:17.399000,6.570219498530815,,,{'GGA+U': {'task_id': 'mp-1741705'}},0.0297835145192344,3.24317942,520.0,-80.78959391,-6.214584146923077,"{'tags': ['Ba2Cu2SmCoO7', 'high-Tc cuprate family', 'Ba2Cu2(Cu0.89Al0.11)YO7']}",-80.78959391,-6.214584146923077,-2.210585226538461,[],False,[],True,2021-05-12 11:00:35.508000,FM,13,4,mp-1214586,oxide,Ba2SmCoCu2O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Sm_3', 'Co', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Sm': 1.0, 'Co': 1.0, 'Cu': 2.0, 'O': 7.0}",GGA+U,mp-1214586,"['mp-1214586', 'mp-1408781', 'mp-1741705', 'mp-1785819']",2.5205311,"{'Ba': 2.0, 'Sm': 1.0, 'Co': 1.0, 'Cu': 2.0, 'O': 7.0}",182.7378607343197,[],FM,True,47,1,"[0.0, 0.0, 0.0, 2.2, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0137931520587546,2.5205311,1,2.5205311,MP,data/source/MP/cleaned/cifs/MP-mp-1214586.cif,True,,data/final/MP/graphs/Ba2Co1Cu2Sm1O7.12-MP-mp-1214586-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
As1Ce1F0.05Fe1O0.95,2,0.025,2.0,False,As2Ce2F0.1Fe2O1.9,As2Ce2Fe2O2,11.8,Ferrite,True,As25Ce25F1.25Fe25O23.75,As-Ce-F-Fe-O,5,Supercon,Ce1Fe1As1F0.05O0.95,MP-mp-605060,Ce2Fe2As2O2,As-Ce-Fe-O,As25Ce25Fe25O25,P 4 m m,tetragonal,3.992256,3.992256,9.041971,data/final/MP/cifs/As1Ce1F0.05Fe1O0.95-MP-mp-605060-synth_doped.cif,data/source/MP/raw/cifs/mp-605060.cif,mp-605060,0.0,,2014-02-14 20:12:08,6.611233843492404,10.17188/1277425,"@misc{osti_1277425,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeFeAsO (SG:99) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277425"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-1751604'}},0.2072581873958352,6.30288445,520.0,-55.74271596,-6.967839495,{'tags': []},-55.74271596,-6.967839495,-1.7010452412499992,['bandstructure'],True,[],True,2021-05-12 10:58:51.532000,FiM,8,10,mp-605060,oxide,CeFeAsO,"{'functional': 'PBE', 'labels': ['Ce', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-605060,"['mp-605060', 'mp-917114', 'mp-918266', 'mp-919274', 'mp-1443189', 'mp-1751604', 'mp-1770633', 'mp-1779614', 'mp-1873964', 'mp-1622328']",2.99945325,"{'Ce': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",144.11191005541338,[],FiM,True,99,3,"[-0.5, -0.5, 3.5, 3.5, 0.0, 0.0, 0.0, 0.0]",0.0416267225775671,2.99945325,4,5.9989065,MP,data/source/MP/cleaned/cifs/MP-mp-605060.cif,True,,data/final/MP/graphs/As1Ce1F0.05Fe1O0.95-MP-mp-605060-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
C1Ta0.45W0.55,2,0.05,2.0,False,C2Ta0.9W1.1,C2Ta1W1,10.5,Other,True,C50Ta22.5W27.5,C-Ta-W,3,Supercon,C1Ta0.45W0.55,MP-mp-1217826,Ta1W1C2,C-Ta-W,C50Ta25W25,R -3 m,trigonal,3.143710581936928,3.1437105819369275,5.41487146,data/final/MP/cifs/C1Ta0.45W0.55-MP-mp-1217826-synth_doped.cif,data/source/MP/raw/cifs/mp-1217826.cif,mp-1217826,0.0,,2019-01-12 19:05:53.027000,14.786382904799275,,,{'GGA': {'task_id': 'mp-1767905'}},0.2106623600000006,8.86330729,520.0,-43.82464305,-10.9561607625,{'tags': []},-43.82464305,-10.9561607625,-0.1387943875000008,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,4,5,mp-1217826,,TaWC2,"{'functional': 'PBE', 'labels': ['Ta_pv', 'W_pv', 'C'], 'pot_type': 'paw'}","{'Ta': 1.0, 'W': 1.0, 'C': 2.0}",GGA,mp-1217826,"['mp-1217826', 'mp-1424018', 'mp-1767905', 'mp-1793222', 'mp-1612658']",0.0002661,"{'Ta': 1.0, 'W': 1.0, 'C': 2.0}",43.664025411316935,[],NM,False,166,0,"[0, 0, 0, 0]",6.094261751941718e-06,0.0002661,0,0.0002661,MP,data/source/MP/cleaned/cifs/MP-mp-1217826.cif,True,,data/final/MP/graphs/C1Ta0.45W0.55-MP-mp-1217826-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Cu3Pb2Sr2Tb0.02Y0.98O8,2,0.0025,2.0,False,Cu6Pb4Sr4Tb0.04Y1.96O16,Cu6Pb4Sr4Y2O16,0.0,Cuprate,True,Cu18.75Pb12.5Sr12.5Tb0.125Y6.125O50,Cu-Pb-Sr-Tb-Y-O,6,Supercon,Pb2Sr2Tb0.02Y0.98Cu3O8,MP-mp-1198573,Sr4Y2Cu6Pb4O16,Cu-Pb-Sr-Y-O,Cu18.75Pb12.5Sr12.5Y6.25O50,P m n a,orthorhombic,5.415744,5.488367,15.951096,data/final/MP/cifs/Cu3Pb2Sr2Tb0.02Y0.98O8-MP-mp-1198573-synth_doped.cif,data/source/MP/raw/cifs/mp-1198573.cif,mp-1198573,0.0,,2019-01-12 03:19:55.890000,6.984903949344623,,,{'GGA': {'task_id': 'mp-1733220'}},0.0235427039355471,4.6568914,520.0,-193.37804115,-6.0430637859375,{'tags': ['Lead strontium yttrium copper oxide (2/2/1/3/8)']},-193.37804115,-6.0430637859375,-2.0645600228125,['bandstructure'],True,[71478],True,2021-05-12 10:58:37.524000,NM,32,5,mp-1198573,oxide,Sr2YCu3(PbO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Y_sv', 'Cu_pv', 'Pb_d', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Y': 1.0, 'Cu': 3.0, 'Pb': 2.0, 'O': 8.0}",GGA,mp-1198573,"['mp-1198573', 'mp-1384845', 'mp-1733220', 'mp-1823228', 'mp-1654304']",0.00063755,"{'Sr': 4.0, 'Y': 2.0, 'Cu': 6.0, 'Pb': 4.0, 'O': 16.0}",474.1238479236181,[],NM,False,53,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.689381699706065e-06,0.00063755,0,0.0012751,MP,data/source/MP/cleaned/cifs/MP-mp-1198573.cif,True,,data/final/MP/graphs/Cu3Pb2Sr2Tb0.02Y0.98O8-MP-mp-1198573-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Hf0.4V2Zr0.6,3,0.0666666666666666,2.0,False,Hf0.8V4Zr1.2,Hf1V4Zr1,8.98,Other,True,Hf13.333V66.667Zr20,Hf-V-Zr,3,Supercon,Hf0.4Zr0.6V2,MP-mp-1224085,Hf1Zr1V4,Hf-V-Zr,Hf16.667V66.667Zr16.667,F -4 3 m,cubic,5.18701573,5.187015729999999,5.187015729999999,data/final/MP/cifs/Hf0.4V2Zr0.6-MP-mp-1224085-synth_doped.cif,data/source/MP/raw/cifs/mp-1224085.cif,mp-1224085,0.0,,2019-01-13 00:23:09.162000,7.967334263158579,,,{'GGA': {'task_id': 'mp-1756967'}},0.0410283783333351,5.00695262,520.0,-54.59434349,-9.099057248333333,{'tags': []},-54.59434349,-9.099057248333333,0.0410283783333322,['bandstructure'],True,[],True,2021-05-12 10:58:45.495000,FM,6,5,mp-1224085,,HfZrV4,"{'functional': 'PBE', 'labels': ['Hf_pv', 'Zr_sv', 'V_pv'], 'pot_type': 'paw'}","{'Hf': 1.0, 'Zr': 1.0, 'V': 4.0}",GGA,mp-1224085,"['mp-1224085', 'mp-1444296', 'mp-1756967', 'mp-1796002', 'mp-1624522']",0.362572,"{'Hf': 1.0, 'Zr': 1.0, 'V': 4.0}",98.68194446031352,[],FM,True,160,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.1]",0.0036741473020509,0.362572,3,0.362572,MP,data/source/MP/cleaned/cifs/MP-mp-1224085.cif,True,,data/final/MP/graphs/Hf0.4V2Zr0.6-MP-mp-1224085-synth_doped.json,0,True,-43m,5,0,0,0,0,0,0,0,0,0,1,1.0,False
Co2Cu1S4,1,0.0,2.0,False,Co4Cu2S8,Co4Cu2S8,2.6,Other,True,Co28.571Cu14.286S57.143,Co-Cu-S,3,Supercon,Cu1Co2S4,MP-mp-3925,Co4Cu2S8,Co-Cu-S,Co28.571Cu14.286S57.143,F d -3 m,cubic,6.69987918,6.699879179999999,6.699879179999999,data/final/MP/cifs/Co2Cu1S4-MP-mp-3925.cif,data/source/MP/raw/cifs/mp-3925.cif,mp-3925,0.0,,2011-05-15 03:07:38,4.836104359598833,10.17188/1207634,"@misc{osti_1207634,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Co2CuS4 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207634"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698326'}},0.0,5.68331854,520.0,-75.59837827,-5.399884162142857,"{'tags': ['Cobalt copper sulfide (2/1/4)', 'Carrollite', 'Dicobalt(III) copper sulfide']}",-75.59837827,-5.399884162142857,-0.7070782010714284,"['xas', 'bandstructure']",True,"[622571, 31107, 52943]",True,2021-05-12 10:57:08.928000,NM,14,8,mp-3925,,Co2CuS4,"{'functional': 'PBE', 'labels': ['Co', 'Cu_pv', 'S'], 'pot_type': 'paw'}","{'Co': 2.0, 'Cu': 1.0, 'S': 4.0}",GGA,mp-3925,"['mp-931396', 'mp-915858', 'mp-932359', 'mp-3925', 'mp-1425952', 'mp-1698326', 'mp-1833413', 'mp-1599756']",0.00593025,"{'Co': 4.0, 'Cu': 2.0, 'S': 8.0}",212.6600516474575,[],NM,False,227,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",5.5772110972972206e-05,0.00593025,0,0.0118605,MP,data/source/MP/cleaned/cifs/MP-mp-3925.cif,False,,data/final/MP/graphs/Co2Cu1S4-MP-mp-3925.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Fe1Se0.35Te0.65,3,0.15,2.0,False,Fe2Se0.7Te1.3,Fe2Se1Te1,15.0,Ferrite,True,Fe50Se17.5Te32.5,Fe-Se-Te,3,Supercon,Fe1Te0.65Se0.35,MP-mp-1225136,Fe2Te1Se1,Fe-Se-Te,Fe50Se25Te25,P 4 m m,tetragonal,3.755398,3.755398,5.937717,data/final/MP/cifs/Fe1Se0.35Te0.65-MP-mp-1225136-synth_doped.cif,data/source/MP/raw/cifs/mp-1225136.cif,mp-1225136,0.0,,2019-01-13 01:17:25.998000,6.310824077785493,,,{'GGA': {'task_id': 'mp-1764167'}},0.0802741556250001,4.86336573,520.0,-24.0729629,-6.018240725,{'tags': []},-24.0729629,-6.018240725,-0.3469333980859375,['bandstructure'],True,[],True,2021-05-12 10:58:45.495000,FM,4,5,mp-1225136,,Fe2TeSe,"{'functional': 'PBE', 'labels': ['Fe_pv', 'Te', 'Se'], 'pot_type': 'paw'}","{'Fe': 2.0, 'Te': 1.0, 'Se': 1.0}",GGA,mp-1225136,"['mp-1225136', 'mp-1425562', 'mp-1764167', 'mp-1784460', 'mp-1615275']",0.1061773,"{'Fe': 2.0, 'Te': 1.0, 'Se': 1.0}",83.73970680084179,[],FM,True,99,1,"[0.1, 0.1, -0.0, -0.0]",0.0012679444920021,0.1061773,2,0.1061773,MP,data/source/MP/cleaned/cifs/MP-mp-1225136.cif,True,,data/final/MP/graphs/Fe1Se0.35Te0.65-MP-mp-1225136-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
Co1.98Cu1Ir0.02S4,2,0.0057142857142857,2.0,False,Co3.96Cu2Ir0.04S8,Co4Cu2S8,2.79,Other,True,Co28.286Cu14.286Ir0.286S57.143,Co-Cu-Ir-S,4,Supercon,Cu1Co1.98Ir0.02S4,MP-mp-3925,Co4Cu2S8,Co-Cu-S,Co28.571Cu14.286S57.143,F d -3 m,cubic,6.69987918,6.699879179999999,6.699879179999999,data/final/MP/cifs/Co1.98Cu1Ir0.02S4-MP-mp-3925-synth_doped.cif,data/source/MP/raw/cifs/mp-3925.cif,mp-3925,0.0,,2011-05-15 03:07:38,4.836104359598833,10.17188/1207634,"@misc{osti_1207634,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Co2CuS4 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207634"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698326'}},0.0,5.68331854,520.0,-75.59837827,-5.399884162142857,"{'tags': ['Cobalt copper sulfide (2/1/4)', 'Carrollite', 'Dicobalt(III) copper sulfide']}",-75.59837827,-5.399884162142857,-0.7070782010714284,"['xas', 'bandstructure']",True,"[622571, 31107, 52943]",True,2021-05-12 10:57:08.928000,NM,14,8,mp-3925,,Co2CuS4,"{'functional': 'PBE', 'labels': ['Co', 'Cu_pv', 'S'], 'pot_type': 'paw'}","{'Co': 2.0, 'Cu': 1.0, 'S': 4.0}",GGA,mp-3925,"['mp-931396', 'mp-915858', 'mp-932359', 'mp-3925', 'mp-1425952', 'mp-1698326', 'mp-1833413', 'mp-1599756']",0.00593025,"{'Co': 4.0, 'Cu': 2.0, 'S': 8.0}",212.6600516474575,[],NM,False,227,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",5.5772110972972206e-05,0.00593025,0,0.0118605,MP,data/source/MP/cleaned/cifs/MP-mp-3925.cif,True,,data/final/MP/graphs/Co1.98Cu1Ir0.02S4-MP-mp-3925-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Dy0.15Pd2Sn1Y0.85,3,0.075,1.0,True,Dy0.15Pd2Sn1Y0.85,Pd2Sn1Y1,2.8,Other,True,Dy3.75Pd50Sn25Y21.25,Dy-Pd-Sn-Y,4,Supercon,Pd2Y0.85Dy0.15Sn1,MP-mp-5538,Y1Sn1Pd2,Pd-Sn-Y,Pd50Sn25Y25,F m -3 m,cubic,4.81595014,4.81595014,4.81595014,data/final/MP/cifs/Dy0.15Pd2Sn1Y0.85-MP-mp-5538-synth_doped.cif,data/source/MP/raw/cifs/mp-5538.cif,mp-5538,0.0,,2011-05-13 01:04:13,8.839720826473608,10.17188/1267618,"@misc{osti_1267618,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YSnPd2 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1267618"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687523'}},0.0,6.33853657,520.0,-24.32859047,-6.0821476175,"{'tags': ['Palladium yttrium stannide (2/1/1)', 'Palladium tin yttrium (2/1/1)']}",-24.32859047,-6.0821476175,-0.873195970416667,"['xas', 'elasticity', 'bandstructure']",True,"[105699, 648949, 105700, 424011, 648950]",True,2021-05-12 10:56:22.739000,NM,4,12,mp-5538,,YSnPd2,"{'functional': 'PBE', 'labels': ['Y_sv', 'Sn_d', 'Pd'], 'pot_type': 'paw'}","{'Y': 1.0, 'Sn': 1.0, 'Pd': 2.0}",GGA,mp-5538,"['mp-1008093', 'mp-1001657', 'mp-5538', 'mp-1065654', 'mp-1065644', 'mp-1065683', 'mp-1439031', 'mp-1687523', 'mp-1801498', 'mp-1012418', 'mp-1593849', 'mp-1065696']",0.0001592,"{'Y': 1.0, 'Sn': 1.0, 'Pd': 2.0}",78.98251295612837,[],NM,False,225,0,"[0, 0, 0, 0]",2.015636044505563e-06,0.0001592,0,0.0001592,MP,data/source/MP/cleaned/cifs/MP-mp-5538.cif,True,,data/final/MP/graphs/Dy0.15Pd2Sn1Y0.85-MP-mp-5538-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ag1Se2Sn1,1,0.0,1.0,True,Ag1Se2Sn1,Ag1Se2Sn1,4.655,Other,True,Ag25Se50Sn25,Ag-Se-Sn,3,Supercon,Ag1Sn1Se2,MP-mp-1229011,Ag1Sn1Se2,Ag-Se-Sn,Ag25Se50Sn25,R -3 m,trigonal,4.0598026973764,4.0598026973764,7.0325229,data/final/MP/cifs/Ag1Se2Sn1-MP-mp-1229011.cif,data/source/MP/raw/cifs/mp-1229011.cif,mp-1229011,0.0,,2019-01-13 04:39:21.201000,6.746249424080593,,,{'GGA': {'task_id': 'mp-1766738'}},0.0,4.6965768,520.0,-14.98910359,-3.7472758975,{'tags': []},-14.98910359,-3.7472758975,-0.5247881940885413,['bandstructure'],True,[],True,2021-05-12 10:58:49.477000,NM,4,5,mp-1229011,,AgSnSe2,"{'functional': 'PBE', 'labels': ['Ag', 'Sn_d', 'Se'], 'pot_type': 'paw'}","{'Ag': 1.0, 'Sn': 1.0, 'Se': 2.0}",GGA,mp-1229011,"['mp-1229011', 'mp-1422543', 'mp-1766738', 'mp-1796245', 'mp-1612963']",0.0080447,"{'Ag': 1.0, 'Sn': 1.0, 'Se': 2.0}",94.64136915222257,[],NM,False,166,0,"[0, 0, 0, 0]",8.50019401881305e-05,0.0080447,0,0.0080447,MP,data/source/MP/cleaned/cifs/MP-mp-1229011.cif,False,,data/final/MP/graphs/Ag1Se2Sn1-MP-mp-1229011.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ba0.115Cu1La1.885O4,2,0.0328571428571428,1.0,True,Ba0.115Cu1La1.885O4,Cu1La2O4,13.9,Cuprate,True,Ba1.643Cu14.286La26.929O57.142857142857146,Ba-Cu-La-O,4,Supercon,La1.885Ba0.115Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ba0.115Cu1La1.885O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ba0.115Cu1La1.885O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ge2.06La1Pt1.94,2,0.024,1.0,True,Ge2.06La1Pt1.94,Ge2La1Pt2,0.95,Other,True,Ge41.2La20Pt38.8,Ge-La-Pt,3,Supercon,La1Pt1.94Ge2.06,MP-mp-21057,La1Ge2Pt2,Ge-La-Pt,Ge40La20Pt40,I 4/m m m,tetragonal,4.458128002603763,4.458128002603763,5.96043246,data/final/MP/cifs/Ge2.06La1Pt1.94-MP-mp-21057-synth_doped.cif,data/source/MP/raw/cifs/mp-21057.cif,mp-21057,0.0,,2014-02-21 09:25:11,11.137876633950224,10.17188/1196317,"@misc{osti_1196317,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La(GePt)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196317"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704515'}},0.0973405535000013,6.85937735,520.0,-30.67754438,-6.135508876,{'tags': ['Lanthanum platinum germanide (1/2/2)']},-30.67754438,-6.135508876,-0.8707332289999996,"['xas', 'bandstructure']",True,[53665],True,2021-05-12 10:56:57.051000,NM,5,8,mp-21057,,La(GePt)2,"{'functional': 'PBE', 'labels': ['La', 'Ge_d', 'Pt'], 'pot_type': 'paw'}","{'La': 1.0, 'Ge': 2.0, 'Pt': 2.0}",GGA,mp-21057,"['mp-993642', 'mp-991893', 'mp-21057', 'mp-1429115', 'mp-1704515', 'mp-1783057', 'mp-994947', 'mp-1591906']",0.003651,"{'La': 1.0, 'Ge': 2.0, 'Pt': 2.0}",100.53893739664449,[],NM,False,139,0,"[0, 0, 0, 0, 0]",3.631428871777447e-05,0.003651,0,0.003651,MP,data/source/MP/cleaned/cifs/MP-mp-21057.cif,True,,data/final/MP/graphs/Ge2.06La1Pt1.94-MP-mp-21057-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B2Ho0.2Lu0.8Ru1,3,0.0999999999999999,4.0,False,B8Ho0.8Lu3.2Ru4,B8Lu4Ru4,6.46,Other,True,B50Ho5Lu20Ru25,B-Ho-Lu-Ru,4,Supercon,Lu0.8Ho0.2Ru1B2,MP-mp-29239,Lu4B8Ru4,B-Lu-Ru,B50Lu25Ru25,P n m a,orthorhombic,5.262881,5.829858,6.288542,data/final/MP/cifs/B2Ho0.2Lu0.8Ru1-MP-mp-29239-synth_doped.cif,data/source/MP/raw/cifs/mp-29239.cif,mp-29239,0.0,,2014-02-24 06:45:28,10.246997128776938,10.17188/1203618,"@misc{osti_1203618,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LuB2Ru (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1203618"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677301'}},0.0,6.02142224,520.0,-119.30016105,-7.456260065625,"{'tags': ['Lutetium ruthenium(III) boride', 'Lutetium ruthenium boride (1/1/2)']}",-119.30016105,-7.456260065625,-0.6677291364583331,"['xas', 'bandstructure']",True,"[614715, 100774]",True,2021-05-12 10:57:03.017000,NM,16,8,mp-29239,,LuB2Ru,"{'functional': 'PBE', 'labels': ['Lu_3', 'B', 'Ru_pv'], 'pot_type': 'paw'}","{'Lu': 1.0, 'B': 2.0, 'Ru': 1.0}",GGA,mp-29239,"['mp-909473', 'mp-925177', 'mp-924466', 'mp-29239', 'mp-1381674', 'mp-1677301', 'mp-1784701', 'mp-1603819']",4.565e-05,"{'Lu': 4.0, 'B': 8.0, 'Ru': 4.0}",192.9440954509509,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",9.4638812124945e-07,4.565e-05,0,0.0001826,MP,data/source/MP/cleaned/cifs/MP-mp-29239.cif,True,,data/final/MP/graphs/B2Ho0.2Lu0.8Ru1-MP-mp-29239-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Pt2Ta1,1,0.0,2.0,False,Pt4Ta2,Pt4Ta2,0.0,Other,True,Pt66.667Ta33.333,Pt-Ta,2,Supercon,Pt2Ta1,MP-mp-30849,Ta2Pt4,Pt-Ta,Pt66.667Ta33.333,C m c m,orthorhombic,4.790695,4.853314001170154,4.89223684,data/final/MP/cifs/Pt2Ta1-MP-mp-30849.cif,data/source/MP/raw/cifs/mp-30849.cif,mp-30849,0.0,,2014-02-24 01:18:10,19.20366660789256,10.17188/1205205,"@misc{osti_1205205,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TaPt2 (SG:63) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1205205"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697989'}},0.0,7.24455584,520.0,-52.4810049,-8.74683415,{'tags': ['Platinum tantalum (2/1)']},-52.4810049,-8.74683415,-0.7469697999999999,"['xas', 'elasticity', 'bandstructure']",True,"[105802, 649718]",True,2021-05-12 10:56:18.721000,NM,6,9,mp-30849,,TaPt2,"{'functional': 'PBE', 'labels': ['Ta_pv', 'Pt'], 'pot_type': 'paw'}","{'Ta': 1.0, 'Pt': 2.0}",GGA,mp-30849,"['mp-932793', 'mp-943072', 'mp-942065', 'mp-30849', 'mp-1077302', 'mp-1421525', 'mp-1697989', 'mp-1796369', 'mp-1587214']",0.00022305,"{'Ta': 2.0, 'Pt': 4.0}",98.76866222056456,[],NM,False,63,0,"[0, 0, 0, 0, 0, 0]",4.516614784189289e-06,0.00022305,0,0.0004461,MP,data/source/MP/cleaned/cifs/MP-mp-30849.cif,False,,data/final/MP/graphs/Pt2Ta1-MP-mp-30849.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
C1Ta0.4W0.6,3,0.0999999999999999,2.0,False,C2Ta0.8W1.2,C2Ta1W1,9.41,Other,True,C50Ta20W30,C-Ta-W,3,Supercon,Ta0.4W0.6C1,MP-mp-1217826,Ta1W1C2,C-Ta-W,C50Ta25W25,R -3 m,trigonal,3.143710581936928,3.1437105819369275,5.41487146,data/final/MP/cifs/C1Ta0.4W0.6-MP-mp-1217826-synth_doped.cif,data/source/MP/raw/cifs/mp-1217826.cif,mp-1217826,0.0,,2019-01-12 19:05:53.027000,14.786382904799275,,,{'GGA': {'task_id': 'mp-1767905'}},0.2106623600000006,8.86330729,520.0,-43.82464305,-10.9561607625,{'tags': []},-43.82464305,-10.9561607625,-0.1387943875000008,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,4,5,mp-1217826,,TaWC2,"{'functional': 'PBE', 'labels': ['Ta_pv', 'W_pv', 'C'], 'pot_type': 'paw'}","{'Ta': 1.0, 'W': 1.0, 'C': 2.0}",GGA,mp-1217826,"['mp-1217826', 'mp-1424018', 'mp-1767905', 'mp-1793222', 'mp-1612658']",0.0002661,"{'Ta': 1.0, 'W': 1.0, 'C': 2.0}",43.664025411316935,[],NM,False,166,0,"[0, 0, 0, 0]",6.094261751941718e-06,0.0002661,0,0.0002661,MP,data/source/MP/cleaned/cifs/MP-mp-1217826.cif,True,,data/final/MP/graphs/C1Ta0.4W0.6-MP-mp-1217826-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Cu1La1.98Na0.02O4,2,0.0057142857142857,1.0,True,Cu1La1.98Na0.02O4,Cu1La2O4,0.0,Cuprate,True,Cu14.286La28.286Na0.286O57.142857142857146,Cu-La-Na-O,4,Supercon,La1.98Na0.02Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La1.98Na0.02O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La1.98Na0.02O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ge1.81La1,2,0.0450771055753261,2.0,False,Ge3.62La2,Ge4La2,2.17,Other,True,Ge64.413La35.587,Ge-La,2,Supercon,Ge1.81La1,MP-mp-19761,La2Ge4,Ge-La,Ge66.667La33.333,I 41/a m d,tetragonal,4.320984000934922,4.320984000934921,8.41484573,data/final/MP/cifs/Ge1.81La1-MP-mp-19761-synth_doped.cif,data/source/MP/raw/cifs/mp-19761.cif,mp-19761,0.0,,2014-02-21 13:34:05,6.447172399329149,10.17188/1194966,"@misc{osti_1194966,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaGe2 (SG:141) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1194966"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703381'}},0.0059020154166642,6.2456377,520.0,-32.49839164,-5.416398606666667,"{'tags': ['Lanthanum germanide (1/2)', 'Germanium lanthanum (2/1)']}",-32.49839164,-5.416398606666667,-0.6890443350000002,"['xas', 'elasticity', 'bandstructure']",True,"[636796, 636784, 57072]",True,2021-05-12 10:56:14.760000,NM,6,6,mp-19761,,LaGe2,"{'functional': 'PBE', 'labels': ['La', 'Ge_d'], 'pot_type': 'paw'}","{'La': 1.0, 'Ge': 2.0}",GGA,mp-19761,"['mp-19761', 'mp-20013', 'mp-1438339', 'mp-1703381', 'mp-1780058', 'mp-1596448']",0.0002277,"{'La': 2.0, 'Ge': 4.0}",146.3900903733194,[],NM,False,141,0,"[0, 0, 0, 0, 0, 0]",3.110866308222457e-06,0.0002277,0,0.0004554,MP,data/source/MP/cleaned/cifs/MP-mp-19761.cif,True,,data/final/MP/graphs/Ge1.81La1-MP-mp-19761-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ce1Co0.8In5Ru0.2,3,0.0571428571428571,1.0,True,Ce1Co0.8In5Ru0.2,Ce1Co1In5,2.18,Heavy_fermion,True,Ce14.286Co11.429In71.429Ru2.857,Ce-Co-In-Ru,4,Supercon,Ce1Co0.8Ru0.2In5,MP-mp-19961,Ce1In5Co1,Ce-Co-In,Ce14.286Co14.286In71.429,P 4/m m m,tetragonal,4.635989,4.635989,7.564124,data/final/MP/cifs/Ce1Co0.8In5Ru0.2-MP-mp-19961-synth_doped.cif,data/source/MP/raw/cifs/mp-19961.cif,mp-19961,0.0,,2014-02-21 14:08:25,7.897022127398995,10.17188/1195145,"@misc{osti_1195145,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeIn5Co (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195145"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701944'}},0.0,7.80626318,520.0,-28.52795357,-4.075421938571429,{'tags': ['Cerium cobalt indium (1/1/5)']},-28.52795357,-4.075421938571429,-0.2468754242857146,"['xas', 'bandstructure']",True,[102108],True,2021-05-12 10:56:57.051000,FM,7,8,mp-19961,,CeIn5Co,"{'functional': 'PBE', 'labels': ['Ce', 'In_d', 'Co'], 'pot_type': 'paw'}","{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",GGA,mp-19961,"['mp-928775', 'mp-912209', 'mp-928270', 'mp-19961', 'mp-1504062', 'mp-1701944', 'mp-1785253', 'mp-1593180']",0.9310323,"{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",162.57113333428427,[],FM,True,123,1,"[0.7, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0057269226147644,0.9310323,1,0.9310323,MP,data/source/MP/cleaned/cifs/MP-mp-19961.cif,True,,data/final/MP/graphs/Ce1Co0.8In5Ru0.2-MP-mp-19961-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Bi2Ca0.8Cu2Gd0.2Sr2O8,3,0.0266666666666666,2.0,False,Bi4Ca1.6Cu4Gd0.4Sr4O16,Bi4Ca2Cu4Sr4O16,73.0,Cuprate,True,Bi13.333Ca5.333Cu13.333Gd1.333Sr13.333O53.333333333333336,Bi-Ca-Cu-Gd-Sr-O,6,Supercon,Bi2Sr2Ca0.8Gd0.2Cu2O8,MP-mp-1218930,Sr4Ca2Cu4Bi4O16,Bi-Ca-Cu-Sr-O,Bi13.333Ca6.667Cu13.333Sr13.333O53.333333333333336,C c c 2,orthorhombic,5.417115,5.472898000129128,16.11398919,data/final/MP/cifs/Bi2Ca0.8Cu2Gd0.2Sr2O8-MP-mp-1218930-synth_doped.cif,data/source/MP/raw/cifs/mp-1218930.cif,mp-1218930,0.0,,2019-01-12 20:01:06.544000,6.266668983881059,,,,0.039252223722225,4.51768334,520.0,-173.15021002,-5.771673667333333,{'tags': []},-173.15021002,-5.771673667333333,-2.074956548222222,[],False,[],True,2021-05-12 11:00:42.526000,NM,30,3,mp-1218930,oxide,Sr2CaCu2(BiO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",GGA,mp-1218930,"['mp-1218930', 'mp-1359698', 'mp-1817714']",0.00011165,"{'Sr': 4.0, 'Ca': 2.0, 'Cu': 4.0, 'Bi': 4.0, 'O': 16.0}",470.7976286073367,[],NM,False,37,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.743014544498498e-07,0.00011165,0,0.0002233,MP,data/source/MP/cleaned/cifs/MP-mp-1218930.cif,True,,data/final/MP/graphs/Bi2Ca0.8Cu2Gd0.2Sr2O8-MP-mp-1218930-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
C1,1,0.0,4.0,False,C4,C4,7.2,Carbon,True,C100,C,1,Supercon,C,MP-mp-569304,C4,C,C100,R -3 m,trigonal,2.469371295072877,2.469371295072877,11.93978189,data/final/MP/cifs/C1-MP-mp-569304.cif,data/source/MP/raw/cifs/mp-569304.cif,mp-569304,2.6904,,2014-02-16 11:44:20,1.2743710183702888,10.17188/1275028,"@misc{osti_1275028,
    author = ""Persson, Kristin"",
    title = ""Materials Data on C (SG:166) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1275028"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700410'}},0.0,-0.47711701,520.0,-36.9071228,-9.2267807,{'tags': ['Carbon']},-36.9071228,-9.2267807,0.0,"['xas', 'elasticity', 'bandstructure']",True,[28417],True,2021-05-12 10:56:22.739000,NM,4,8,mp-569304,,C,"{'functional': 'PBE', 'labels': ['C'], 'pot_type': 'paw'}",{'C': 1.0},GGA,mp-569304,"['mp-569304', 'mp-920333', 'mp-921362', 'mp-906669', 'mp-1413033', 'mp-1700410', 'mp-1795488', 'mp-1594124']",9.4e-06,{'C': 4.0},62.60103621225793,[],NM,False,166,0,"[0, 0, 0, 0]",6.006290354765331e-07,9.4e-06,0,3.76e-05,MP,data/source/MP/cleaned/cifs/MP-mp-569304.cif,False,,data/final/MP/graphs/C1-MP-mp-569304.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
P2Pd2Tb1,1,0.0,1.0,True,P2Pd2Tb1,P2Pd2Tb1,0.0,Other,True,P40Pd40Tb20,P-Pd-Tb,3,Supercon,Tb1Pd2P2,MP-mp-1206776,Tb1P2Pd2,P-Pd-Tb,P40Pd40Tb20,I 4/m m m,tetragonal,4.103348000091363,4.103348000091363,5.75647899,data/final/MP/cifs/P2Pd2Tb1-MP-mp-1206776.cif,data/source/MP/raw/cifs/mp-1206776.cif,mp-1206776,0.0,,2019-01-12 10:01:06.663000,8.603303679725176,,,{'GGA': {'task_id': 'mp-1760391'}},0.0043414631428566,7.00827155,520.0,-30.51867982,-6.103735964,"{'tags': ['TbPd2P2', 'CeAl2Ga2']}",-30.51867982,-6.103735964,-0.9395890173333334,['bandstructure'],True,[],True,2021-05-12 10:58:39.488000,NM,5,5,mp-1206776,,Tb(PPd)2,"{'functional': 'PBE', 'labels': ['Tb_3', 'P', 'Pd'], 'pot_type': 'paw'}","{'Tb': 1.0, 'P': 2.0, 'Pd': 2.0}",GGA,mp-1206776,"['mp-1206776', 'mp-1408699', 'mp-1760391', 'mp-1800851', 'mp-1585057']",0.0002588,"{'Tb': 1.0, 'P': 2.0, 'Pd': 2.0}",83.71169933959246,[],NM,False,139,0,"[0, 0, 0, 0, 0]",3.091563091439925e-06,0.0002588,0,0.0002588,MP,data/source/MP/cleaned/cifs/MP-mp-1206776.cif,False,,data/final/MP/graphs/P2Pd2Tb1-MP-mp-1206776.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ge1Ru1Zr1,1,0.0,6.0,False,Ge6Ru6Zr6,Ge6Ru6Zr6,9.0,Other,True,Ge33.333Ru33.333Zr33.333,Ge-Ru-Zr,3,Supercon,Zr1Ru1Ge1,MP-mp-637736,Zr6Ge6Ru6,Ge-Ru-Zr,Ge33.333Ru33.333Zr33.333,I m a 2,orthorhombic,6.827079999962907,7.770044300269561,7.535793999579474,data/final/MP/cifs/Ge1Ru1Zr1-MP-mp-637736.cif,data/source/MP/raw/cifs/mp-637736.cif,mp-637736,0.0,,2013-06-23 16:33:16,8.731958964155762,10.17188/1279715,"@misc{osti_1279715,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrGeRu (SG:46) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1279715"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672112'}},0.0,5.96274094,520.0,-148.89627503,-8.272015279444444,{'tags': ['Germanium ruthenium zirconium (1:1:1)']},-148.89627503,-8.272015279444444,-0.7903092327777791,"['xas', 'bandstructure']",True,[23578],True,2021-05-12 10:57:30.779000,NM,18,8,mp-637736,,ZrGeRu,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Ge_d', 'Ru_pv'], 'pot_type': 'paw'}","{'Zr': 1.0, 'Ge': 1.0, 'Ru': 1.0}",GGA,mp-637736,"['mp-930043', 'mp-637736', 'mp-930592', 'mp-913577', 'mp-1436684', 'mp-1672112', 'mp-1807943', 'mp-1609080']",2.5333333333333338e-06,"{'Zr': 6.0, 'Ge': 6.0, 'Ru': 6.0}",302.2917942307156,[],NM,False,46,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.028254253041031e-08,2.5333333333333338e-06,0,1.52e-05,MP,data/source/MP/cleaned/cifs/MP-mp-637736.cif,False,,data/final/MP/graphs/Ge1Ru1Zr1-MP-mp-637736.json,0,True,mm2,0,0,0,6,0,0,0,0,0,1,0,1.0,False
Te3Tl5,1,0.0,2.0,False,Te6Tl10,Te6Tl10,2.144,Other,True,Te37.5Tl62.5,Te-Tl,2,Supercon,Te3Tl5,MP-mp-174,Tl10Te6,Te-Tl,Te37.5Tl62.5,I 4/m c m,tetragonal,9.074188004129764,9.15781773,9.074188004129764,data/final/MP/cifs/Te3Tl5-MP-mp-174.cif,data/source/MP/raw/cifs/mp-174.cif,mp-174,0.0,,2011-05-17 05:06:15,8.67087247382719,10.17188/1192488,"@misc{osti_1192488,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Tl5Te3 (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1192488"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1705552'}},0.0108760027059657,4.81466976,520.0,-46.96681105,-2.935425690625,{'tags': ['Thallium telluride (5/3)']},-46.96681105,-2.935425690625,-0.4382858752083334,"['xas', 'bandstructure']",True,"[26281, 40260, 69881, 653090, 69028]",True,2021-05-12 10:56:55.092000,NM,16,11,mp-174,,Tl5Te3,"{'functional': 'PBE', 'labels': ['Tl_d', 'Te'], 'pot_type': 'paw'}","{'Tl': 5.0, 'Te': 3.0}",GGA,mp-174,"['mp-922544', 'mp-923332', 'mp-908071', 'mp-8815', 'mp-174', 'mp-1189883', 'mp-1237676', 'mp-1416289', 'mp-1705552', 'mp-1867880', 'mp-1608479']",0.0003518,"{'Tl': 10.0, 'Te': 6.0}",538.0281241105719,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.3077383290383551e-06,0.0003518,0,0.0007036,MP,data/source/MP/cleaned/cifs/MP-mp-174.cif,False,,data/final/MP/graphs/Te3Tl5-MP-mp-174.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Bi2Ca1Cu2Sr2O8.272,2,0.0166230137943076,1.9340471953578335,False,Bi3.868Ca1.934Cu3.868Sr3.868O16,Bi4Ca2Cu4Sr4O16,92.2,Cuprate,True,Bi13.096Ca6.548Cu13.096Sr13.096O54.16448402304872,Bi-Ca-Cu-Sr-O,5,Supercon,Bi2Sr2Ca1Cu2O8.272,MP-mp-1218930,Sr4Ca2Cu4Bi4O16,Bi-Ca-Cu-Sr-O,Bi13.333Ca6.667Cu13.333Sr13.333O53.333333333333336,C c c 2,orthorhombic,5.417115,5.472898000129128,16.11398919,data/final/MP/cifs/Bi2Ca1Cu2Sr2O8.272-MP-mp-1218930-synth_doped.cif,data/source/MP/raw/cifs/mp-1218930.cif,mp-1218930,0.0,,2019-01-12 20:01:06.544000,6.266668983881059,,,,0.039252223722225,4.51768334,520.0,-173.15021002,-5.771673667333333,{'tags': []},-173.15021002,-5.771673667333333,-2.074956548222222,[],False,[],True,2021-05-12 11:00:42.526000,NM,30,3,mp-1218930,oxide,Sr2CaCu2(BiO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",GGA,mp-1218930,"['mp-1218930', 'mp-1359698', 'mp-1817714']",0.00011165,"{'Sr': 4.0, 'Ca': 2.0, 'Cu': 4.0, 'Bi': 4.0, 'O': 16.0}",470.7976286073367,[],NM,False,37,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.743014544498498e-07,0.00011165,0,0.0002233,MP,data/source/MP/cleaned/cifs/MP-mp-1218930.cif,True,,data/final/MP/graphs/Bi2Ca1Cu2Sr2O8.272-MP-mp-1218930-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
B2Mg0.8Zr0.2,3,0.1333333333333333,1.0,True,B2Mg0.8Zr0.2,B2Mg1,37.3,Other,True,B66.667Mg26.667Zr6.667,B-Mg-Zr,3,Supercon,Mg0.8Zr0.2B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B2Mg0.8Zr0.2-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B2Mg0.8Zr0.2-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Nd0.99Ni1Sr0.01O3,2,0.004,4.0,False,Nd3.96Ni4Sr0.04O12,Nd4Ni4O12,0.0,Oxide,True,Nd19.8Ni20Sr0.2O60,Nd-Ni-Sr-O,4,Supercon,Nd0.99Sr0.01Ni1O3,MP-mp-22106,Nd4Ni4O12,Nd-Ni-O,Nd20Ni20O60,P n m a,orthorhombic,5.431762,5.495849,7.709429,data/final/MP/cifs/Nd0.99Ni1Sr0.01O3-MP-mp-22106-synth_doped.cif,data/source/MP/raw/cifs/mp-22106.cif,mp-22106,0.0,,2014-02-19 13:18:08,7.242194237367626,,,{'GGA+U': {'task_id': 'mp-1701351'}},0.0,3.99854667,520.0,-131.66600273,-6.5833001365,"{'tags': ['Neodymium nickel(III) oxide', 'Dineodymium niccolate', 'Neodymium niccolate', 'Neodymium nickel oxide', 'Neodymium niccolate(III)']}",-131.66600273,-6.5833001365,-2.425267555500001,"['xas', 'bandstructure']",True,"[155746, 67725, 164825, 67724, 416213, 78319, 164562, 155747, 67723, 69788, 155748, 67722, 24875, 416212]",True,2021-05-12 10:57:01.079000,FM,20,11,mp-22106,oxide,NdNiO3,"{'functional': 'PBE', 'labels': ['Nd_3', 'Ni_pv', 'O'], 'pot_type': 'paw'}","{'Nd': 1.0, 'Ni': 1.0, 'O': 3.0}",GGA+U,mp-22106,"['mp-919926', 'mp-918860', 'mp-905914', 'mp-602303', 'mp-25591', 'mp-1189695', 'mp-22106', 'mp-1416651', 'mp-1701351', 'mp-1930748', 'mp-1599871']",1.00005245,"{'Nd': 4.0, 'Ni': 4.0, 'O': 12.0}",230.14298278419733,[],FM,True,62,1,"[0.0, 0.0, 0.0, 0.0, 1.4, 1.4, 1.4, 1.4, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0173814111193255,1.00005245,4,4.0002098,MP,data/source/MP/cleaned/cifs/MP-mp-22106.cif,True,,data/final/MP/graphs/Nd0.99Ni1Sr0.01O3-MP-mp-22106-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ce0.14Ge12Pr0.86Pt4,2,0.0164705882352941,1.0,True,Ce0.14Ge12Pr0.86Pt4,Ge12Pr1Pt4,3.43,Heavy_fermion,True,Ce0.824Ge70.588Pr5.059Pt23.529,Ce-Ge-Pr-Pt,4,Supercon,Pr0.86Ce0.14Pt4Ge12,MP-mp-1105939,Pr1Ge12Pt4,Ge-Pr-Pt,Ge70.588Pr5.882Pt23.529,I m -3,cubic,7.560907531676135,7.560907530000001,7.56090753,data/final/MP/cifs/Ce0.14Ge12Pr0.86Pt4-MP-mp-1105939-synth_doped.cif,data/source/MP/raw/cifs/mp-1105939.cif,mp-1105939,0.0,,2018-07-19 06:58:09,8.947691530234051,,,{'GGA': {'task_id': 'mp-1705662'}},0.0059454020588258,4.25899828,520.0,-91.15368674,-5.361981572941176,{'tags': ['Praseodymium platinum germanide (1/4/12)']},-91.15368674,-5.361981572941176,-0.3889895585294119,['bandstructure'],True,[174554],True,2021-05-12 10:58:22.271000,NM,17,5,mp-1105939,,Pr(Ge3Pt)4,"{'functional': 'PBE', 'labels': ['Pr_3', 'Ge_d', 'Pt'], 'pot_type': 'paw'}","{'Pr': 1.0, 'Ge': 12.0, 'Pt': 4.0}",GGA,mp-1105939,"['mp-1105939', 'mp-1427343', 'mp-1705662', 'mp-1805701', 'mp-1584493']",0.0022709,"{'Pr': 1.0, 'Ge': 12.0, 'Pt': 4.0}",332.73607546662794,[],NM,False,204,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.824928727115922e-06,0.0022709,0,0.0022709,MP,data/source/MP/cleaned/cifs/MP-mp-1105939.cif,True,,data/final/MP/graphs/Ce0.14Ge12Pr0.86Pt4-MP-mp-1105939-synth_doped.json,0,True,m-3,2,0,0,0,0,0,0,0,0,1,0,1.0,False
Ce0.65La0.35Ru2,3,0.1,2.0,False,Ce1.3La0.7Ru4,Ce1La1Ru4,1.647,Heavy_fermion,True,Ce21.667La11.667Ru66.667,Ce-La-Ru,3,Supercon,La0.35Ce0.65Ru2,MP-mp-1222913,La1Ce1Ru4,Ce-La-Ru,Ce16.667La16.667Ru66.667,F -4 3 m,cubic,5.407204540000001,5.40720454,5.40720454,data/final/MP/cifs/Ce0.65La0.35Ru2-MP-mp-1222913-synth_doped.cif,data/source/MP/raw/cifs/mp-1222913.cif,mp-1222913,0.0,,2019-01-12 23:22:50.626000,10.149813335401207,,,{'GGA': {'task_id': 'mp-1717130'}},0.0,8.64426336,520.0,-49.23252279,-8.205420465,{'tags': []},-49.23252279,-8.205420465,-0.2109779849999995,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,6,5,mp-1222913,,LaCeRu4,"{'functional': 'PBE', 'labels': ['La', 'Ce', 'Ru_pv'], 'pot_type': 'paw'}","{'La': 1.0, 'Ce': 1.0, 'Ru': 4.0}",GGA,mp-1222913,"['mp-1222913', 'mp-1394759', 'mp-1717130', 'mp-1804881', 'mp-1626317']",0.0208777,"{'La': 1.0, 'Ce': 1.0, 'Ru': 4.0}",111.79011354255184,[],NM,False,216,0,"[0.0, -0.0, 0.0, 0.0, 0.0, 0.0]",0.0001867580176672,0.0208777,0,0.0208777,MP,data/source/MP/cleaned/cifs/MP-mp-1222913.cif,True,,data/final/MP/graphs/Ce0.65La0.35Ru2-MP-mp-1222913-synth_doped.json,0,True,-43m,5,0,0,0,0,0,0,0,0,0,1,1.0,False
Ce1Co0.7In5Ir0.3,3,0.0857142857142857,1.0,True,Ce1Co0.7In5Ir0.3,Ce1Co1In5,2.0,Heavy_fermion,True,Ce14.286Co10In71.429Ir4.286,Ce-Co-In-Ir,4,Supercon,Ce1Ir0.3Co0.7In5,MP-mp-19961,Ce1In5Co1,Ce-Co-In,Ce14.286Co14.286In71.429,P 4/m m m,tetragonal,4.635989,4.635989,7.564124,data/final/MP/cifs/Ce1Co0.7In5Ir0.3-MP-mp-19961-synth_doped.cif,data/source/MP/raw/cifs/mp-19961.cif,mp-19961,0.0,,2014-02-21 14:08:25,7.897022127398995,10.17188/1195145,"@misc{osti_1195145,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeIn5Co (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195145"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701944'}},0.0,7.80626318,520.0,-28.52795357,-4.075421938571429,{'tags': ['Cerium cobalt indium (1/1/5)']},-28.52795357,-4.075421938571429,-0.2468754242857146,"['xas', 'bandstructure']",True,[102108],True,2021-05-12 10:56:57.051000,FM,7,8,mp-19961,,CeIn5Co,"{'functional': 'PBE', 'labels': ['Ce', 'In_d', 'Co'], 'pot_type': 'paw'}","{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",GGA,mp-19961,"['mp-928775', 'mp-912209', 'mp-928270', 'mp-19961', 'mp-1504062', 'mp-1701944', 'mp-1785253', 'mp-1593180']",0.9310323,"{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",162.57113333428427,[],FM,True,123,1,"[0.7, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0057269226147644,0.9310323,1,0.9310323,MP,data/source/MP/cleaned/cifs/MP-mp-19961.cif,True,,data/final/MP/graphs/Ce1Co0.7In5Ir0.3-MP-mp-19961-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Co0.15La1Ru2.85Si2,2,0.0499999999999999,1.0,True,Co0.15La1Ru2.85Si2,La1Ru3Si2,6.45,Other,True,Co2.5La16.667Ru47.5Si33.333,Co-La-Ru-Si,4,Supercon,La1Ru2.85Co0.15Si2,MP-mp-29240,La2Si4Ru6,La-Ru-Si,La16.667Ru50Si33.333,P 6/m m m,hexagonal,3.6088705,5.693851997310984,5.69385245,data/final/MP/cifs/Co0.15La1Ru2.85Si2-MP-mp-29240-synth_doped.cif,data/source/MP/raw/cifs/mp-29240.cif,mp-29240,0.0,,2014-02-24 11:42:03,8.166084465628895,10.17188/1203620,"@misc{osti_1203620,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaSi2Ru3 (SG:193) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1203620"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1719509'}},0.0844490616666675,8.56766587,520.0,-95.13702135,-7.9280851125,{'tags': []},-95.13702135,-7.9280851125,-0.6361177608333328,"['xas', 'bandstructure']",True,[],True,2021-05-12 10:57:03.017000,NM,12,10,mp-29240,,LaSi2Ru3,"{'functional': 'PBE', 'labels': ['La', 'Si', 'Ru_pv'], 'pot_type': 'paw'}","{'La': 1.0, 'Si': 2.0, 'Ru': 3.0}",GGA,mp-29240,"['mp-925171', 'mp-924493', 'mp-909454', 'mp-29240', 'mp-1172476', 'mp-1254946', 'mp-1406081', 'mp-1719509', 'mp-1834844', 'mp-1618500']",0.00014945,"{'La': 2.0, 'Si': 4.0, 'Ru': 6.0}",202.6489324904347,[],NM,False,38,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, 0.0, 0.0, 0.0, -0.0]",1.4749645918520125e-06,0.00014945,0,0.0002989,MP,data/source/MP/cleaned/cifs/MP-mp-29240.cif,True,,data/final/MP/graphs/Co0.15La1Ru2.85Si2-MP-mp-29240-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Nb3Pt0.3Rh0.7,3,0.15,2.0,False,Nb6Pt0.6Rh1.4,Nb6Rh2,5.1,Other,True,Nb75Pt7.5Rh17.5,Nb-Pt-Rh,3,Supercon,Nb3Rh0.7Pt0.3,MP-mp-1545,Nb6Rh2,Nb-Rh,Nb75Rh25,P m -3 n,cubic,5.186072,5.186072,5.186072,data/final/MP/cifs/Nb3Pt0.3Rh0.7-MP-mp-1545-synth_doped.cif,data/source/MP/raw/cifs/mp-1545.cif,mp-1545,0.0,,2011-05-14 11:20:25,9.086567873234834,10.17188/1191190,"@misc{osti_1191190,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Rh (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191190"",
    place = ""United States"",
    year = ""2015"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700041'}},0.0,5.48706495,520.0,-77.37430008,-9.67178751,{'tags': ['Niobium rhodium (3/1)']},-77.37430008,-9.67178751,-0.2547317625000005,"['xas', 'elasticity', 'bandstructure']",True,"[105216, 645269]",True,2021-05-12 10:56:12.755000,NM,8,8,mp-1545,,Nb3Rh,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Rh_pv'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Rh': 1.0}",GGA,mp-1545,"['mp-942004', 'mp-943019', 'mp-935201', 'mp-1545', 'mp-1433570', 'mp-1700041', 'mp-1786474', 'mp-1591392']",0.00021655,"{'Nb': 6.0, 'Rh': 2.0}",139.48118416938905,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",3.1050783127424102e-06,0.00021655,0,0.0004331,MP,data/source/MP/cleaned/cifs/MP-mp-1545.cif,True,,data/final/MP/graphs/Nb3Pt0.3Rh0.7-MP-mp-1545-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba1Os2P2,1,0.0,1.0,True,Ba1Os2P2,Ba1Os2P2,0.0,Other,True,Ba20Os40P40,Ba-Os-P,3,Supercon,Ba1Os2P2,MP-mp-12056,Ba1P2Os2,Ba-Os-P,Ba20Os40P40,I 4/m m m,tetragonal,4.083899997458391,4.083899997458391,6.78850956,data/final/MP/cifs/Ba1Os2P2-MP-mp-12056.cif,data/source/MP/raw/cifs/mp-12056.cif,mp-12056,0.0,,2011-05-28 04:14:29,9.395065873248427,10.17188/1188539,"@misc{osti_1188539,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba(POs)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188539"",
    place = ""United States"",
    year = ""2015"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698443'}},0.0,6.12401428,520.0,-38.55511442,-7.711022884,{'tags': ['Barium osmium phosphide (1/2/2)']},-38.55511442,-7.711022884,-0.6709612133333337,"['xas', 'bandstructure']",True,[602106],True,2021-05-12 10:56:51.169000,NM,5,8,mp-12056,,Ba(POs)2,"{'functional': 'PBE', 'labels': ['Ba_sv', 'P', 'Os_pv'], 'pot_type': 'paw'}","{'Ba': 1.0, 'P': 2.0, 'Os': 2.0}",GGA,mp-12056,"['mp-943646', 'mp-933376', 'mp-944295', 'mp-12056', 'mp-1419414', 'mp-1698443', 'mp-1795977', 'mp-1591104']",5.56e-05,"{'Ba': 1.0, 'P': 2.0, 'Os': 2.0}",102.46568127849676,[],NM,False,139,0,"[0, 0, 0, 0, 0]",5.426207029149779e-07,5.56e-05,0,5.56e-05,MP,data/source/MP/cleaned/cifs/MP-mp-12056.cif,False,,data/final/MP/graphs/Ba1Os2P2-MP-mp-12056.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ce0.21Ga1V2.79,3,0.1049999999999999,2.0,False,Ce0.42Ga2V5.58,Ga2V6,7.5,Other,True,Ce5.25Ga25V69.75,Ce-Ga-V,3,Supercon,V2.79Ce0.21Ga1,MP-mp-22568,V6Ga2,Ga-V,Ga25V75,P m -3 n,cubic,4.789645,4.789645,4.789645,data/final/MP/cifs/Ce0.21Ga1V2.79-MP-mp-22568-synth_doped.cif,data/source/MP/raw/cifs/mp-22568.cif,mp-22568,0.0,,2014-02-22 11:36:40,6.726541666276222,10.17188/1198793,"@misc{osti_1198793,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Ga (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198793"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686867'}},0.0,5.67452231,520.0,-61.95244347,-7.74405543375,{'tags': ['Gallium vanadium (1/3)']},-61.95244347,-7.74405543375,-0.1741018756249994,"['xas', 'elasticity', 'bandstructure']",True,"[635643, 635628, 635619, 635634, 104021, 635646, 635604, 635610, 635617, 635624, 635626, 635605, 635631, 635625, 635636, 635603, 104020, 635616, 635607]",True,2021-05-12 10:56:16.728000,FM,8,9,mp-22568,,V3Ga,"{'functional': 'PBE', 'labels': ['V_pv', 'Ga_d'], 'pot_type': 'paw'}","{'V': 3.0, 'Ga': 1.0}",GGA,mp-22568,"['mp-941343', 'mp-941663', 'mp-934924', 'mp-22568', 'mp-1440749', 'mp-1686867', 'mp-1804076', 'mp-1593784', 'mp-1595713']",0.09063635,"{'V': 6.0, 'Ga': 2.0}",109.87780534443452,[],FM,True,131,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.0, -0.0, -0.0]",0.0016497662965852,0.09063635,2,0.1812727,MP,data/source/MP/cleaned/cifs/MP-mp-22568.cif,True,,data/final/MP/graphs/Ce0.21Ga1V2.79-MP-mp-22568-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ga0.5Ge0.5Nb3,1,0.0,2.0,False,Ga1Ge1Nb6,Ga1Ge1Nb6,7.3,Other,True,Ga12.5Ge12.5Nb75,Ga-Ge-Nb,3,Supercon,Nb3Ge0.5Ga0.5,MP-mp-1220381,Nb6Ga1Ge1,Ga-Ge-Nb,Ga12.5Ge12.5Nb75,P m -3,cubic,5.185284,5.185284,5.185284,data/final/MP/cifs/Ga0.5Ge0.5Nb3-MP-mp-1220381.cif,data/source/MP/raw/cifs/mp-1220381.cif,mp-1220381,0.0,,2019-01-12 21:14:13.987000,8.335011174677705,,,{'GGA': {'task_id': 'mp-1753329'}},0.0597425011458341,5.38633053,520.0,-69.96900041,-8.74612505125,{'tags': []},-69.96900041,-8.74612505125,-0.2137557865625012,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,8,5,mp-1220381,,Nb6GaGe,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Ga_d', 'Ge_d'], 'pot_type': 'paw'}","{'Nb': 6.0, 'Ga': 1.0, 'Ge': 1.0}",GGA,mp-1220381,"['mp-1220381', 'mp-1389995', 'mp-1753329', 'mp-1781215', 'mp-1618442']",0.0532199,"{'Nb': 6.0, 'Ga': 1.0, 'Ge': 1.0}",139.417613239327,[],NM,False,200,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0003817301039908,0.0532199,0,0.0532199,MP,data/source/MP/cleaned/cifs/MP-mp-1220381.cif,False,,data/final/MP/graphs/Ga0.5Ge0.5Nb3-MP-mp-1220381.json,0,True,m-3,2,0,0,0,0,0,0,1,0,0,0,1.0,False
Ce1Co0.925In5Ni0.075,2,0.0214285714285714,1.0,True,Ce1Co0.925In5Ni0.075,Ce1Co1In5,1.69,Heavy_fermion,True,Ce14.286Co13.214In71.429Ni1.071,Ce-Co-In-Ni,4,Supercon,Ce1Co0.925Ni0.075In5,MP-mp-19961,Ce1In5Co1,Ce-Co-In,Ce14.286Co14.286In71.429,P 4/m m m,tetragonal,4.635989,4.635989,7.564124,data/final/MP/cifs/Ce1Co0.925In5Ni0.075-MP-mp-19961-synth_doped.cif,data/source/MP/raw/cifs/mp-19961.cif,mp-19961,0.0,,2014-02-21 14:08:25,7.897022127398995,10.17188/1195145,"@misc{osti_1195145,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeIn5Co (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195145"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701944'}},0.0,7.80626318,520.0,-28.52795357,-4.075421938571429,{'tags': ['Cerium cobalt indium (1/1/5)']},-28.52795357,-4.075421938571429,-0.2468754242857146,"['xas', 'bandstructure']",True,[102108],True,2021-05-12 10:56:57.051000,FM,7,8,mp-19961,,CeIn5Co,"{'functional': 'PBE', 'labels': ['Ce', 'In_d', 'Co'], 'pot_type': 'paw'}","{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",GGA,mp-19961,"['mp-928775', 'mp-912209', 'mp-928270', 'mp-19961', 'mp-1504062', 'mp-1701944', 'mp-1785253', 'mp-1593180']",0.9310323,"{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",162.57113333428427,[],FM,True,123,1,"[0.7, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0057269226147644,0.9310323,1,0.9310323,MP,data/source/MP/cleaned/cifs/MP-mp-19961.cif,True,,data/final/MP/graphs/Ce1Co0.925In5Ni0.075-MP-mp-19961-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Al0.9Ca1Si1.1,3,0.0666666666666667,1.0,True,Al0.9Ca1Si1.1,Al1Ca1Si1,5.57,Other,True,Al30Ca33.333Si36.667,Al-Ca-Si,3,Supercon,Ca1Al0.9Si1.1,MP-mp-3173,Ca1Al1Si1,Al-Ca-Si,Al33.333Ca33.333Si33.333,P -6 m 2,hexagonal,4.204102004380959,4.20410189,4.381114,data/final/MP/cifs/Al0.9Ca1Si1.1-MP-mp-3173-synth_doped.cif,data/source/MP/raw/cifs/mp-3173.cif,mp-3173,0.0,,2011-05-12 18:07:21,2.3559907742364445,10.17188/1205871,"@misc{osti_1205871,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CaAlSi (SG:187) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1205871"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688380'}},0.0042011372222221,5.20030027,520.0,-12.33105355,-4.110351183333333,"{'tags': ['Calcium aluminium silicide (1/1/1) - 1H', 'Calcium aluminium silicide (1/1/1) - (SrPtSb)-type']}",-12.33105355,-4.110351183333333,-0.36118794,"['xas', 'elasticity', 'bandstructure']",True,"[162864, 155853]",True,2021-05-12 10:56:20.740000,NM,3,12,mp-3173,,CaAlSi,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Al', 'Si'], 'pot_type': 'paw'}","{'Ca': 1.0, 'Al': 1.0, 'Si': 1.0}",GGA,mp-3173,"['mp-3173', 'mp-1000446', 'mp-1006914', 'mp-1170858', 'mp-1252945', 'mp-1258722', 'mp-1259938', 'mp-1439603', 'mp-1688380', 'mp-1781727', 'mp-1011629', 'mp-1597142']",0.0033294,"{'Ca': 1.0, 'Al': 1.0, 'Si': 1.0}",67.05970809230726,[],NM,False,187,0,"[0, 0, 0]",4.964829246523266e-05,0.0033294,0,0.0033294,MP,data/source/MP/cleaned/cifs/MP-mp-3173.cif,True,,data/final/MP/graphs/Al0.9Ca1Si1.1-MP-mp-3173-synth_doped.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Ba0.17Cu1La1.83O4,3,0.0485714285714285,1.0,True,Ba0.17Cu1La1.83O4,Cu1La2O4,26.9,Cuprate,True,Ba2.429Cu14.286La26.143O57.142857142857146,Ba-Cu-La-O,4,Supercon,La1.83Ba0.17Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ba0.17Cu1La1.83O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ba0.17Cu1La1.83O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Au0.93Ga2Pd0.07,2,0.0466666666666666,1.0,True,Au0.93Ga2Pd0.07,Au1Ga2,1.773,Other,True,Au31Ga66.667Pd2.333,Au-Ga-Pd,3,Supercon,Au0.93Pd0.07Ga2,MP-mp-2776,Ga2Au1,Au-Ga,Au33.333Ga66.667,F m -3 m,cubic,4.40327555,4.40327555,4.40327555,data/final/MP/cifs/Au0.93Ga2Pd0.07-MP-mp-2776-synth_doped.cif,data/source/MP/raw/cifs/mp-2776.cif,mp-2776,0.0,,2011-05-12 21:57:19,9.253557284351938,10.17188/1201942,"@misc{osti_1201942,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ga2Au (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201942"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687524'}},0.0,3.58527429,520.0,-10.04441228,-3.3481374266666664,"{'tags': ['Gold gallium (1/2)', 'Gallium gold (2/1)']}",-10.04441228,-3.3481374266666664,-0.2381128983333328,"['xas', 'elasticity', 'bandstructure']",True,"[611874, 611864, 150958, 58458]",True,2021-05-12 10:56:18.721000,NM,3,8,mp-2776,,Ga2Au,"{'functional': 'PBE', 'labels': ['Ga_d', 'Au'], 'pot_type': 'paw'}","{'Ga': 2.0, 'Au': 1.0}",GGA,mp-2776,"['mp-991379', 'mp-2776', 'mp-993315', 'mp-1439079', 'mp-1687524', 'mp-1795480', 'mp-994626', 'mp-1589089']",0.000866,"{'Ga': 2.0, 'Au': 1.0}",60.36880695215696,[],NM,False,225,0,"[0, 0, 0]",1.4345156774198237e-05,0.000866,0,0.000866,MP,data/source/MP/cleaned/cifs/MP-mp-2776.cif,True,,data/final/MP/graphs/Au0.93Ga2Pd0.07-MP-mp-2776-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
B2Ir3Sm1,1,0.0,1.0,True,B2Ir3Sm1,B2Ir3Sm1,0.0,Other,True,B33.333Ir50Sm16.667,B-Ir-Sm,3,Supercon,Sm1Ir3B2,MP-mp-1080381,Sm1B2Ir3,B-Ir-Sm,B33.333Ir50Sm16.667,P 6/m m m,hexagonal,3.153729,5.516142002931291,5.51614278,data/final/MP/cifs/B2Ir3Sm1-MP-mp-1080381.cif,data/source/MP/raw/cifs/mp-1080381.cif,mp-1080381,0.0,,2018-04-23 16:23:43,14.95863979755754,,,{'GGA': {'task_id': 'mp-1696706'}},0.0,7.78510672,520.0,-48.58002004,-8.096670006666667,"{'tags': ['ErIr3B2', 'SmIr3B2', 'Samarium iridium boride (1/3/2)']}",-48.58002004,-8.096670006666667,-0.6645598505555567,['bandstructure'],True,[614563],True,2021-05-12 10:58:16.596000,NM,6,5,mp-1080381,,SmB2Ir3,"{'functional': 'PBE', 'labels': ['Sm_3', 'B', 'Ir'], 'pot_type': 'paw'}","{'Sm': 1.0, 'B': 2.0, 'Ir': 3.0}",GGA,mp-1080381,"['mp-1080381', 'mp-1504260', 'mp-1696706', 'mp-1800030', 'mp-1593476']",5.51e-05,"{'Sm': 1.0, 'B': 2.0, 'Ir': 3.0}",83.10477154807471,[],NM,False,191,0,"[0, 0, 0, 0, 0, 0]",6.630184882720672e-07,5.51e-05,0,5.51e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1080381.cif,False,,data/final/MP/graphs/B2Ir3Sm1-MP-mp-1080381.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Al2Gd0.005La0.995,2,0.0033333333333333,2.0,False,Al4Gd0.01La1.99,Al4La2,0.932,Other,True,Al66.667Gd0.167La33.167,Al-Gd-La,3,Supercon,La0.995Gd0.005Al2,MP-mp-2694,La2Al4,Al-La,Al66.667La33.333,F d -3 m,cubic,5.75810346,5.75810346,5.75810346,data/final/MP/cifs/Al2Gd0.005La0.995-MP-mp-2694-synth_doped.cif,data/source/MP/raw/cifs/mp-2694.cif,mp-2694,0.0,,2011-05-12 21:07:48,4.744791242841679,10.17188/1201263,"@misc{osti_1201263,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaAl2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201263"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686658'}},0.0,8.10972418,520.0,-27.8605497,-4.64342495,{'tags': ['Aluminium lanthanum (2/1)']},-27.8605497,-4.64342495,-0.5010386950000001,"['xas', 'elasticity', 'bandstructure']",True,"[608275, 608277, 608265, 608290, 608288, 57933, 608270, 608269, 603920, 608272, 608286, 608273, 608289, 604450, 608266]",True,2021-05-12 10:56:18.721000,NM,6,10,mp-2694,,LaAl2,"{'functional': 'PBE', 'labels': ['La', 'Al'], 'pot_type': 'paw'}","{'La': 1.0, 'Al': 2.0}",GGA,mp-2694,"['mp-940230', 'mp-925817', 'mp-940644', 'mp-2694', 'mp-1258643', 'mp-1440554', 'mp-1686658', 'mp-1787219', 'mp-1596037', 'mp-1594760']",0.0008869,"{'La': 2.0, 'Al': 4.0}",134.99677475891534,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",1.3139573172527638e-05,0.0008869,0,0.0017738,MP,data/source/MP/cleaned/cifs/MP-mp-2694.cif,True,,data/final/MP/graphs/Al2Gd0.005La0.995-MP-mp-2694-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
C2Tb1,3,0.1333333333333334,6.0,False,C12Tb6,C12Tb8,0.0,Carbon,True,C66.667Tb33.333,C-Tb,2,Supercon,C2Tb1,MP-mp-7024,Tb8C12,C-Tb,C60Tb40,I -4 3 d,cubic,7.17817800159129,7.178178,7.178178,data/final/MP/cifs/C2Tb1-MP-mp-7024-synth_doped.cif,data/source/MP/raw/cifs/mp-7024.cif,mp-7024,0.0,,2011-06-03 14:12:00,8.25558330455064,10.17188/1285587,"@misc{osti_1285587,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Tb2C3 (SG:220) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1285587"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1669156'}},0.0218985724999969,5.2635907,520.0,-152.92645738,-7.646322869,{'tags': ['Terbium carbide (2/3)']},-152.92645738,-7.646322869,-0.2565080089999981,['bandstructure'],True,"[74663, 618873]",True,2021-05-12 10:58:53.520000,NM,20,8,mp-7024,,Tb2C3,"{'functional': 'PBE', 'labels': ['Tb_3', 'C'], 'pot_type': 'paw'}","{'Tb': 2.0, 'C': 3.0}",GGA,mp-7024,"['mp-922936', 'mp-7024', 'mp-908696', 'mp-923740', 'mp-1431942', 'mp-1669156', 'mp-1925543', 'mp-1608771']",0.000183625,"{'Tb': 8.0, 'C': 12.0}",284.72183864894333,[],NM,False,220,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.579710792418789e-06,0.000183625,0,0.0007345,MP,data/source/MP/cleaned/cifs/MP-mp-7024.cif,True,,data/final/MP/graphs/C2Tb1-MP-mp-7024-synth_doped.json,0,True,-43m,5,0,0,0,0,0,0,0,0,1,0,1.0,False
As2Te3,1,0.0,2.0,False,As4Te6,As4Te6,4.4,Other,True,As40Te60,As-Te,2,Supercon,As2Te3,MP-mp-484,Te6As4,As-Te,As40Te60,C 1 2/m 1,monoclinic,4.069223998003671,7.77178496,10.14114142,data/final/MP/cifs/As2Te3-MP-mp-484.cif,data/source/MP/raw/cifs/mp-484.cif,mp-484,0.5811000000000002,,2011-05-13 16:50:26,5.742207915849349,10.17188/1208434,"@misc{osti_1208434,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Te3As2 (SG:12) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208434"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704707'}},0.0,4.68705963,520.0,-37.64533892,-3.764533892,"{'tags': ['Diarsenic tritelluride', 'Diarsenic telluride', 'Arsenic telluride']}",-37.64533892,-3.764533892,-0.0149059719999996,"['diel', 'xas', 'elasticity', 'bandstructure']",True,"[196146, 30981, 54097, 18208]",True,2021-05-12 10:56:20.740000,NM,10,10,mp-484,,Te3As2,"{'functional': 'PBE', 'labels': ['Te', 'As'], 'pot_type': 'paw'}","{'Te': 3.0, 'As': 2.0}",GGA,mp-484,"['mp-665083', 'mp-700784', 'mp-679806', 'mp-484', 'mp-1078323', 'mp-1140490', 'mp-1413259', 'mp-1704707', 'mp-1808690', 'mp-1598972']",5.23e-05,"{'Te': 6.0, 'As': 4.0}",308.060890556594,[],NM,False,12,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.395432630575477e-07,5.23e-05,0,0.0001046,MP,data/source/MP/cleaned/cifs/MP-mp-484.cif,False,,data/final/MP/graphs/As2Te3-MP-mp-484.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
Ho1,1,0.0,3.0,False,Ho3,Ho3,0.0,Other,True,Ho100,Ho,1,Supercon,Ho1,MP-mp-10659,Ho3,Ho,Ho100,R -3 m,trigonal,3.5450346085765485,3.5450346085765485,8.79805372,data/final/MP/cifs/Ho1-MP-mp-10659.cif,data/source/MP/raw/cifs/mp-10659.cif,mp-10659,0.0,,2011-05-27 20:03:20,8.822554243159384,10.17188/1187266,"@misc{osti_1187266,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ho (SG:166) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187266"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1674258'}},0.0,3.05520371,520.0,-13.74722661,-4.58240887,"{'tags': ['Holmium', 'Holmium - HP', 'High pressure experimental phase']}",-13.74722661,-4.58240887,0.0,"['xas', 'elasticity', 'bandstructure', 'surfaces']",True,"[52519, 639322, 639321]",True,2021-05-12 10:56:10.715000,NM,3,13,mp-10659,,Ho,"{'functional': 'PBE', 'labels': ['Ho_3'], 'pot_type': 'paw'}",{'Ho': 1.0},GGA,mp-10659,"['mp-10659', 'mp-1062378', 'mp-1062425', 'mp-1062476', 'mp-1063151', 'mp-1063212', 'mp-1063289', 'mp-1439659', 'mp-1674258', 'mp-1797957', 'mp-1596725', 'mp-1063261', 'mp-1062460']",0.0021005,{'Ho': 3.0},93.12719380757169,[],NM,False,166,0,"[-0.0, 0.0, 0.0]",6.76655200522928e-05,0.0021005,0,0.0063015,MP,data/source/MP/cleaned/cifs/MP-mp-10659.cif,False,,data/final/MP/graphs/Ho1-MP-mp-10659.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Cu1La2O4.075,2,0.0090863200403836,0.98169836400818,True,Cu0.982La1.963O4,Cu1La2O4,45.0,Cuprate,True,Cu14.134La28.269O57.59717314487632,Cu-La-O,3,Supercon,La2Cu1O4.075,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La2O4.075-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La2O4.075-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B2Nd1Ru3,1,0.0,1.0,True,B2Nd1Ru3,B2Nd1Ru3,0.0,Other,True,B33.333Nd16.667Ru50,B-Nd-Ru,3,Supercon,Nd1Ru3B2,MP-mp-7099,Nd1B2Ru3,B-Nd-Ru,B33.333Nd16.667Ru50,P 6/m m m,hexagonal,3.048895,5.570777995114725,5.57077863,data/final/MP/cifs/B2Nd1Ru3-MP-mp-7099.cif,data/source/MP/raw/cifs/mp-7099.cif,mp-7099,0.0,,2011-05-28 09:12:00,9.505732516395891,10.17188/1286590,"@misc{osti_1286590,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NdB2Ru3 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1286590"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703029'}},0.0168500391666643,6.56134887,520.0,-48.39538523,-8.065897538333333,{'tags': ['Neodymium ruthenium boride (1/3/2)']},-48.39538523,-8.065897538333333,-0.4075482522222226,"['bandstructure', 'elasticity']",True,[614966],True,2021-05-12 10:56:29.056000,NM,6,8,mp-7099,,NdB2Ru3,"{'functional': 'PBE', 'labels': ['Nd_3', 'B', 'Ru_pv'], 'pot_type': 'paw'}","{'Nd': 1.0, 'B': 2.0, 'Ru': 3.0}",GGA,mp-7099,"['mp-1001895', 'mp-7099', 'mp-1008243', 'mp-1427863', 'mp-1703029', 'mp-1798509', 'mp-1012556', 'mp-1597000']",4.91e-05,"{'Nd': 1.0, 'B': 2.0, 'Ru': 3.0}",81.94168106275042,[],NM,False,191,0,"[0, 0, 0, 0, 0, 0]",5.992066474984756e-07,4.91e-05,0,4.91e-05,MP,data/source/MP/cleaned/cifs/MP-mp-7099.cif,False,,data/final/MP/graphs/B2Nd1Ru3-MP-mp-7099.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
B12Tm1,1,0.0,1.0,True,B12Tm1,B12Tm1,0.0,Other,True,B92.308Tm7.692,B-Tm,2,Supercon,B12Tm1,MP-mp-1104905,Tm1B12,B-Tm,B92.308Tm7.692,F m -3 m,cubic,5.28242707,5.282427069999999,5.282427069999999,data/final/MP/cifs/B12Tm1-MP-mp-1104905.cif,data/source/MP/raw/cifs/mp-1104905.cif,mp-1104905,0.0,,2018-07-19 00:13:52,4.758276308743612,,,{'GGA': {'task_id': 'mp-1703849'}},0.0,6.10207366,520.0,-87.898364,-6.761412615384615,"{'tags': ['Thulium boride (1/12)', 'UB12', 'TmB12']}",-87.898364,-6.761412615384615,-0.2515251789743583,['bandstructure'],True,[615607],True,2021-05-12 10:58:20.361000,NM,13,5,mp-1104905,,TmB12,"{'functional': 'PBE', 'labels': ['Tm_3', 'B'], 'pot_type': 'paw'}","{'Tm': 1.0, 'B': 12.0}",GGA,mp-1104905,"['mp-1104905', 'mp-1426335', 'mp-1703849', 'mp-1783135', 'mp-1600356']",0.0009807,"{'Tm': 1.0, 'B': 12.0}",104.22827036484368,[],NM,False,225,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",9.409155467774042e-06,0.0009807,0,0.0009807,MP,data/source/MP/cleaned/cifs/MP-mp-1104905.cif,False,,data/final/MP/graphs/B12Tm1-MP-mp-1104905.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
C1U1,1,0.0,1.0,True,C1U1,C1U1,0.0,Heavy_fermion,True,C50U50,C-U,2,Supercon,C1U1,MP-mp-2489,U1C1,C-U,C50U50,F m -3 m,cubic,3.4910979000000006,3.4910979,3.4910979,data/final/MP/cifs/C1U1-MP-mp-2489.cif,data/source/MP/raw/cifs/mp-2489.cif,mp-2489,0.0,,2011-05-12 18:30:39,13.800245874308125,10.17188/1200303,"@misc{osti_1200303,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UC (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1200303"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672868'}},0.0,11.2634611,520.0,-20.76769153,-10.383845765,"{'tags': ['Uranium carbide', 'Uranium carbide (1/1)']}",-20.76769153,-10.383845765,-0.1247504100000007,"['xas', 'elasticity', 'bandstructure']",True,"[24218, 44357, 26476, 619027, 619004, 618992, 619013, 619023, 619020, 619026, 619010, 77560, 619015, 619012, 619000, 619018, 618997, 619025, 160448, 168163, 619017, 619002, 619011]",True,2021-05-12 10:56:16.728000,NM,2,9,mp-2489,,UC,"{'functional': 'PBE', 'labels': ['U', 'C'], 'pot_type': 'paw'}","{'U': 1.0, 'C': 1.0}",GGA,mp-2489,"['mp-906098', 'mp-918941', 'mp-919950', 'mp-2489', 'mp-1440662', 'mp-1672868', 'mp-1795228', 'mp-1591741', 'mp-1593157']",0.001368,"{'U': 1.0, 'C': 1.0}",30.08645964601294,[],NM,False,225,0,"[0, 0]",4.546895899668566e-05,0.001368,0,0.001368,MP,data/source/MP/cleaned/cifs/MP-mp-2489.cif,False,,data/final/MP/graphs/C1U1-MP-mp-2489.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Bi2Ca1Cu2Sr2O8.218,2,0.0133701318613922,1.9469891457775617,False,Bi3.894Ca1.947Cu3.894Sr3.894O16,Bi4Ca2Cu4Sr4O16,70.0,Cuprate,True,Bi13.142Ca6.571Cu13.142Sr13.142O54.001839926402944,Bi-Ca-Cu-Sr-O,5,Supercon,Bi2Sr2Ca1Cu2O8.218,MP-mp-1218930,Sr4Ca2Cu4Bi4O16,Bi-Ca-Cu-Sr-O,Bi13.333Ca6.667Cu13.333Sr13.333O53.333333333333336,C c c 2,orthorhombic,5.417115,5.472898000129128,16.11398919,data/final/MP/cifs/Bi2Ca1Cu2Sr2O8.218-MP-mp-1218930-synth_doped.cif,data/source/MP/raw/cifs/mp-1218930.cif,mp-1218930,0.0,,2019-01-12 20:01:06.544000,6.266668983881059,,,,0.039252223722225,4.51768334,520.0,-173.15021002,-5.771673667333333,{'tags': []},-173.15021002,-5.771673667333333,-2.074956548222222,[],False,[],True,2021-05-12 11:00:42.526000,NM,30,3,mp-1218930,oxide,Sr2CaCu2(BiO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",GGA,mp-1218930,"['mp-1218930', 'mp-1359698', 'mp-1817714']",0.00011165,"{'Sr': 4.0, 'Ca': 2.0, 'Cu': 4.0, 'Bi': 4.0, 'O': 16.0}",470.7976286073367,[],NM,False,37,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.743014544498498e-07,0.00011165,0,0.0002233,MP,data/source/MP/cleaned/cifs/MP-mp-1218930.cif,True,,data/final/MP/graphs/Bi2Ca1Cu2Sr2O8.218-MP-mp-1218930-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Ga0.09Nb3Sn0.91,2,0.0449999999999999,2.0,False,Ga0.18Nb6Sn1.82,Nb6Sn2,18.3,Other,True,Ga2.25Nb75Sn22.75,Ga-Nb-Sn,3,Supercon,Nb3Sn0.91Ga0.09,MP-mp-1326,Nb6Sn2,Nb-Sn,Nb75Sn25,P m -3 n,cubic,5.334611,5.334611,5.334611,data/final/MP/cifs/Ga0.09Nb3Sn0.91-MP-mp-1326-synth_doped.cif,data/source/MP/raw/cifs/mp-1326.cif,mp-1326,0.0,,2011-05-14 09:51:48,8.694218121896231,10.17188/1189484,"@misc{osti_1189484,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Sn (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189484"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668415'}},0.0,6.59372491,520.0,-69.93787048,-8.74223381,{'tags': ['Niobium tin (3/1)']},-69.93787048,-8.74223381,-0.163862066250001,"['xas', 'elasticity', 'bandstructure']",True,"[105230, 645503, 645489, 105231, 645498, 645485, 645474, 645496, 645480, 645488, 645482, 645487, 645500, 645493, 645477, 645484, 645502, 645483, 150878, 645479, 645481, 645486, 645473]",True,2021-05-12 10:56:12.755000,NM,8,9,mp-1326,,Nb3Sn,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Sn_d'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Sn': 1.0}",GGA,mp-1326,"['mp-930046', 'mp-913770', 'mp-930577', 'mp-1326', 'mp-1440651', 'mp-1668415', 'mp-1880085', 'mp-1594093', 'mp-1594507']",0.62023085,"{'Nb': 6.0, 'Sn': 2.0}",151.81275738025872,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0081709977567491,0.62023085,0,1.2404617,MP,data/source/MP/cleaned/cifs/MP-mp-1326.cif,True,,data/final/MP/graphs/Ga0.09Nb3Sn0.91-MP-mp-1326-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ge2Pd2Th1,1,0.0,1.0,True,Ge2Pd2Th1,Ge2Pd2Th1,1.1,Other,True,Ge40Pd40Th20,Ge-Pd-Th,3,Supercon,Th1Pd2Ge2,MP-mp-4147,Th1Ge2Pd2,Ge-Pd-Th,Ge40Pd40Th20,I 4/m m m,tetragonal,4.325614003167603,4.325614003167604,5.99074722,data/final/MP/cifs/Ge2Pd2Th1-MP-mp-4147.cif,data/source/MP/raw/cifs/mp-4147.cif,mp-4147,0.0,,2011-05-13 09:59:48,10.167728903022285,10.17188/1207889,"@misc{osti_1207889,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Th(GePd)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207889"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703259'}},0.0,6.15509197,520.0,-31.08789283,-6.217578566,{'tags': ['Palladium thorium germanide (2/1/2)']},-31.08789283,-6.217578566,-0.8136430500000003,"['xas', 'bandstructure']",True,"[637561, 53884]",True,2021-05-12 10:57:08.928000,NM,5,6,mp-4147,,Th(GePd)2,"{'functional': 'PBE', 'labels': ['Th', 'Ge_d', 'Pd'], 'pot_type': 'paw'}","{'Th': 1.0, 'Ge': 2.0, 'Pd': 2.0}",GGA,mp-4147,"['mp-996578', 'mp-4147', 'mp-1441188', 'mp-1703259', 'mp-1797194', 'mp-1587538']",0.0003812,"{'Th': 1.0, 'Ge': 2.0, 'Pd': 2.0}",96.38145582417864,[],NM,False,139,0,"[0, 0, 0, 0, 0]",3.95511768047366e-06,0.0003812,0,0.0003812,MP,data/source/MP/cleaned/cifs/MP-mp-4147.cif,False,,data/final/MP/graphs/Ge2Pd2Th1-MP-mp-4147.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Co0.8Fe0.2Ga5Pu1,3,0.0571428571428571,1.0,True,Co0.8Fe0.2Ga5Pu1,Co1Ga5Pu1,10.0,Heavy_fermion,True,Co11.429Fe2.857Ga71.429Pu14.286,Co-Fe-Ga-Pu,4,Supercon,Pu1Co0.8Fe0.2Ga5,MP-mp-1206185,Pu1Ga5Co1,Co-Ga-Pu,Co14.286Ga71.429Pu14.286,P 4/m m m,tetragonal,4.21614,4.21614,6.713162,data/final/MP/cifs/Co0.8Fe0.2Ga5Pu1-MP-mp-1206185-synth_doped.cif,data/source/MP/raw/cifs/mp-1206185.cif,mp-1206185,0.0,,2019-01-12 09:32:50.345000,9.066475010423687,,,{'GGA': {'task_id': 'mp-1735508'}},0.1559735717857142,5.95141073,520.0,-37.77932529,-5.39704647,"{'tags': ['PuCoGa5 hyp', 'HoCoGa5']}",-37.77932529,-5.39704647,-0.1803841503571429,['bandstructure'],True,[],True,2021-05-12 10:58:37.524000,FM,7,5,mp-1206185,,PuGa5Co,"{'functional': 'PBE', 'labels': ['Pu', 'Ga_d', 'Co'], 'pot_type': 'paw'}","{'Pu': 1.0, 'Ga': 5.0, 'Co': 1.0}",GGA,mp-1206185,"['mp-1206185', 'mp-1446054', 'mp-1735508', 'mp-1784841', 'mp-1627590']",0.283083,"{'Pu': 1.0, 'Ga': 5.0, 'Co': 1.0}",119.33207010732774,[],FM,True,123,2,"[0.3, -0.0, -0.0, -0.0, -0.0, -0.0, 0.1]",0.0023722290223021,0.283083,2,0.283083,MP,data/source/MP/cleaned/cifs/MP-mp-1206185.cif,True,,data/final/MP/graphs/Co0.8Fe0.2Ga5Pu1-MP-mp-1206185-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
C2Cr3,1,0.0,4.0,False,C8Cr12,C8Cr12,0.0,Other,True,C40Cr60,C-Cr,2,Supercon,C2Cr3,MP-mp-20937,Cr12C8,C-Cr,C40Cr60,P n m a,orthorhombic,2.788369,5.48245,11.5101,data/final/MP/cifs/C2Cr3-MP-mp-20937.cif,data/source/MP/raw/cifs/mp-20937.cif,mp-20937,0.0,,2013-06-23 17:23:04,6.795180145961777,10.17188/1196130,"@misc{osti_1196130,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Cr3C2 (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196130"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704555'}},0.0,8.33263647,520.0,-191.65615505,-9.5828077525,"{'tags': ['Tongbaite', 'Chromium carbide (3/2)']}",-191.65615505,-9.5828077525,-0.100266990499999,"['xas', 'elasticity', 'bandstructure']",True,"[601754, 181712, 15086, 658153, 43376, 653958, 617482, 76798, 151477]",True,2021-05-12 10:56:14.760000,NM,20,10,mp-20937,,Cr3C2,"{'functional': 'PBE', 'labels': ['Cr_pv', 'C'], 'pot_type': 'paw'}","{'Cr': 3.0, 'C': 2.0}",GGA,mp-20937,"['mp-926405', 'mp-926839', 'mp-637774', 'mp-910533', 'mp-20937', 'mp-1188176', 'mp-1434717', 'mp-1704555', 'mp-1787360', 'mp-1609245']",0.002328875,"{'Cr': 12.0, 'C': 8.0}",175.9559763221779,[],NM,False,62,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",5.2942219950194745e-05,0.002328875,0,0.0093155,MP,data/source/MP/cleaned/cifs/MP-mp-20937.cif,False,,data/final/MP/graphs/C2Cr3-MP-mp-20937.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
B2Gd1Rh3,1,0.0,1.0,True,B2Gd1Rh3,B2Gd1Rh3,0.0,Other,True,B33.333Gd16.667Rh50,B-Gd-Rh,3,Supercon,Gd1Rh3B2,MP-mp-22117,Gd1B2Rh3,B-Gd-Rh,B33.333Gd16.667Rh50,P 6/m m m,hexagonal,3.130228,5.462473997972291,5.46247378,data/final/MP/cifs/B2Gd1Rh3-MP-mp-22117.cif,data/source/MP/raw/cifs/mp-22117.cif,mp-22117,0.0,,2014-02-21 14:46:53,10.009611122426948,10.17188/1197356,"@misc{osti_1197356,
    author = ""Persson, Kristin"",
    title = ""Materials Data on GdB2Rh3 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197356"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704277'}},0.0,5.87339646,520.0,-53.67151663,-8.945252771666667,{'tags': ['Gadolinium rhodium boride (1/3/2)']},-53.67151663,-8.945252771666667,-0.6906145397222213,"['xas', 'bandstructure']",True,"[44311, 614373]",True,2021-05-12 10:56:59.077000,FM,6,6,mp-22117,,GdB2Rh3,"{'functional': 'PBE', 'labels': ['Gd', 'B', 'Rh_pv'], 'pot_type': 'paw'}","{'Gd': 1.0, 'B': 2.0, 'Rh': 3.0}",GGA,mp-22117,"['mp-22117', 'mp-1440480', 'mp-1704277', 'mp-1768590', 'mp-1784002', 'mp-1594551']",6.9965222,"{'Gd': 1.0, 'B': 2.0, 'Rh': 3.0}",80.88823259685063,[],FM,True,191,1,"[7.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0864961685449461,6.9965222,1,6.9965222,MP,data/source/MP/cleaned/cifs/MP-mp-22117.cif,False,,data/final/MP/graphs/B2Gd1Rh3-MP-mp-22117.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Co1.95Cu1Ir0.05S4,2,0.0142857142857142,2.0,False,Co3.9Cu2Ir0.1S8,Co4Cu2S8,2.13,Other,True,Co27.857Cu14.286Ir0.714S57.143,Co-Cu-Ir-S,4,Supercon,Cu1Co1.95Ir0.05S4,MP-mp-3925,Co4Cu2S8,Co-Cu-S,Co28.571Cu14.286S57.143,F d -3 m,cubic,6.69987918,6.699879179999999,6.699879179999999,data/final/MP/cifs/Co1.95Cu1Ir0.05S4-MP-mp-3925-synth_doped.cif,data/source/MP/raw/cifs/mp-3925.cif,mp-3925,0.0,,2011-05-15 03:07:38,4.836104359598833,10.17188/1207634,"@misc{osti_1207634,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Co2CuS4 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207634"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698326'}},0.0,5.68331854,520.0,-75.59837827,-5.399884162142857,"{'tags': ['Cobalt copper sulfide (2/1/4)', 'Carrollite', 'Dicobalt(III) copper sulfide']}",-75.59837827,-5.399884162142857,-0.7070782010714284,"['xas', 'bandstructure']",True,"[622571, 31107, 52943]",True,2021-05-12 10:57:08.928000,NM,14,8,mp-3925,,Co2CuS4,"{'functional': 'PBE', 'labels': ['Co', 'Cu_pv', 'S'], 'pot_type': 'paw'}","{'Co': 2.0, 'Cu': 1.0, 'S': 4.0}",GGA,mp-3925,"['mp-931396', 'mp-915858', 'mp-932359', 'mp-3925', 'mp-1425952', 'mp-1698326', 'mp-1833413', 'mp-1599756']",0.00593025,"{'Co': 4.0, 'Cu': 2.0, 'S': 8.0}",212.6600516474575,[],NM,False,227,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",5.5772110972972206e-05,0.00593025,0,0.0118605,MP,data/source/MP/cleaned/cifs/MP-mp-3925.cif,True,,data/final/MP/graphs/Co1.95Cu1Ir0.05S4-MP-mp-3925-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Co0.06Ge2Pd1.94Sr1,2,0.024,1.0,True,Co0.06Ge2Pd1.94Sr1,Ge2Pd2Sr1,2.58,Other,True,Co1.2Ge40Pd38.8Sr20,Co-Ge-Pd-Sr,4,Supercon,Sr1Pd1.94Co0.06Ge2,MP-mp-978986,Sr1Ge2Pd2,Ge-Pd-Sr,Ge40Pd40Sr20,I 4/m m m,tetragonal,4.438671999438209,4.438671999438209,6.03054834,data/final/MP/cifs/Co0.06Ge2Pd1.94Sr1-MP-mp-978986-synth_doped.cif,data/source/MP/raw/cifs/mp-978986.cif,mp-978986,0.0,,2015-10-09 03:56:43,7.295677176868866,10.17188/1316057,"@misc{osti_1316057,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr(GePd)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1316057"",
    place = ""United States"",
    year = ""2016"",
    month = ""9"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688092'}},0.0,4.0155429,520.0,-24.8627221,-4.97254442,"{'tags': ['Strontium palladium germanide (1/2/2)', 'Strontium palladium germanium (1/2/2)', 'High pressure experimental phase']}",-24.8627221,-4.97254442,-0.7134818633333324,"['xas', 'elasticity', 'bandstructure']",True,"[165985, 181157, 181155, 181156, 168133]",True,2021-05-12 10:56:37.246000,NM,5,9,mp-978986,,Sr(GePd)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ge_d', 'Pd'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Ge': 2.0, 'Pd': 2.0}",GGA,mp-978986,"['mp-1005776', 'mp-978986', 'mp-1005866', 'mp-979737', 'mp-1438850', 'mp-1688092', 'mp-1782349', 'mp-1011093', 'mp-1589601']",0.0012593,"{'Sr': 1.0, 'Ge': 2.0, 'Pd': 2.0}",101.45304755163892,[],NM,False,139,0,"[0, 0, 0, 0, 0]",1.2412638460752248e-05,0.0012593,0,0.0012593,MP,data/source/MP/cleaned/cifs/MP-mp-978986.cif,True,,data/final/MP/graphs/Co0.06Ge2Pd1.94Sr1-MP-mp-978986-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Fe3Si5Sm2,1,0.0,4.0,False,Fe12Si20Sm8,Fe12Si20Sm8,0.0,Other,True,Fe30Si50Sm20,Fe-Si-Sm,3,Supercon,Sm2Fe3Si5,MP-mp-1200246,Sm8Fe12Si20,Fe-Si-Sm,Fe30Si50Sm20,P 4/m n c,tetragonal,5.5859,10.454031,10.454031,data/final/MP/cifs/Fe3Si5Sm2-MP-mp-1200246.cif,data/source/MP/raw/cifs/mp-1200246.cif,mp-1200246,0.0,,2019-01-12 04:41:27.289000,6.622762494834453,,,,0.0047777997499993,7.20059642,520.0,-274.31162202,-6.857790550500001,"{'tags': ['Sm2Fe3Si5', 'Samarium iron silicide (2/3/5)', 'U2Mn3Si5']}",-274.31162202,-6.857790550500001,-0.6249137785000002,[],False,[633562],True,2021-05-12 11:00:08.243000,NM,40,3,mp-1200246,,Sm2Fe3Si5,"{'functional': 'PBE', 'labels': ['Sm_3', 'Fe_pv', 'Si'], 'pot_type': 'paw'}","{'Sm': 2.0, 'Fe': 3.0, 'Si': 5.0}",GGA,mp-1200246,"['mp-1200246', 'mp-1340575', 'mp-1892858']",0.000602525,"{'Sm': 8.0, 'Fe': 12.0, 'Si': 20.0}",610.4649358596813,[],NM,False,128,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",3.947974500134066e-06,0.000602525,0,0.0024101,MP,data/source/MP/cleaned/cifs/MP-mp-1200246.cif,False,,data/final/MP/graphs/Fe3Si5Sm2-MP-mp-1200246.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B2C1Ni2Tb0.9Y0.1,2,0.0333333333333333,1.0,True,B2C1Ni2Tb0.9Y0.1,B2C1Ni2Tb1,0.0,Other,True,B33.333C16.667Ni33.333Tb15Y1.667,B-C-Ni-Tb-Y,5,Supercon,Y0.1Tb0.9Ni2B2C1,MP-mp-6092,Tb1Ni2B2C1,B-C-Ni-Tb,B33.333C16.667Ni33.333Tb16.667,I 4/m m m,tetragonal,3.5665140003823987,3.5665140003823987,5.7333997100000005,data/final/MP/cifs/B2C1Ni2Tb0.9Y0.1-MP-mp-6092-synth_doped.cif,data/source/MP/raw/cifs/mp-6092.cif,mp-6092,0.0,,2011-05-13 04:21:03,7.858244682564482,10.17188/1277657,"@misc{osti_1277657,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TbNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277657"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686417'}},0.0,6.76233636,520.0,-41.85355222,-6.975592036666666,{'tags': []},-41.85355222,-6.975592036666666,-0.5122247530555543,"['xas', 'elasticity', 'bandstructure']",True,"[89159, 89157, 79572, 56648, 89155, 89156, 89160, 89158]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-6092,,TbNi2B2C,"{'functional': 'PBE', 'labels': ['Tb_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Tb': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6092,"['mp-1007320', 'mp-1000865', 'mp-6092', 'mp-1440112', 'mp-1686417', 'mp-1793943', 'mp-1012059', 'mp-1590555']",0.0029604,"{'Tb': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.4949740949675,[],NM,False,139,0,"[-0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",4.520041485484718e-05,0.0029604,0,0.0029604,MP,data/source/MP/cleaned/cifs/MP-mp-6092.cif,True,,data/final/MP/graphs/B2C1Ni2Tb0.9Y0.1-MP-mp-6092-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
La0.76Pb3Th0.24,3,0.12,1.0,True,La0.76Pb3Th0.24,La1Pb3,1.46,Other,True,La19Pb75Th6,La-Pb-Th,3,Supercon,La0.76Th0.24Pb3,MP-mp-21432,La1Pb3,La-Pb,La25Pb75,P m -3 m,cubic,4.968277,4.968277,4.968277,data/final/MP/cifs/La0.76Pb3Th0.24-MP-mp-21432-synth_doped.cif,data/source/MP/raw/cifs/mp-21432.cif,mp-21432,0.0,,2014-02-21 08:53:02,10.297552988886016,10.17188/1196890,"@misc{osti_1196890,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaPb3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196890"",
    place = ""United States"",
    year = ""2016"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687535'}},0.0,7.94036935,520.0,-17.86283558,-4.465708895,{'tags': ['Lanthanum lead (1/3)']},-17.86283558,-4.465708895,-0.447221816249999,"['xas', 'elasticity', 'bandstructure']",True,"[641644, 104691, 641647, 641640, 104692, 151360]",True,2021-05-12 10:56:16.728000,NM,4,8,mp-21432,,LaPb3,"{'functional': 'PBE', 'labels': ['La', 'Pb_d'], 'pot_type': 'paw'}","{'La': 1.0, 'Pb': 3.0}",GGA,mp-21432,"['mp-993074', 'mp-991107', 'mp-21432', 'mp-1439281', 'mp-1687535', 'mp-1784789', 'mp-994394', 'mp-1589043']",0.0017048,"{'La': 1.0, 'Pb': 3.0}",122.63583830653424,[],NM,False,221,0,"[0, 0, 0, 0]",1.3901319740961604e-05,0.0017048,0,0.0017048,MP,data/source/MP/cleaned/cifs/MP-mp-21432.cif,True,,data/final/MP/graphs/La0.76Pb3Th0.24-MP-mp-21432-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
C2La0.9Ni1Y0.1,2,0.0499999999999999,1.0,True,C2La0.9Ni1Y0.1,C2La1Ni1,2.29,Other,True,C50La22.5Ni25Y2.5,C-La-Ni-Y,4,Supercon,La0.9Y0.1Ni1C2,MP-mp-1018048,La1Ni1C2,C-La-Ni,C50La25Ni25,A m m 2,orthorhombic,3.82731293,3.82731293,3.977635,data/final/MP/cifs/C2La0.9Ni1Y0.1-MP-mp-1018048-synth_doped.cif,data/source/MP/raw/cifs/mp-1018048.cif,mp-1018048,0.0,,2017-04-06 23:27:44,6.5955568384756855,10.17188/1350127,"@article{osti_1350127,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaNiC2 (SG:38) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1350127"",
    place = ""United States"",
    year = ""2017"",
    month = ""4""
}
",{'GGA': {'task_id': 'mp-1697101'}},0.0,8.87914765,520.0,-30.18892584,-7.54723146,"{'tags': ['LaNiC2', 'Lanthanum nickel carbide (1/1/2)', 'CeNiC2']}",-30.18892584,-7.54723146,-0.2548051637499995,"['bandstructure', 'elasticity']",True,[618179],True,2021-05-12 10:56:08.727000,NM,4,12,mp-1018048,,LaNiC2,"{'functional': 'PBE', 'labels': ['La', 'Ni_pv', 'C'], 'pot_type': 'paw'}","{'La': 1.0, 'Ni': 1.0, 'C': 2.0}",GGA,mp-1018048,"['mp-1018048', 'mp-1018270', 'mp-1018463', 'mp-1067001', 'mp-1067047', 'mp-1067181', 'mp-1115476', 'mp-1412950', 'mp-1697101', 'mp-1783297', 'mp-1594865', 'mp-1067093']",0.005804,"{'La': 1.0, 'Ni': 1.0, 'C': 2.0}",55.79651958097468,[],NM,False,38,0,"[0.0, -0.0, 0.0, 0.0]",0.0001040208250189,0.005804,0,0.005804,MP,data/source/MP/cleaned/cifs/MP-mp-1018048.cif,True,,data/final/MP/graphs/C2La0.9Ni1Y0.1-MP-mp-1018048-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Sc1Tc2,1,0.0,4.0,False,Sc4Tc8,Sc4Tc8,10.9,Other,True,Sc33.333Tc66.667,Sc-Tc,2,Supercon,Sc1Tc2,MP-mp-1101860,Sc4Tc8,Sc-Tc,Sc33.333Tc66.667,P 63/m m c,hexagonal,5.235872722213048,5.23587322,8.635025,data/final/MP/cifs/Sc1Tc2-MP-mp-1101860.cif,data/source/MP/raw/cifs/mp-1101860.cif,mp-1101860,0.0,,2018-07-18 12:41:34,7.806821316854238,,,,0.0,6.52223606,520.0,-111.87526256,-9.322938546666666,"{'tags': ['ScTc2', 'MgZn2', 'Friauf-Laves phase, Frank-Kasper phase', 'Scandium technetium (1/2)']}",-111.87526256,-9.322938546666666,-0.3050355716666655,[],False,"[651832, 651831]",True,2021-05-12 10:59:31.014000,NM,12,4,mp-1101860,,ScTc2,"{'functional': 'PBE', 'labels': ['Sc_sv', 'Tc_pv'], 'pot_type': 'paw'}","{'Sc': 1.0, 'Tc': 2.0}",GGA,mp-1101860,"['mp-1101860', 'mp-1102853', 'mp-1831168', 'mp-1986578']",0.014545225,"{'Sc': 4.0, 'Tc': 8.0}",205.008768083581,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.000283797129966,0.014545225,0,0.0581809,MP,data/source/MP/cleaned/cifs/MP-mp-1101860.cif,False,,data/final/MP/graphs/Sc1Tc2-MP-mp-1101860.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Cu1Dy0.75La1.25O4,1,0.0,4.0,False,Cu4Dy3La5O16,Cu4Dy3La5O16,0.0,Cuprate,True,Cu14.286Dy10.714La17.857O57.142857142857146,Cu-Dy-La-O,4,Supercon,La1.25Dy0.75Cu1O4,MP-mp-1223395,La5Dy3Cu4O16,Cu-Dy-La-O,Cu14.286Dy10.714La17.857O57.142857142857146,P 4 m m,tetragonal,3.868272,3.868272,24.995763,data/final/MP/cifs/Cu1Dy0.75La1.25O4-MP-mp-1223395.cif,data/source/MP/raw/cifs/mp-1223395.cif,mp-1223395,0.0,,2019-01-12 23:47:44.805000,7.512782756684467,,,{'GGA': {'task_id': 'mp-1679884'}},0.0494778690178607,6.17241148,520.0,-207.82535019,-7.422333935357143,{'tags': []},-207.82535019,-7.422333935357143,-3.026883978035713,[],False,[],True,2021-05-12 11:00:52.054000,NM,28,4,mp-1223395,oxide,La5Dy3(CuO4)4,"{'functional': 'PBE', 'labels': ['La', 'Dy_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 5.0, 'Dy': 3.0, 'Cu': 4.0, 'O': 16.0}",GGA,mp-1223395,"['mp-1223395', 'mp-1343793', 'mp-1679884', 'mp-1837281']",0.0047116,"{'La': 5.0, 'Dy': 3.0, 'Cu': 4.0, 'O': 16.0}",374.02480618033707,[],NM,False,99,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, 0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",1.2597025443623355e-05,0.0047116,0,0.0047116,MP,data/source/MP/cleaned/cifs/MP-mp-1223395.cif,False,,data/final/MP/graphs/Cu1Dy0.75La1.25O4-MP-mp-1223395.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
Bi1K0.8La0.2O3,3,0.0799999999999999,1.0,True,Bi1K0.8La0.2O3,Bi1K1O3,12.2,Oxide,True,Bi20K16La4O60,Bi-K-La-O,4,Supercon,K0.8La0.2Bi1O3,MP-mp-982040,K1Bi1O3,Bi-K-O,Bi20K20O60,P m -3 m,cubic,4.284204,4.284204,4.284204,data/final/MP/cifs/Bi1K0.8La0.2O3-MP-mp-982040-synth_doped.cif,data/source/MP/raw/cifs/mp-982040.cif,mp-982040,0.0,,2015-10-12 11:25:13,6.252348761231978,10.17188/1316390,"@misc{osti_1316390,
    author = ""Persson, Kristin"",
    title = ""Materials Data on KBiO3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1316390"",
    place = ""United States"",
    year = ""2016"",
    month = ""9"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1717462'}},0.0928686834999998,1.80216133,520.0,-25.20286901,-5.040573802,{'tags': []},-25.20286901,-5.040573802,-1.4839105476,"['xas', 'elasticity']",False,[],True,2021-05-12 10:56:37.246000,NM,5,9,mp-982040,oxide,KBiO3,"{'functional': 'PBE', 'labels': ['K_sv', 'Bi', 'O'], 'pot_type': 'paw'}","{'K': 1.0, 'Bi': 1.0, 'O': 3.0}",GGA,mp-982040,"['mp-982222', 'mp-1006156', 'mp-982040', 'mp-1006117', 'mp-1431172', 'mp-1717462', 'mp-1798749', 'mp-1011221', 'mp-1585048']",0.0005425,"{'K': 1.0, 'Bi': 1.0, 'O': 3.0}",78.63401066432932,[],NM,False,221,0,"[0, 0, 0, 0, 0]",6.899050365315956e-06,0.0005425,0,0.0005425,MP,data/source/MP/cleaned/cifs/MP-mp-982040.cif,True,,data/final/MP/graphs/Bi1K0.8La0.2O3-MP-mp-982040-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
C1La3Tl1,1,0.0,1.0,True,C1La3Tl1,C1La3Tl1,0.0,Other,True,C20La60Tl20,C-La-Tl,3,Supercon,C1La3Tl1,MP-mp-7159,La3Tl1C1,C-La-Tl,C20La60Tl20,P m -3 m,cubic,5.249037,5.249037,5.249037,data/final/MP/cifs/C1La3Tl1-MP-mp-7159.cif,data/source/MP/raw/cifs/mp-7159.cif,mp-7159,0.0,,2011-05-28 04:03:53,7.269250746729196,10.17188/1282141,"@misc{osti_1282141,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La3TlC (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1282141"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700597'}},0.0,7.35450814,520.0,-27.85578256,-5.571156512,{'tags': ['Lanthanum thallium carbide (3/1/1)']},-27.85578256,-5.571156512,-0.2916674796666669,"['bandstructure', 'elasticity']",True,[56402],True,2021-05-12 10:56:29.056000,NM,5,8,mp-7159,,La3TlC,"{'functional': 'PBE', 'labels': ['La', 'Tl_d', 'C'], 'pot_type': 'paw'}","{'La': 3.0, 'Tl': 1.0, 'C': 1.0}",GGA,mp-7159,"['mp-910991', 'mp-926588', 'mp-927120', 'mp-7159', 'mp-1475682', 'mp-1700597', 'mp-1779063', 'mp-1593760']",0.0019295,"{'La': 3.0, 'Tl': 1.0, 'C': 1.0}",144.62351154266872,[],NM,False,221,0,"[0, 0, 0, 0, 0]",1.3341537481827317e-05,0.0019295,0,0.0019295,MP,data/source/MP/cleaned/cifs/MP-mp-7159.cif,False,,data/final/MP/graphs/C1La3Tl1-MP-mp-7159.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Bi0.1Pt1Sb0.9,3,0.0999999999999999,2.0,False,Bi0.2Pt2Sb1.8,Pt2Sb2,1.21,Other,True,Bi5Pt50Sb45,Bi-Pt-Sb,3,Supercon,Bi0.1Pt1Sb0.9,MP-mp-2845,Sb2Pt2,Pt-Sb,Pt50Sb50,P 63/m m c,hexagonal,4.208133997890831,4.20813491,5.589409,data/final/MP/cifs/Bi0.1Pt1Sb0.9-MP-mp-2845-synth_doped.cif,data/source/MP/raw/cifs/mp-2845.cif,mp-2845,0.0,,2011-05-12 20:23:42,12.275771957890468,10.17188/1202554,"@misc{osti_1202554,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SbPt (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1202554"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688267'}},0.0,8.14326013,520.0,-22.06200421,-5.5155010525,"{'tags': ['Platinum(III) antimonide', 'Platinum antimonide (1/1)', 'Stumpflite']}",-22.06200421,-5.5155010525,-0.5115465774999999,"['xas', 'elasticity', 'bandstructure']",True,"[16969, 649552, 649561, 649556]",True,2021-05-12 10:56:18.721000,NM,4,8,mp-2845,,SbPt,"{'functional': 'PBE', 'labels': ['Sb', 'Pt'], 'pot_type': 'paw'}","{'Sb': 1.0, 'Pt': 1.0}",GGA,mp-2845,"['mp-925211', 'mp-924645', 'mp-909507', 'mp-2845', 'mp-1439801', 'mp-1688267', 'mp-1781514', 'mp-1594820']",0.0005052,"{'Sb': 2.0, 'Pt': 2.0}",85.71873798610766,[],NM,False,194,0,"[0, 0, 0, 0]",1.1787387725700703e-05,0.0005052,0,0.0010104,MP,data/source/MP/cleaned/cifs/MP-mp-2845.cif,True,,data/final/MP/graphs/Bi0.1Pt1Sb0.9-MP-mp-2845-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Mn0.03Si1V2.97,2,0.0149999999999999,2.0,False,Mn0.06Si2V5.94,Si2V6,16.25,Other,True,Mn0.75Si25V74.25,Mn-Si-V,3,Supercon,Mn0.03Si1V2.97,MP-mp-2567,V6Si2,Si-V,Si25V75,P m -3 n,cubic,4.702381,4.702381,4.702381,data/final/MP/cifs/Mn0.03Si1V2.97-MP-mp-2567-synth_doped.cif,data/source/MP/raw/cifs/mp-2567.cif,mp-2567,0.0,,2011-05-13 19:15:43,5.778142190030859,10.17188/1200874,"@misc{osti_1200874,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Si (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1200874"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668672'}},0.0,7.30599425,520.0,-69.05773321,-8.63221665125,{'tags': ['Vanadium silicide (3/1)']},-69.05773321,-8.63221665125,-0.4452085937499994,"['xas', 'elasticity', 'bandstructure']",True,"[652491, 87328, 652522, 652502, 652510, 652520, 600518, 186003, 652507, 652513, 652497, 601150, 652514, 652487, 22412, 652509, 652529, 652532, 652499, 652539, 652537, 652533, 652512, 652538, 652490, 652493, 652494, 652511, 652519, 87329, 652526, 652500]",True,2021-05-12 10:56:18.721000,FM,8,13,mp-2567,,V3Si,"{'functional': 'PBE', 'labels': ['V_pv', 'Si'], 'pot_type': 'paw'}","{'V': 3.0, 'Si': 1.0}",GGA,mp-2567,"['mp-920081', 'mp-906309', 'mp-919083', 'mp-2567', 'mp-1078474', 'mp-1078852', 'mp-1138781', 'mp-1145907', 'mp-1440678', 'mp-1668672', 'mp-1795955', 'mp-1593554', 'mp-1596575']",0.8382519,"{'V': 6.0, 'Si': 2.0}",103.98086881866836,[],FM,True,131,1,"[0.2, 0.3, 0.3, 0.2, 0.3, 0.3, 0.0, 0.0]",0.0161231947669493,0.8382519,6,1.6765038,MP,data/source/MP/cleaned/cifs/MP-mp-2567.cif,True,,data/final/MP/graphs/Mn0.03Si1V2.97-MP-mp-2567-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Si0.2Sn0.8V3,3,0.0999999999999999,2.0,False,Si0.4Sn1.6V6,Sn2V6,6.4,Other,True,Si5Sn20V75,Si-Sn-V,3,Supercon,V3Si0.2Sn0.8,MP-mp-21342,V6Sn2,Sn-V,Sn25V75,P m -3 n,cubic,4.964966,4.964966,4.964966,data/final/MP/cifs/Si0.2Sn0.8V3-MP-mp-21342-synth_doped.cif,data/source/MP/raw/cifs/mp-21342.cif,mp-21342,0.0,,2014-02-22 08:04:37,7.368095966501239,10.17188/1196758,"@misc{osti_1196758,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Sn (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196758"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702465'}},0.0,7.68691019,520.0,-63.04343383,-7.88042922875,{'tags': ['Tin vanadium (1/3)']},-63.04343383,-7.88042922875,-0.0651067124999995,"['xas', 'elasticity', 'bandstructure']",True,"[106097, 652826, 652827, 652825, 652830, 652831, 652824]",True,2021-05-12 10:56:16.728000,FM,8,8,mp-21342,,V3Sn,"{'functional': 'PBE', 'labels': ['V_pv', 'Sn_d'], 'pot_type': 'paw'}","{'V': 3.0, 'Sn': 1.0}",GGA,mp-21342,"['mp-942096', 'mp-932834', 'mp-943109', 'mp-21342', 'mp-1441571', 'mp-1702465', 'mp-1803347', 'mp-1596265']",0.7034491,"{'V': 6.0, 'Sn': 2.0}",122.3908177172686,[],FM,True,223,1,"[0.2, 0.2, 0.2, 0.2, 0.2, 0.2, 0.0, 0.0]",0.0114951286889024,0.7034491,6,1.4068982,MP,data/source/MP/cleaned/cifs/MP-mp-21342.cif,True,,data/final/MP/graphs/Si0.2Sn0.8V3-MP-mp-21342-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ir1Nb1,1,0.0,1.0,True,Ir1Nb1,Ir1Nb1,7.9,Other,True,Ir50Nb50,Ir-Nb,2,Supercon,Ir1Nb1,MP-mp-1359,Nb1Ir1,Ir-Nb,Ir50Nb50,P 4/m m m,tetragonal,2.884095,2.884095,3.897234,data/final/MP/cifs/Ir1Nb1-MP-mp-1359.cif,data/source/MP/raw/cifs/mp-1359.cif,mp-1359,0.0,,2011-05-12 22:45:42,14.60516010633782,10.17188/1189675,"@misc{osti_1189675,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbIr (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189675"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688420'}},0.0,7.1614056,520.0,-19.97897518,-9.98948759,{'tags': ['Iridium niobium (1/1)']},-19.97897518,-9.98948759,-0.5196198599999988,"['xas', 'elasticity', 'bandstructure']",True,"[640846, 104509, 640836, 104510, 640829]",True,2021-05-12 10:56:12.755000,NM,2,8,mp-1359,,NbIr,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Ir'], 'pot_type': 'paw'}","{'Nb': 1.0, 'Ir': 1.0}",GGA,mp-1359,"['mp-929389', 'mp-912591', 'mp-929015', 'mp-1359', 'mp-1476237', 'mp-1688420', 'mp-1790803', 'mp-1587899']",2e-06,"{'Nb': 1.0, 'Ir': 1.0}",32.41720788021917,[],NM,False,123,0,"[0, 0]",6.169562805624574e-08,2e-06,0,2e-06,MP,data/source/MP/cleaned/cifs/MP-mp-1359.cif,False,,data/final/MP/graphs/Ir1Nb1-MP-mp-1359.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ho1Pb1Pd2,1,0.0,1.0,True,Ho1Pb1Pd2,Ho1Pb1Pd2,0.0,Other,True,Ho25Pb25Pd50,Ho-Pb-Pd,3,Supercon,Pd2Ho1Pb1,MP-mp-1206634,Ho1Pd2Pb1,Ho-Pb-Pd,Ho25Pb25Pd50,F m -3 m,cubic,4.866216940000001,4.86621694,4.86621694,data/final/MP/cifs/Ho1Pb1Pd2-MP-mp-1206634.cif,data/source/MP/raw/cifs/mp-1206634.cif,mp-1206634,0.0,,2019-01-12 09:54:20.045000,11.921297526077009,,,{'GGA': {'task_id': 'mp-1734586'}},0.0107305121874974,5.95524991,520.0,-21.47842708,-5.36960677,"{'tags': ['b.c.c. atom arrangement', 'Cu2MnAl', 'HoPd2Pb']}",-21.47842708,-5.36960677,-0.7059018799999999,['bandstructure'],True,[],True,2021-05-12 10:58:39.488000,NM,4,5,mp-1206634,,HoPd2Pb,"{'functional': 'PBE', 'labels': ['Ho_3', 'Pd', 'Pb_d'], 'pot_type': 'paw'}","{'Ho': 1.0, 'Pd': 2.0, 'Pb': 1.0}",GGA,mp-1206634,"['mp-1206634', 'mp-1504197', 'mp-1734586', 'mp-1801175', 'mp-1616782']",0.0008762,"{'Ho': 1.0, 'Pd': 2.0, 'Pb': 1.0}",81.48157254163881,[],NM,False,225,0,"[0, 0, 0, 0]",1.0753351618885894e-05,0.0008762,0,0.0008762,MP,data/source/MP/cleaned/cifs/MP-mp-1206634.cif,False,,data/final/MP/graphs/Ho1Pb1Pd2-MP-mp-1206634.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Pb1S1,1,0.0,1.0,True,Pb1S1,Pb1S1,0.0,Other,True,Pb50S50,Pb-S,2,Supercon,Pb1S1,MP-mp-21276,Pb1S1,Pb-S,Pb50S50,F m -3 m,cubic,4.2471987,4.2471987,4.2471987,data/final/MP/cifs/Pb1S1-MP-mp-21276.cif,data/source/MP/raw/cifs/mp-21276.cif,mp-21276,0.9925999999999996,,2014-02-15 06:55:24,7.333909254750865,10.17188/1196542,"@misc{osti_1196542,
    author = ""Persson, Kristin"",
    title = ""Materials Data on PbS (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196542"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686596'}},0.0,5.15085129,700.0,-8.91514539,-4.457572695,"{'tags': ['Lead sulfide (1/1) - HP', 'Lead sulfide', 'Lead sulfide - (Na Cl)-type', 'High pressure experimental phase', 'Lead sulfide (1/1)', 'Galena']}",-8.91514539,-4.457572695,-0.7845242265624996,"['piezo', 'eos', 'xas', 'bandstructure', 'diel', 'phonons', 'elasticity']",True,"[193679, 601032, 648449, 62193, 62191, 250762, 183239, 648443, 62190, 648452, 186786, 53932, 183004, 648437, 600243, 648434, 169770, 648444, 648450, 603902, 648447, 648439, 648453, 648440, 648441, 648435, 38293, 290053, 648442, 648436, 63095, 657560, 62192]",True,2021-05-12 10:56:16.728000,NM,2,37,mp-21276,,PbS,"{'functional': 'PBE', 'labels': ['Pb_d', 'S'], 'pot_type': 'paw'}","{'Pb': 1.0, 'S': 1.0}",GGA,mp-21276,"['mp-656589', 'mp-656587', 'mp-656592', 'mp-21276', 'mp-1056871', 'mp-1056888', 'mp-1056881', 'mp-1057539', 'mp-1057555', 'mp-1057548', 'mp-1057549', 'mp-1057552', 'mp-1057538', 'mp-1058257', 'mp-1058237', 'mp-1058249', 'mp-1058450', 'mp-1058458', 'mp-1058470', 'mp-1060672', 'mp-1060691', 'mp-1060703', 'mp-1142176', 'mp-1440798', 'mp-1541486', 'mp-1541918', 'mp-1686596', 'mp-1791972', 'mp-1924761', 'mp-1593581', 'mp-1594042', 'mp-1057557', 'mp-1057553', 'mp-1058258', 'mp-1058472', 'mp-1060706', 'mp-1056889']",0.0001476,"{'Pb': 1.0, 'S': 1.0}",54.17422904608132,[],NM,False,225,0,"[0, 0]",2.7245426949121787e-06,0.0001476,0,0.0001476,MP,data/source/MP/cleaned/cifs/MP-mp-21276.cif,False,,data/final/MP/graphs/Pb1S1-MP-mp-21276.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Rh2Y3,1,0.0,14.0,False,Rh28Y42,Rh28Y42,1.48,Other,True,Rh40Y60,Rh-Y,2,Supercon,Rh2Y3,MP-mp-1196999,Y42Rh28,Rh-Y,Rh40Y60,I 4/m c m,tetragonal,11.318421997901533,11.318421997901533,15.00419984,data/final/MP/cifs/Rh2Y3-MP-mp-1196999.cif,data/source/MP/raw/cifs/mp-1196999.cif,mp-1196999,0.0,,2019-01-12 02:03:44.026000,6.75651098126279,,,,0.0,4.47522459,520.0,-529.29824071,-7.561403438714285,"{'tags': ['Yttrium rhodium (3/2)', 'Y3Rh2', 'Rhodium yttrium (2/3)']}",-529.29824071,-7.561403438714285,-0.7357976227142851,[],False,"[105976, 337]",True,2021-05-12 11:00:01.375000,NM,70,3,mp-1196999,,Y3Rh2,"{'functional': 'PBE', 'labels': ['Y_sv', 'Rh_pv'], 'pot_type': 'paw'}","{'Y': 3.0, 'Rh': 2.0}",GGA,mp-1196999,"['mp-1196999', 'mp-1197245', 'mp-1330904']",0.0024849142857142,"{'Y': 42.0, 'Rh': 28.0}",1625.8583273953034,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.139719028024612e-05,0.0024849142857142,0,0.0347888,MP,data/source/MP/cleaned/cifs/MP-mp-1196999.cif,False,,data/final/MP/graphs/Rh2Y3-MP-mp-1196999.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Al1Y2,1,0.0,4.0,False,Al4Y8,Al4Y8,0.0,Other,True,Al33.333Y66.667,Al-Y,2,Supercon,Al1Y2,MP-mp-11230,Y8Al4,Al-Y,Al33.333Y66.667,P n m a,orthorhombic,5.114956,6.60678,9.491062,data/final/MP/cifs/Al1Y2-MP-mp-11230.cif,data/source/MP/raw/cifs/mp-11230.cif,mp-11230,0.0,,2011-06-02 03:05:50,4.24109640684424,10.17188/1187654,"@misc{osti_1187654,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Y2Al (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187654"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1670802'}},0.0,4.10135442,520.0,-70.49049451,-5.874207875833334,{'tags': ['Aluminum yttrium (1/2)']},-70.49049451,-5.874207875833334,-0.3147018569444443,"['xas', 'elasticity', 'bandstructure']",True,[58211],True,2021-05-12 10:56:10.715000,NM,12,9,mp-11230,,Y2Al,"{'functional': 'PBE', 'labels': ['Y_sv', 'Al'], 'pot_type': 'paw'}","{'Y': 2.0, 'Al': 1.0}",GGA,mp-11230,"['mp-928638', 'mp-11230', 'mp-912028', 'mp-928345', 'mp-1253327', 'mp-1431377', 'mp-1670802', 'mp-1813798', 'mp-1597526']",0.00092395,"{'Y': 8.0, 'Al': 4.0}",320.7351502050629,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.152290292360248e-05,0.00092395,0,0.0036958,MP,data/source/MP/cleaned/cifs/MP-mp-11230.cif,False,,data/final/MP/graphs/Al1Y2-MP-mp-11230.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
B2Li0.15Mg0.85,3,0.1,1.0,True,B2Li0.15Mg0.85,B2Mg1,36.6,Other,True,B66.667Li5Mg28.333,B-Li-Mg,3,Supercon,Mg0.85Li0.15B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B2Li0.15Mg0.85-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B2Li0.15Mg0.85-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
B0.67Mg0.33,2,0.0066666666666667,3.0,False,B2.01Mg0.99,B2Mg1,6.1,Other,True,B67Mg33,B-Mg,2,Supercon,B0.67Mg0.33,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B0.67Mg0.33-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B0.67Mg0.33-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ni1Si2,1,0.0,1.0,True,Ni1Si2,Ni1Si2,0.0,Other,True,Ni33.333Si66.667,Ni-Si,2,Supercon,Ni1Si2,MP-mp-2291,Si2Ni1,Ni-Si,Ni33.333Si66.667,F m -3 m,cubic,3.85058533,3.85058533,3.85058533,data/final/MP/cifs/Ni1Si2-MP-mp-2291.cif,data/source/MP/raw/cifs/mp-2291.cif,mp-2291,0.0,,2011-05-12 19:35:47,4.7246461428572095,10.17188/1199076,"@misc{osti_1199076,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Si2Ni (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199076"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671078'}},0.0,9.70399624,520.0,-17.68886154,-5.896287180000001,{'tags': ['Nickel silicide (1/2)']},-17.68886154,-5.896287180000001,-0.3526989399999998,"['xas', 'elasticity', 'bandstructure']",True,"[646575, 646567, 646568, 76634, 163352, 76715]",True,2021-05-12 10:56:16.728000,NM,3,10,mp-2291,,Si2Ni,"{'functional': 'PBE', 'labels': ['Si', 'Ni_pv'], 'pot_type': 'paw'}","{'Si': 2.0, 'Ni': 1.0}",GGA,mp-2291,"['mp-920154', 'mp-906378', 'mp-919127', 'mp-2291', 'mp-1138578', 'mp-1145668', 'mp-1300839', 'mp-1671078', 'mp-1791274', 'mp-1588553']",0.0002378,"{'Si': 2.0, 'Ni': 1.0}",40.37060507693847,[],NM,False,225,0,"[0, 0, 0]",5.8904244696555765e-06,0.0002378,0,0.0002378,MP,data/source/MP/cleaned/cifs/MP-mp-2291.cif,False,,data/final/MP/graphs/Ni1Si2-MP-mp-2291.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ca2K1Nb3O10,1,0.0,4.0,False,Ca8K4Nb12O40,Ca8K4Nb12O40,1.0,Oxide,True,Ca12.5K6.25Nb18.75O62.5,Ca-K-Nb-O,4,Supercon,K1Ca2Nb3O10,MP-mp-557195,K4Ca8Nb12O40,Ca-K-Nb-O,Ca12.5K6.25Nb18.75O62.5,P 1 21/m 1,monoclinic,7.808443,7.854881,15.19056011,data/final/MP/cifs/Ca2K1Nb3O10-MP-mp-557195.cif,data/source/MP/raw/cifs/mp-557195.cif,mp-557195,1.9568,,2013-10-01 04:25:30,4.007698469555267,10.17188/1269736,"@misc{osti_1269736,
    author = ""Persson, Kristin"",
    title = ""Materials Data on KCa2Nb3O10 (SG:11) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1269736"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-679403'}},0.0049455681250005,1.05564554,520.0,-514.04150165,-8.03189846328125,{'tags': ['Potassium dicalcium triniobate']},-514.04150165,-8.03189846328125,-3.1547032209687504,"['xas', 'bandstructure']",True,[157839],True,2021-05-12 10:57:19.246000,NM,64,6,mp-557195,oxide,KCa2Nb3O10,"{'functional': 'PBE', 'labels': ['K_sv', 'Ca_sv', 'Nb_pv', 'O'], 'pot_type': 'paw'}","{'K': 1.0, 'Ca': 2.0, 'Nb': 3.0, 'O': 10.0}",GGA,mp-557195,"['mp-679403', 'mp-664365', 'mp-557195', 'mp-1357186', 'mp-1896409', 'mp-1000322']",0.0007507,"{'K': 4.0, 'Ca': 8.0, 'Nb': 12.0, 'O': 40.0}",924.746947954503,[],NM,False,11,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.2471585947291344e-06,0.0007507,0,0.0030028,MP,data/source/MP/cleaned/cifs/MP-mp-557195.cif,False,,data/final/MP/graphs/Ca2K1Nb3O10-MP-mp-557195.json,0,True,2/m,0,0,3,0,0,0,0,1,0,0,0,1.0,False
As1Fe0.95Gd1Ir0.05O1,2,0.025,2.0,False,As2Fe1.9Gd2Ir0.1O2,As2Fe2Gd2O2,0.0,Ferrite,True,As25Fe23.75Gd25Ir1.25O25,As-Fe-Gd-Ir-O,5,Supercon,Gd1Fe0.95Ir0.05As1O1,MP-mp-1078679,Gd2Fe2As2O2,As-Fe-Gd-O,As25Fe25Gd25O25,P 4/n m m,tetragonal,3.996524,3.996524,9.110606,data/final/MP/cifs/As1Fe0.95Gd1Ir0.05O1-MP-mp-1078679-synth_doped.cif,data/source/MP/raw/cifs/mp-1078679.cif,mp-1078679,0.0,,2018-04-12 14:54:44,6.938465251324023,,,{'GGA+U': {'task_id': 'mp-1704492'}},0.2756975050000001,4.06882668,520.0,-71.78498399,-8.97312299875,{'tags': ['Gadolinium iron arsenic oxide (1/1/1/1)']},-71.78498399,-8.97312299875,-1.670570473750001,['bandstructure'],True,"[425013, 422003, 425006, 425015, 425010, 236655, 425016]",True,2021-05-12 10:58:16.596000,FM,8,10,mp-1078679,oxide,GdFeAsO,"{'functional': 'PBE', 'labels': ['Gd', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Gd': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-1078679,"['mp-1078679', 'mp-1079389', 'mp-1079927', 'mp-1080502', 'mp-1080613', 'mp-1095209', 'mp-1438268', 'mp-1704492', 'mp-1864230', 'mp-1589235']",10.7990939,"{'Gd': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",145.5164583479414,[],FM,True,129,2,"[6.9, 6.9, 3.6, 3.6, 0.0, 0.0, 0.0, 0.0]",0.1484243641248952,10.7990939,4,21.5981878,MP,data/source/MP/cleaned/cifs/MP-mp-1078679.cif,True,,data/final/MP/graphs/As1Fe0.95Gd1Ir0.05O1-MP-mp-1078679-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ba1.9Cu4Gd1Sr0.1O8,2,0.0133333333333333,1.0,True,Ba1.9Cu4Gd1Sr0.1O8,Ba2Cu4Gd1O8,73.5,Cuprate,True,Ba12.667Cu26.667Gd6.667Sr0.667O53.333333333333336,Ba-Cu-Gd-Sr-O,5,Supercon,Gd1Sr0.1Ba1.9Cu4O8,MP-mp-1214720,Ba2Gd1Cu4O8,Ba-Cu-Gd-O,Ba13.333Cu26.667Gd6.667O53.333333333333336,C m m m,orthorhombic,3.899565,3.914795998374347,13.83769943,data/final/MP/cifs/Ba1.9Cu4Gd1Sr0.1O8-MP-mp-1214720-synth_doped.cif,data/source/MP/raw/cifs/mp-1214720.cif,mp-1214720,0.0,,2019-01-12 16:30:57.742000,6.464243473418578,,,{'GGA': {'task_id': 'mp-1738624'}},0.0,3.23160584,520.0,-99.06735497,-6.604490331333333,"{'tags': ['Ba2Cu4YO8', 'high-Tc cuprate family', 'Ba2Cu4GdO8']}",-99.06735497,-6.604490331333333,-2.044585089999999,[],False,[],True,2021-05-12 11:00:37.845000,FM,15,4,mp-1214720,oxide,Ba2Gd(CuO2)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Gd', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Gd': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-1214720,"['mp-1214720', 'mp-1376184', 'mp-1738624', 'mp-1882861']",6.9490048,"{'Ba': 2.0, 'Gd': 1.0, 'Cu': 4.0, 'O': 8.0}",209.1222217451288,[],FM,True,65,1,"[0.0, 0.0, 6.9, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0332293944756823,6.9490048,1,6.9490048,MP,data/source/MP/cleaned/cifs/MP-mp-1214720.cif,True,,data/final/MP/graphs/Ba1.9Cu4Gd1Sr0.1O8-MP-mp-1214720-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Al0.08Nb3Sn0.92,2,0.0399999999999999,2.0,False,Al0.16Nb6Sn1.84,Nb6Sn2,17.9,Other,True,Al2Nb75Sn23,Al-Nb-Sn,3,Supercon,Nb3Sn0.92Al0.08,MP-mp-1326,Nb6Sn2,Nb-Sn,Nb75Sn25,P m -3 n,cubic,5.334611,5.334611,5.334611,data/final/MP/cifs/Al0.08Nb3Sn0.92-MP-mp-1326-synth_doped.cif,data/source/MP/raw/cifs/mp-1326.cif,mp-1326,0.0,,2011-05-14 09:51:48,8.694218121896231,10.17188/1189484,"@misc{osti_1189484,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Sn (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189484"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668415'}},0.0,6.59372491,520.0,-69.93787048,-8.74223381,{'tags': ['Niobium tin (3/1)']},-69.93787048,-8.74223381,-0.163862066250001,"['xas', 'elasticity', 'bandstructure']",True,"[105230, 645503, 645489, 105231, 645498, 645485, 645474, 645496, 645480, 645488, 645482, 645487, 645500, 645493, 645477, 645484, 645502, 645483, 150878, 645479, 645481, 645486, 645473]",True,2021-05-12 10:56:12.755000,NM,8,9,mp-1326,,Nb3Sn,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Sn_d'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Sn': 1.0}",GGA,mp-1326,"['mp-930046', 'mp-913770', 'mp-930577', 'mp-1326', 'mp-1440651', 'mp-1668415', 'mp-1880085', 'mp-1594093', 'mp-1594507']",0.62023085,"{'Nb': 6.0, 'Sn': 2.0}",151.81275738025872,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0081709977567491,0.62023085,0,1.2404617,MP,data/source/MP/cleaned/cifs/MP-mp-1326.cif,True,,data/final/MP/graphs/Al0.08Nb3Sn0.92-MP-mp-1326-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
B0.72Mo0.28,3,0.06,8.0,False,B5.76Mo2.24,B6Mo2,0.0,Other,True,B72Mo28,B-Mo,2,Supercon,B0.72Mo0.28,MP-mp-1080111,B6Mo2,B-Mo,B75Mo25,R -3 m,trigonal,4.34615684,4.34615684,4.34615696,data/final/MP/cifs/B0.72Mo0.28-MP-mp-1080111-synth_doped.cif,data/source/MP/raw/cifs/mp-1080111.cif,mp-1080111,0.0,,2018-04-17 13:11:13,5.760905143492877,,,{'GGA': {'task_id': 'mp-1733804'}},0.0083846927083328,7.50378797,520.0,-64.29089903,-8.03636237875,{'tags': ['Molybdenum boride (1/3) - hypothetical']},-64.29089903,-8.03636237875,-0.3154077931250008,['bandstructure'],True,[167734],True,2021-05-12 10:58:16.596000,NM,8,5,mp-1080111,,B3Mo,"{'functional': 'PBE', 'labels': ['B', 'Mo_pv'], 'pot_type': 'paw'}","{'B': 3.0, 'Mo': 1.0}",GGA,mp-1080111,"['mp-1080111', 'mp-1402888', 'mp-1733804', 'mp-1799761', 'mp-1628007']",4.455e-05,"{'B': 6.0, 'Mo': 2.0}",74.00516977351107,[],NM,False,166,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.2039699425416611e-06,4.455e-05,0,8.91e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1080111.cif,True,,data/final/MP/graphs/B0.72Mo0.28-MP-mp-1080111-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Cu1Tm2O4,1,0.0,2.0,False,Cu2Tm4O8,Cu2Tm4O8,0.0,Cuprate,True,Cu14.286Tm28.571O57.142857142857146,Cu-Tm-O,3,Supercon,Tm2Cu1O4,MP-mp-1100986,Tm4Cu2O8,Cu-Tm-O,Cu14.286Tm28.571O57.142857142857146,P 1 21/c 1,monoclinic,5.409843553237426,5.48364013,6.13602021,data/final/MP/cifs/Cu1Tm2O4-MP-mp-1100986.cif,data/source/MP/raw/cifs/mp-1100986.cif,mp-1100986,0.2054,,2018-07-15 12:43:08,8.988727038800237,,,,0.0336481182143,3.17438928,520.0,-104.41694245,-7.458353032142857,{'tags': []},-104.41694245,-7.458353032142857,-3.1591070983333327,[],False,[],True,2021-05-12 10:59:28.847000,AFM,14,2,mp-1100986,oxide,Tm2CuO4,"{'functional': 'PBE', 'labels': ['Tm_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Tm': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1100986,"['mp-1100986', 'mp-1833440']",0.0,"{'Tm': 4.0, 'Cu': 2.0, 'O': 8.0}",171.9564601170432,[],AFM,True,2,2,"[0.0, -0.0, -0.0, 0.0, 0.3, -0.3, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0,0.0,2,0.0,MP,data/source/MP/cleaned/cifs/MP-mp-1100986.cif,False,,data/final/MP/graphs/Cu1Tm2O4-MP-mp-1100986.json,0,True,2/m,0,0,3,0,0,0,0,1,0,0,0,1.0,False
Os2U1,1,0.0,4.0,False,Os8U4,Os8U4,0.0,Heavy_fermion,True,Os66.667U33.333,Os-U,2,Supercon,Os2U1,MP-mp-1102439,U4Os8,Os-U,Os66.667U33.333,P 63/m m c,hexagonal,5.383582692647433,5.38358219,8.531663,data/final/MP/cifs/Os2U1-MP-mp-1102439.cif,data/source/MP/raw/cifs/mp-1102439.cif,mp-1102439,0.0,,2018-07-18 14:19:02,19.18376806017207,,,,0.0,10.20895332,520.0,-136.07876918,-11.339897431666666,{'tags': ['Osmium uranium (2/1)']},-136.07876918,-11.339897431666666,-0.0911832583333331,[],False,[659012],True,2021-05-12 10:59:31.014000,NM,12,3,mp-1102439,,UOs2,"{'functional': 'PBE', 'labels': ['U', 'Os_pv'], 'pot_type': 'paw'}","{'U': 1.0, 'Os': 2.0}",GGA,mp-1102439,"['mp-1102439', 'mp-1835585', 'mp-1987768']",0.11462665,"{'U': 4.0, 'Os': 8.0}",214.14458183449065,[],NM,False,194,0,"[0.0, 0.0, 0.0, 0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0021411076389239,0.11462665,0,0.4585066,MP,data/source/MP/cleaned/cifs/MP-mp-1102439.cif,False,,data/final/MP/graphs/Os2U1-MP-mp-1102439.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
B12Lu1,1,0.0,1.0,True,B12Lu1,B12Lu1,0.435,Other,True,B92.308Lu7.692,B-Lu,2,Supercon,B12Lu1,MP-mp-1104289,Lu1B12,B-Lu,B92.308Lu7.692,F m -3 m,cubic,5.273595299999999,5.273595299999999,5.273595299999999,data/final/MP/cifs/B12Lu1-MP-mp-1104289.cif,data/source/MP/raw/cifs/mp-1104289.cif,mp-1104289,0.0,,2018-07-18 21:35:34,4.878819237289688,,,{'GGA': {'task_id': 'mp-1699658'}},0.0,6.12256451,520.0,-87.87639773,-6.759722902307692,"{'tags': ['Lutetium boride (1/12)', 'LuB12', 'UB12']}",-87.87639773,-6.759722902307692,-0.2463650738461528,['bandstructure'],True,"[180141, 614672, 600741]",True,2021-05-12 10:58:20.361000,NM,13,7,mp-1104289,,LuB12,"{'functional': 'PBE', 'labels': ['Lu_3', 'B'], 'pot_type': 'paw'}","{'Lu': 1.0, 'B': 12.0}",GGA,mp-1104289,"['mp-1104289', 'mp-1104623', 'mp-1104793', 'mp-1425994', 'mp-1699658', 'mp-1874128', 'mp-1592076']",1.72e-05,"{'Lu': 1.0, 'B': 12.0}",103.70636181532932,[],NM,False,225,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.6585289175053858e-07,1.72e-05,0,1.72e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1104289.cif,False,,data/final/MP/graphs/B12Lu1-MP-mp-1104289.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Nb3Pt0.7Rh0.3,3,0.15,2.0,False,Nb6Pt1.4Rh0.6,Nb6Pt2,7.4,Other,True,Nb75Pt17.5Rh7.5,Nb-Pt-Rh,3,Supercon,Nb3Rh0.3Pt0.7,MP-mp-2663,Nb6Pt2,Nb-Pt,Nb75Pt25,P m -3 n,cubic,5.206284,5.206284,5.206284,data/final/MP/cifs/Nb3Pt0.7Rh0.3-MP-mp-2663-synth_doped.cif,data/source/MP/raw/cifs/mp-2663.cif,mp-2663,0.0,,2011-05-14 02:42:41,11.150477426700435,10.17188/1201206,"@misc{osti_1201206,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Pt (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201206"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1667983'}},0.0,5.9039275,520.0,-75.80228808,-9.47528601,{'tags': ['Niobium platinum (3/1)']},-75.80228808,-9.47528601,-0.3815803024999997,"['xas', 'elasticity', 'bandstructure']",True,"[645231, 645226, 645216, 645227, 105203, 645228, 645218, 645236, 645224]",True,2021-05-12 10:56:18.721000,NM,8,8,mp-2663,,Nb3Pt,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Pt'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Pt': 1.0}",GGA,mp-2663,"['mp-929425', 'mp-912670', 'mp-929036', 'mp-2663', 'mp-1438686', 'mp-1667983', 'mp-1778280', 'mp-1593946']",0.0004491,"{'Nb': 6.0, 'Pt': 2.0}",141.11837435118034,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",6.364869239244375e-06,0.0004491,0,0.0008982,MP,data/source/MP/cleaned/cifs/MP-mp-2663.cif,True,,data/final/MP/graphs/Nb3Pt0.7Rh0.3-MP-mp-2663-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Cu0.5La2Li0.5O4,1,0.0,2.0,False,Cu1La4Li1O8,Cu1La4Li1O8,0.0,Cuprate,True,Cu7.143La28.571Li7.143O57.142857142857146,Cu-La-Li-O,4,Supercon,La2Cu0.5Li0.5O4,MP-mp-21496,Li1La4Cu1O8,Cu-La-Li-O,Cu7.143La28.571Li7.143O57.142857142857146,C m m m,orthorhombic,5.305003,5.312343996410554,7.11242369,data/final/MP/cifs/Cu0.5La2Li0.5O4-MP-mp-21496.cif,data/source/MP/raw/cifs/mp-21496.cif,mp-21496,0.8123999999999993,,2013-10-01 22:21:11,6.734535403686981,10.17188/1196949,"@misc{osti_1196949,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LiLa4CuO8 (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196949"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698136'}},0.0143939401785697,6.81909937,520.0,-104.18208744,-7.441577674285715,{'tags': ['Lanthanum copper lithium oxide (2/.5/.5/4)']},-104.18208744,-7.441577674285715,-3.1673029602380955,"['xas', 'bandstructure']",True,[202958],True,2021-05-12 10:56:59.077000,NM,14,7,mp-21496,oxide,LiLa4CuO8,"{'functional': 'PBE', 'labels': ['Li_sv', 'La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Li': 1.0, 'La': 4.0, 'Cu': 1.0, 'O': 8.0}",GGA,mp-21496,"['mp-661492', 'mp-671043', 'mp-21496', 'mp-1415128', 'mp-1698136', 'mp-1787372', 'mp-692704']",6.15e-05,"{'Li': 1.0, 'La': 4.0, 'Cu': 1.0, 'O': 8.0}",185.9399661685489,[],NM,False,65,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.307519156169586e-07,6.15e-05,0,6.15e-05,MP,data/source/MP/cleaned/cifs/MP-mp-21496.cif,False,,data/final/MP/graphs/Cu0.5La2Li0.5O4-MP-mp-21496.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
As1Os1Zr1,1,0.0,3.0,False,As3Os3Zr3,As3Os3Zr3,8.0,Other,True,As33.333Os33.333Zr33.333,As-Os-Zr,3,Supercon,Zr1Os1As1,MP-mp-1079816,Zr3As3Os3,As-Os-Zr,As33.333Os33.333Zr33.333,P -6 2 m,hexagonal,4.008261,6.607285999538,6.60728641,data/final/MP/cifs/As1Os1Zr1-MP-mp-1079816.cif,data/source/MP/raw/cifs/mp-1079816.cif,mp-1079816,0.0,,2018-04-16 10:21:53,11.71508492279846,,,{'GGA': {'task_id': 'mp-1700983'}},0.1376573452777769,7.42392432,520.0,-78.91731212,-8.768590235555557,"{'tags': ['ZrOsAs', 'ZrNiAl', 'Osmium zirconium arsenide (1/1/1)']}",-78.91731212,-8.768590235555557,-0.623861805555557,['bandstructure'],True,"[611146, 604606]",True,2021-05-12 10:58:16.596000,NM,9,6,mp-1079816,,ZrAsOs,"{'functional': 'PBE', 'labels': ['Zr_sv', 'As', 'Os_pv'], 'pot_type': 'paw'}","{'Zr': 1.0, 'As': 1.0, 'Os': 1.0}",GGA,mp-1079816,"['mp-1079816', 'mp-1080139', 'mp-1430100', 'mp-1700983', 'mp-1935484', 'mp-1587203']",0.0008858,"{'Zr': 3.0, 'As': 3.0, 'Os': 3.0}",151.54195042104402,[],NM,False,189,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",1.753573840521837e-05,0.0008858,0,0.0026574,MP,data/source/MP/cleaned/cifs/MP-mp-1079816.cif,False,,data/final/MP/graphs/As1Os1Zr1-MP-mp-1079816.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Al0.98Ge0.02Nb3,2,0.01,2.0,False,Al1.96Ge0.04Nb6,Al2Nb6,19.3,Other,True,Al24.5Ge0.5Nb75,Al-Ge-Nb,3,Supercon,Nb3Al0.98Ge0.02,MP-mp-796,Nb6Al2,Al-Nb,Al25Nb75,P m -3 n,cubic,5.215254,5.215254,5.215254,data/final/MP/cifs/Al0.98Ge0.02Nb3-MP-mp-796-synth_doped.cif,data/source/MP/raw/cifs/mp-796.cif,mp-796,0.0,,2011-05-13 16:07:37,7.157298025966356,,,{'GGA': {'task_id': 'mp-1686893'}},0.0460773865000003,5.52947534,520.0,-69.48918494,-8.6861481175,"{'tags': ['Aluminium niobium (1/3)', 'Niobium aluminide (3/1)', 'Aluminum niobium (1/3)']}",-69.48918494,-8.6861481175,-0.1737753800000003,"['bandstructure', 'elasticity']",True,"[608675, 608654, 608688, 608668, 608669, 608685, 608676, 608683, 58014, 608657, 107856, 608655, 608666, 608691, 608656, 608665, 608673, 608653, 608661]",True,2021-05-12 10:56:31.128000,NM,8,10,mp-796,,Nb3Al,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Al': 1.0}",GGA,mp-796,"['mp-911586', 'mp-927906', 'mp-796', 'mp-927472', 'mp-1260512', 'mp-1440919', 'mp-1686893', 'mp-1927652', 'mp-1591599', 'mp-1587739']",0.16323955,"{'Nb': 6.0, 'Al': 2.0}",141.8490379078192,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0023015954483396,0.16323955,0,0.3264791,MP,data/source/MP/cleaned/cifs/MP-mp-796.cif,True,,data/final/MP/graphs/Al0.98Ge0.02Nb3-MP-mp-796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
B4Ir4Lu0.5Y0.5,1,0.0,2.0,False,B8Ir8Lu1Y1,B8Ir8Lu1Y1,3.21,Other,True,B44.444Ir44.444Lu5.556Y5.556,B-Ir-Lu-Y,4,Supercon,Y0.5Lu0.5Ir4B4,MP-mp-1215947,Y1Lu1B8Ir8,B-Ir-Lu-Y,B44.444Ir44.444Lu5.556Y5.556,P -4 m 2,tetragonal,5.397527,5.397527,7.454301,data/final/MP/cifs/B4Ir4Lu0.5Y0.5-MP-mp-1215947.cif,data/source/MP/raw/cifs/mp-1215947.cif,mp-1215947,0.0,,2019-01-12 17:32:34.719000,14.436994561781765,,,,0.0267232327777815,8.34985726,520.0,-144.25774255,-8.014319030555555,{'tags': []},-144.25774255,-8.014319030555555,-0.5070968549999988,[],False,[],True,2021-05-12 11:00:37.845000,NM,18,3,mp-1215947,,YLu(BIr)8,"{'functional': 'PBE', 'labels': ['Y_sv', 'Lu_3', 'B', 'Ir'], 'pot_type': 'paw'}","{'Y': 1.0, 'Lu': 1.0, 'B': 8.0, 'Ir': 8.0}",GGA,mp-1215947,"['mp-1215947', 'mp-1367845', 'mp-1830201']",5.13e-05,"{'Y': 1.0, 'Lu': 1.0, 'B': 8.0, 'Ir': 8.0}",217.1683702956564,[],NM,False,115,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.3622224511865785e-07,5.13e-05,0,5.13e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1215947.cif,False,,data/final/MP/graphs/B4Ir4Lu0.5Y0.5-MP-mp-1215947.json,0,True,-42m,0,0,0,0,6,0,0,1,0,0,0,1.0,False
Ba2Cu4Lu0.24Y0.76O8,3,0.032,1.0,True,Ba2Cu4Lu0.24Y0.76O8,Ba2Cu4Y1O8,0.0,Cuprate,True,Ba13.333Cu26.667Lu1.6Y5.067O53.333333333333336,Ba-Cu-Lu-Y-O,5,Supercon,Y0.76Lu0.24Ba2Cu4O8,MP-mp-6790,Ba2Y1Cu4O8,Ba-Cu-Y-O,Ba13.333Cu26.667Y6.667O53.333333333333336,C m m m,orthorhombic,3.889922,3.899603999537882,13.88942687,data/final/MP/cifs/Ba2Cu4Lu0.24Y0.76O8-MP-mp-6790-synth_doped.cif,data/source/MP/raw/cifs/mp-6790.cif,mp-6790,0.0,,2011-05-16 03:21:24,5.936250568336678,10.17188/1283441,"@misc{osti_1283441,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Y(CuO2)4 (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1283441"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686864'}},0.0,3.31391536,520.0,-91.58381472,-6.105587648,"{'tags': ['Yttrium barium copper oxide (1/2/4/8)', 'High pressure experimental phase']}",-91.58381472,-6.105587648,-2.0529924817777783,"['xas', 'bandstructure']",True,"[72261, 85273, 74251, 400273, 85277, 85275, 400280, 67632, 85272, 67631, 83920, 66613, 85279, 400277, 75689, 74259, 85278, 85280, 66603, 94265, 400276, 88873, 71417, 75712, 97052, 66605, 72258, 85281, 85274, 400279, 66604, 69698]",True,2021-05-12 10:57:34.594000,NM,15,10,mp-6790,oxide,Ba2Y(CuO2)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-6790,"['mp-1000664', 'mp-6790', 'mp-1007136', 'mp-1237713', 'mp-1440937', 'mp-1686864', 'mp-1834179', 'mp-1011883', 'mp-1590064', 'mp-1590433']",0.0004643,"{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",208.60454115924333,[],NM,False,65,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.225742533790601e-06,0.0004643,0,0.0004643,MP,data/source/MP/cleaned/cifs/MP-mp-6790.cif,True,,data/final/MP/graphs/Ba2Cu4Lu0.24Y0.76O8-MP-mp-6790-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ga0.21Si0.79V3,3,0.1049999999999999,2.0,False,Ga0.42Si1.58V6,Si2V6,10.7,Other,True,Ga5.25Si19.75V75,Ga-Si-V,3,Supercon,V3Si0.79Ga0.21,MP-mp-2567,V6Si2,Si-V,Si25V75,P m -3 n,cubic,4.702381,4.702381,4.702381,data/final/MP/cifs/Ga0.21Si0.79V3-MP-mp-2567-synth_doped.cif,data/source/MP/raw/cifs/mp-2567.cif,mp-2567,0.0,,2011-05-13 19:15:43,5.778142190030859,10.17188/1200874,"@misc{osti_1200874,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Si (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1200874"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668672'}},0.0,7.30599425,520.0,-69.05773321,-8.63221665125,{'tags': ['Vanadium silicide (3/1)']},-69.05773321,-8.63221665125,-0.4452085937499994,"['xas', 'elasticity', 'bandstructure']",True,"[652491, 87328, 652522, 652502, 652510, 652520, 600518, 186003, 652507, 652513, 652497, 601150, 652514, 652487, 22412, 652509, 652529, 652532, 652499, 652539, 652537, 652533, 652512, 652538, 652490, 652493, 652494, 652511, 652519, 87329, 652526, 652500]",True,2021-05-12 10:56:18.721000,FM,8,13,mp-2567,,V3Si,"{'functional': 'PBE', 'labels': ['V_pv', 'Si'], 'pot_type': 'paw'}","{'V': 3.0, 'Si': 1.0}",GGA,mp-2567,"['mp-920081', 'mp-906309', 'mp-919083', 'mp-2567', 'mp-1078474', 'mp-1078852', 'mp-1138781', 'mp-1145907', 'mp-1440678', 'mp-1668672', 'mp-1795955', 'mp-1593554', 'mp-1596575']",0.8382519,"{'V': 6.0, 'Si': 2.0}",103.98086881866836,[],FM,True,131,1,"[0.2, 0.3, 0.3, 0.2, 0.3, 0.3, 0.0, 0.0]",0.0161231947669493,0.8382519,6,1.6765038,MP,data/source/MP/cleaned/cifs/MP-mp-2567.cif,True,,data/final/MP/graphs/Ga0.21Si0.79V3-MP-mp-2567-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Ca0.2Cu4Ho0.8O8,3,0.0266666666666666,1.0,True,Ba2Ca0.2Cu4Ho0.8O8,Ba2Cu4Ho1O8,87.0,Cuprate,True,Ba13.333Ca1.333Cu26.667Ho5.333O53.333333333333336,Ba-Ca-Cu-Ho-O,5,Supercon,Ho0.8Ca0.2Ba2Cu4O8,MP-mp-6205,Ba2Ho1Cu4O8,Ba-Cu-Ho-O,Ba13.333Cu26.667Ho6.667O53.333333333333336,C m m m,orthorhombic,3.87946,3.894348001774656,13.87398175,data/final/MP/cifs/Ba2Ca0.2Cu4Ho0.8O8-MP-mp-6205-synth_doped.cif,data/source/MP/raw/cifs/mp-6205.cif,mp-6205,0.0,,2011-05-16 02:52:11,6.575196061130729,10.17188/1278028,"@misc{osti_1278028,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Ho(CuO2)4 (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278028"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678300'}},0.0,3.29099269,520.0,-89.84060384,-5.989373589333334,"{'tags': ['Holmium dibarium tricopper copper(III) oxide', 'Holmium dibarium tetracopper octaoxide', 'Holmium barium copper oxide (1/2/4/8)']}",-89.84060384,-5.989373589333334,-2.0623825726666665,"['xas', 'bandstructure']",True,"[67638, 75688, 74126, 78624, 67639]",True,2021-05-12 10:57:28.836000,NM,15,7,mp-6205,oxide,Ba2Ho(CuO2)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ho_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Ho': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-6205,"['mp-1001291', 'mp-1007620', 'mp-6205', 'mp-1381302', 'mp-1678300', 'mp-1832236', 'mp-1599331']",0.0019325,"{'Ba': 2.0, 'Ho': 1.0, 'Cu': 4.0, 'O': 8.0}",207.53304019835824,[],NM,False,65,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",9.31177030005889e-06,0.0019325,0,0.0019325,MP,data/source/MP/cleaned/cifs/MP-mp-6205.cif,True,,data/final/MP/graphs/Ba2Ca0.2Cu4Ho0.8O8-MP-mp-6205-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Cu2Gd1Ru0.925Sr2Ti0.075O8,2,0.0107142857142857,2.0,False,Cu4Gd2Ru1.85Sr4Ti0.15O16,Cu4Gd2Ru2Sr4O16,29.2,Cuprate,True,Cu14.286Gd7.143Ru6.607Sr14.286Ti0.536O57.142857142857146,Cu-Gd-Ru-Sr-Ti-O,6,Supercon,Ru0.925Ti0.075Sr2Gd1Cu2O8,MP-mp-1194240,Sr4Gd2Cu4Ru2O16,Cu-Gd-Ru-Sr-O,Cu14.286Gd7.143Ru7.143Sr14.286O57.142857142857146,P 4/m b m,tetragonal,5.472451,5.472451,11.740702,data/final/MP/cifs/Cu2Gd1Ru0.925Sr2Ti0.075O8-MP-mp-1194240-synth_doped.cif,data/source/MP/raw/cifs/mp-1194240.cif,mp-1194240,0.0,,2019-01-11 23:51:58.932000,6.504561898971391,,,{'GGA': {'task_id': 'mp-1765260'}},0.0213449239285443,3.93502801,520.0,-201.55352223,-7.198340079642857,"{'tags': ['Sr2Cu2GdRuO8 orth', 'Sr2Cu2GdRuO8', 'Ruthenium distrontium gadolinium dicopper octaoxide']}",-201.55352223,-7.198340079642857,-2.268654352380952,['bandstructure'],True,[245741],True,2021-05-12 10:58:35.561000,FiM,28,6,mp-1194240,oxide,Sr2GdCu2RuO8,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Gd', 'Cu_pv', 'Ru_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Gd': 1.0, 'Cu': 2.0, 'Ru': 1.0, 'O': 8.0}",GGA,mp-1194240,"['mp-1194240', 'mp-1396976', 'mp-1659973', 'mp-1765260', 'mp-1841948', 'mp-1638264']",4.23696715,"{'Sr': 4.0, 'Gd': 2.0, 'Cu': 4.0, 'Ru': 2.0, 'O': 16.0}",351.6072554818909,[],FiM,True,127,2,"[-0.0, -0.0, -0.0, -0.0, 6.9, 6.9, 0.0, 0.0, 0.0, 0.0, -1.8, -1.8, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0241005672319991,4.23696715,4,8.4739343,MP,data/source/MP/cleaned/cifs/MP-mp-1194240.cif,True,,data/final/MP/graphs/Cu2Gd1Ru0.925Sr2Ti0.075O8-MP-mp-1194240-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Bi2Ca0.9Cu2I1Sr2Y0.1O8,2,0.0124999999999999,2.0,False,Bi4Ca1.8Cu4I2Sr4Y0.2O16,Bi4Ca2Cu4I2Sr4O16,67.0,Cuprate,True,Bi12.5Ca5.625Cu12.5I6.25Sr12.5Y0.625O50,Bi-Ca-Cu-I-Sr-Y-O,7,Supercon,Bi2Sr2Ca0.9Y0.1Cu2I1O8,MP-mp-1209124,Sr4Ca2Cu4Bi4I2O16,Bi-Ca-Cu-I-Sr-O,Bi12.5Ca6.25Cu12.5I6.25Sr12.5O50,P m n a,orthorhombic,5.21493,5.481615,19.120353,data/final/MP/cifs/Bi2Ca0.9Cu2I1Sr2Y0.1O8-MP-mp-1209124-synth_doped.cif,data/source/MP/raw/cifs/mp-1209124.cif,mp-1209124,0.0,,2019-01-12 11:54:40.777000,6.168902819730907,,,,0.092595106494147,3.5592228,520.0,-175.92812723,-5.4977539759375,{'tags': ['Sr2CaCu2Bi2IO8']},-175.92812723,-5.4977539759375,-1.9605183883333333,[],False,[],True,2021-05-12 11:00:21.818000,NM,32,3,mp-1209124,oxide,Sr2CaCu2Bi2IO8,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Cu_pv', 'Bi', 'I', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'I': 1.0, 'O': 8.0}",GGA,mp-1209124,"['mp-1209124', 'mp-1361882', 'mp-1929533']",0.31195235,"{'Sr': 4.0, 'Ca': 2.0, 'Cu': 4.0, 'Bi': 4.0, 'I': 2.0, 'O': 16.0}",546.5789712906787,[],NM,False,53,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0011414721984761,0.31195235,0,0.6239047,MP,data/source/MP/cleaned/cifs/MP-mp-1209124.cif,True,,data/final/MP/graphs/Bi2Ca0.9Cu2I1Sr2Y0.1O8-MP-mp-1209124-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
B2C1Fe0.2Ni1.8Tm1,3,0.0666666666666666,1.0,True,B2C1Fe0.2Ni1.8Tm1,B2C1Ni2Tm1,0.0,Other,True,B33.333C16.667Fe3.333Ni30Tm16.667,B-C-Fe-Ni-Tm,5,Supercon,Tm1Ni1.8Fe0.2B2C1,MP-mp-6754,Tm1Ni2B2C1,B-C-Ni-Tm,B33.333C16.667Ni33.333Tm16.667,I 4/m m m,tetragonal,3.4928639994202824,3.492863999420283,5.7937603300000005,data/final/MP/cifs/B2C1Fe0.2Ni1.8Tm1-MP-mp-6754-synth_doped.cif,data/source/MP/raw/cifs/mp-6754.cif,mp-6754,0.0,,2011-05-13 04:35:22,8.309262229712736,10.17188/1282688,"@misc{osti_1282688,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TmNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1282688"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696752'}},0.0,6.71149537,520.0,-41.76249282,-6.96041547,{'tags': []},-41.76249282,-6.96041547,-0.5234699658333332,"['xas', 'elasticity', 'bandstructure']",True,"[79577, 56652, 164574]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-6754,,TmNi2B2C,"{'functional': 'PBE', 'labels': ['Tm_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Tm': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6754,"['mp-6754', 'mp-1000684', 'mp-1007145', 'mp-1412917', 'mp-1696752', 'mp-1790753', 'mp-1011888', 'mp-1590290']",0.0028138,"{'Tm': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",63.94016944835002,[],NM,False,139,0,"[0.0, -0.0, -0.0, 0.0, 0.0, 0.0]",4.40067648283752e-05,0.0028138,0,0.0028138,MP,data/source/MP/cleaned/cifs/MP-mp-6754.cif,True,,data/final/MP/graphs/B2C1Fe0.2Ni1.8Tm1-MP-mp-6754-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B2Os1Sc1,1,0.0,4.0,False,B8Os4Sc4,B8Os4Sc4,1.34,Other,True,B50Os25Sc25,B-Os-Sc,3,Supercon,Sc1Os1B2,MP-mp-1189073,Sc4B8Os4,B-Os-Sc,B50Os25Sc25,P n m a,orthorhombic,5.199445,5.669938,6.182056,data/final/MP/cifs/B2Os1Sc1-MP-mp-1189073.cif,data/source/MP/raw/cifs/mp-1189073.cif,mp-1189073,0.0,,2019-01-11 19:55:13.213000,9.359426869410369,,,{'GGA': {'task_id': 'mp-1670193'}},0.0,7.06866092,520.0,-134.56144988,-8.4100906175,"{'tags': ['ScOsB2', 'Scandium osmium boride (1/1/2)', 'LuRuB2']}",-134.56144988,-8.4100906175,-0.6804358920833327,['bandstructure'],True,[615126],True,2021-05-12 10:58:33.577000,NM,16,5,mp-1189073,,ScB2Os,"{'functional': 'PBE', 'labels': ['Sc_sv', 'B', 'Os_pv'], 'pot_type': 'paw'}","{'Sc': 1.0, 'B': 2.0, 'Os': 1.0}",GGA,mp-1189073,"['mp-1189073', 'mp-1427551', 'mp-1670193', 'mp-1835872', 'mp-1604896']",0.0003301,"{'Sc': 4.0, 'B': 8.0, 'Os': 4.0}",182.25029221894656,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",7.244981524714025e-06,0.0003301,0,0.0013204,MP,data/source/MP/cleaned/cifs/MP-mp-1189073.cif,False,,data/final/MP/graphs/B2Os1Sc1-MP-mp-1189073.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
N0.87Nb1O0.13,3,0.13,1.0,True,N0.87Nb1O0.13,N1Nb1,17.2,Oxide,True,N43.5Nb50O6.5,N-Nb-O,3,Supercon,Nb1N0.87O0.13,MP-mp-2634,Nb1N1,N-Nb,N50Nb50,P -6 m 2,hexagonal,2.898656,2.9761920047347994,2.97619211,data/final/MP/cifs/N0.87Nb1O0.13-MP-mp-2634-synth_doped.cif,data/source/MP/raw/cifs/mp-2634.cif,mp-2634,0.0,,2011-05-12 17:49:04,7.984187332554685,10.17188/1201157,"@misc{osti_1201157,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbN (SG:187) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201157"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671304'}},0.0,7.12357548,520.0,-20.57319827,-10.286599135,"{'tags': ['Niobium nitride (1/1)', 'Niobium nitride', 'Niobium nitride (1/1) - gamma']}",-20.57319827,-10.286599135,-1.2481991524999998,"['xas', 'elasticity', 'bandstructure']",True,"[185569, 644536, 76385, 191062]",True,2021-05-12 10:56:18.721000,NM,2,17,mp-2634,,NbN,"{'functional': 'PBE', 'labels': ['Nb_pv', 'N'], 'pot_type': 'paw'}","{'Nb': 1.0, 'N': 1.0}",GGA,mp-2634,"['mp-926732', 'mp-910421', 'mp-926222', 'mp-2634', 'mp-1058402', 'mp-1058440', 'mp-1058487', 'mp-1061535', 'mp-1061589', 'mp-1061648', 'mp-1116126', 'mp-1442283', 'mp-1671304', 'mp-1924826', 'mp-1594881', 'mp-1061618', 'mp-1058457']",0.0002504,"{'Nb': 1.0, 'N': 1.0}",22.23561881453577,[],NM,False,187,0,"[0, 0]",1.1261211216496917e-05,0.0002504,0,0.0002504,MP,data/source/MP/cleaned/cifs/MP-mp-2634.cif,True,,data/final/MP/graphs/N0.87Nb1O0.13-MP-mp-2634-synth_doped.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
B2C1Dy0.15Ho0.85Ni2,2,0.05,1.0,True,B2C1Dy0.15Ho0.85Ni2,B2C1Ho1Ni2,7.895,Other,True,B33.333C16.667Dy2.5Ho14.167Ni33.333,B-C-Dy-Ho-Ni,5,Supercon,Ho0.85Dy0.15Ni2B2C1,MP-mp-6646,Ho1Ni2B2C1,B-C-Ho-Ni,B33.333C16.667Ho16.667Ni33.333,I 4/m m m,tetragonal,3.529863997734658,3.529863997734658,5.76032203,data/final/MP/cifs/B2C1Dy0.15Ho0.85Ni2-MP-mp-6646-synth_doped.cif,data/source/MP/raw/cifs/mp-6646.cif,mp-6646,0.0,,2011-05-13 04:24:09,8.11075125231065,10.17188/1281460,"@misc{osti_1281460,
    author = ""Persson, Kristin"",
    title = ""Materials Data on HoNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281460"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1670774'}},0.0,6.70981387,520.0,-41.84364575,-6.973940958333333,{'tags': ['Holmium dinickel diboride carbide']},-41.84364575,-6.973940958333333,-0.5192332130555558,"['xas', 'elasticity', 'bandstructure']",True,"[79064, 56650, 79065, 79062, 79063, 79575]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-6646,,HoNi2B2C,"{'functional': 'PBE', 'labels': ['Ho_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Ho': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6646,"['mp-1007146', 'mp-6646', 'mp-1000682', 'mp-1439301', 'mp-1670774', 'mp-1782657', 'mp-1011887', 'mp-1589032']",0.0032459,"{'Ho': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",64.68537905730652,[],NM,False,139,0,"[0.0, -0.0, -0.0, 0.0, 0.0, 0.0]",5.017980952271099e-05,0.0032459,0,0.0032459,MP,data/source/MP/cleaned/cifs/MP-mp-6646.cif,True,,data/final/MP/graphs/B2C1Dy0.15Ho0.85Ni2-MP-mp-6646-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B12Th0.93Zr0.07,2,0.0107692307692307,1.0,True,B12Th0.93Zr0.07,B12Th1,5.5,Other,True,B92.308Th7.154Zr0.538,B-Th-Zr,3,Supercon,Th0.93Zr0.07B12,MP-mp-12570,Th1B12,B-Th,B92.308Th7.692,F m -3 m,cubic,5.37459985,5.374599849999999,5.374599849999999,data/final/MP/cifs/B12Th0.93Zr0.07-MP-mp-12570-synth_doped.cif,data/source/MP/raw/cifs/mp-12570.cif,mp-12570,0.0,,2015-02-18 17:39:46,5.472153989982715,10.17188/1188986,"@misc{osti_1188986,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ThB12 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188986"",
    place = ""United States"",
    year = ""2015"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696994'}},0.0096971426923211,7.15088211,520.0,-90.86162024,-6.989355403076923,{'tags': ['Thorium boride (1/12)']},-90.86162024,-6.989355403076923,-0.2534662107692294,"['xas', 'bandstructure']",True,"[108086, 615581]",True,2021-05-12 10:56:51.169000,NM,13,8,mp-12570,,ThB12,"{'functional': 'PBE', 'labels': ['Th', 'B'], 'pot_type': 'paw'}","{'Th': 1.0, 'B': 12.0}",GGA,mp-12570,"['mp-934069', 'mp-944130', 'mp-944755', 'mp-12570', 'mp-1418703', 'mp-1696994', 'mp-1803619', 'mp-1601656']",0.0002455,"{'Th': 1.0, 'B': 12.0}",109.78004618582077,[],NM,False,225,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.2362898225097383e-06,0.0002455,0,0.0002455,MP,data/source/MP/cleaned/cifs/MP-mp-12570.cif,True,,data/final/MP/graphs/B12Th0.93Zr0.07-MP-mp-12570-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
As2Ba0.5Fe1.9K0.5Ru0.1,2,0.04,2.0,False,As4Ba1Fe3.8K1Ru0.2,As4Ba1Fe4K1,37.14,Ferrite,True,As40Ba10Fe38K10Ru2,As-Ba-Fe-K-Ru,5,Supercon,Ba0.5K0.5Fe1.9Ru0.1As2,MP-mp-1223517,K1Ba1Fe4As4,As-Ba-Fe-K,As40Ba10Fe40K10,C m m m,orthorhombic,5.479027,5.480024002658328,7.13170472,data/final/MP/cifs/As2Ba0.5Fe1.9K0.5Ru0.1-MP-mp-1223517-synth_doped.cif,data/source/MP/raw/cifs/mp-1223517.cif,mp-1223517,0.0,,2019-01-12 23:54:03.876000,5.87534599912672,,,{'GGA': {'task_id': 'mp-1743010'}},0.0132513644999994,4.21185628,520.0,-59.66633886,-5.966633886,{'tags': []},-59.66633886,-5.966633886,-0.4120461663000007,[],False,[],True,2021-05-12 11:00:52.054000,FM,10,4,mp-1223517,,KBa(FeAs)4,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",GGA,mp-1223517,"['mp-1223517', 'mp-1396881', 'mp-1743010', 'mp-1827585']",0.9947188,"{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",197.6961518155852,[],FM,True,65,1,"[0.0, 0.0, 0.3, 0.3, 0.3, 0.3, 0.0, 0.0, 0.0, 0.0]",0.0050315536790412,0.9947188,4,0.9947188,MP,data/source/MP/cleaned/cifs/MP-mp-1223517.cif,True,,data/final/MP/graphs/As2Ba0.5Fe1.9K0.5Ru0.1-MP-mp-1223517-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ir0.9Rh0.1Te2,3,0.0666666666666666,4.0,False,Ir3.6Rh0.4Te8,Ir4Te8,2.61,Other,True,Ir30Rh3.333Te66.667,Ir-Rh-Te,3,Supercon,Ir0.9Rh0.1Te2,MP-mp-569322,Te8Ir4,Ir-Te,Ir33.333Te66.667,P n m a,orthorhombic,4.049805,5.441863,13.587474,data/final/MP/cifs/Ir0.9Rh0.1Te2-MP-mp-569322-synth_doped.cif,data/source/MP/raw/cifs/mp-569322.cif,mp-569322,0.0,,2014-02-16 04:48:25,9.924328423353325,10.17188/1275037,"@misc{osti_1275037,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Te2Ir (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1275037"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1746248'}},0.0123894575000003,7.60847828,520.0,-63.94410921,-5.3286757675,{'tags': ['Iridium telluride (1/2)']},-63.94410921,-5.3286757675,-0.5683316741666667,"['xas', 'bandstructure']",True,[93894],True,2021-05-12 10:57:24.969000,NM,12,7,mp-569322,,Te2Ir,"{'functional': 'PBE', 'labels': ['Te', 'Ir'], 'pot_type': 'paw'}","{'Te': 2.0, 'Ir': 1.0}",GGA,mp-569322,"['mp-927873', 'mp-927408', 'mp-569322', 'mp-911451', 'mp-1392626', 'mp-1746248', 'mp-1810340']",0.000153075,"{'Te': 8.0, 'Ir': 4.0}",299.44732816890644,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.0447669503153013e-06,0.000153075,0,0.0006123,MP,data/source/MP/cleaned/cifs/MP-mp-569322.cif,True,,data/final/MP/graphs/Ir0.9Rh0.1Te2-MP-mp-569322-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
In3La1,1,0.0,1.0,True,In3La1,In3La1,0.7,Other,True,In75La25,In-La,2,Supercon,In3La1,MP-mp-20729,La1In3,In-La,In75La25,P m -3 m,cubic,4.794334,4.794334,4.794334,data/final/MP/cifs/In3La1-MP-mp-20729.cif,data/source/MP/raw/cifs/mp-20729.cif,mp-20729,0.0,,2014-02-21 08:36:43,7.2834051824662,10.17188/1195890,"@misc{osti_1195890,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaIn3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195890"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672920'}},0.0,7.86497743,520.0,-15.09491222,-3.773728055,"{'tags': ['Indium lanthanum (3/1)', 'Lanthanum indium (1/3)']}",-15.09491222,-3.773728055,-0.47596348125,"['xas', 'elasticity', 'bandstructure']",True,"[639841, 191073, 639849, 639843, 51953, 51952]",True,2021-05-12 10:56:14.760000,NM,4,12,mp-20729,,LaIn3,"{'functional': 'PBE', 'labels': ['La', 'In_d'], 'pot_type': 'paw'}","{'La': 1.0, 'In': 3.0}",GGA,mp-20729,"['mp-930036', 'mp-930526', 'mp-913746', 'mp-20729', 'mp-1064661', 'mp-1064672', 'mp-1064702', 'mp-1439375', 'mp-1672920', 'mp-1805293', 'mp-1590976', 'mp-1064713']",0.0025303,"{'La': 1.0, 'In': 3.0}",110.20082818930766,[],NM,False,221,0,"[0, 0, 0, 0]",2.296080747826453e-05,0.0025303,0,0.0025303,MP,data/source/MP/cleaned/cifs/MP-mp-20729.cif,False,,data/final/MP/graphs/In3La1-MP-mp-20729.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Fe1.995K0.8Se2Zn0.005,3,0.0666666666666667,1.0,True,Fe1.995K0.8Se2Zn0.005,Fe2K1Se2,0.0,Ferrite,True,Fe41.563K16.667Se41.667Zn0.104,Fe-K-Se-Zn,4,Supercon,K0.8Fe1.995Zn0.005Se2,MP-mp-1070735,K1Fe2Se2,Fe-K-Se,Fe40K20Se40,I 4/m m m,tetragonal,3.783558000712664,3.783558000712664,7.91886339,data/final/MP/cifs/Fe1.995K0.8Se2Zn0.005-MP-mp-1070735-synth_doped.cif,data/source/MP/raw/cifs/mp-1070735.cif,mp-1070735,0.0,,2018-03-22 03:52:22,4.804538531009527,,,{'GGA': {'task_id': 'mp-1761650'}},0.0327827750000011,3.42423866,520.0,-27.50456218,-5.500912436,{'tags': ['Potassium iron selenide (1/2/2)']},-27.50456218,-5.500912436,-0.6812646755374999,['bandstructure'],True,[186573],True,2021-05-12 10:58:14.654000,FM,5,8,mp-1070735,,K(FeSe)2,"{'functional': 'PBE', 'labels': ['K_sv', 'Fe_pv', 'Se'], 'pot_type': 'paw'}","{'K': 1.0, 'Fe': 2.0, 'Se': 2.0}",GGA,mp-1070735,"['mp-1070735', 'mp-1070765', 'mp-1070841', 'mp-1416829', 'mp-1761650', 'mp-1797161', 'mp-1585994', 'mp-1070830']",6.0503851,"{'K': 1.0, 'Fe': 2.0, 'Se': 2.0}",106.69540665041993,[],FM,True,139,1,"[0.0, 2.8, 2.8, 0.0, 0.0]",0.0567070813069176,6.0503851,2,6.0503851,MP,data/source/MP/cleaned/cifs/MP-mp-1070735.cif,True,,data/final/MP/graphs/Fe1.995K0.8Se2Zn0.005-MP-mp-1070735-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Nd0.97Ni1Th0.03O3,2,0.012,4.0,False,Nd3.88Ni4Th0.12O12,Nd4Ni4O12,0.0,Oxide,True,Nd19.4Ni20Th0.6O60,Nd-Ni-Th-O,4,Supercon,Nd0.97Th0.03Ni1O3,MP-mp-22106,Nd4Ni4O12,Nd-Ni-O,Nd20Ni20O60,P n m a,orthorhombic,5.431762,5.495849,7.709429,data/final/MP/cifs/Nd0.97Ni1Th0.03O3-MP-mp-22106-synth_doped.cif,data/source/MP/raw/cifs/mp-22106.cif,mp-22106,0.0,,2014-02-19 13:18:08,7.242194237367626,,,{'GGA+U': {'task_id': 'mp-1701351'}},0.0,3.99854667,520.0,-131.66600273,-6.5833001365,"{'tags': ['Neodymium nickel(III) oxide', 'Dineodymium niccolate', 'Neodymium niccolate', 'Neodymium nickel oxide', 'Neodymium niccolate(III)']}",-131.66600273,-6.5833001365,-2.425267555500001,"['xas', 'bandstructure']",True,"[155746, 67725, 164825, 67724, 416213, 78319, 164562, 155747, 67723, 69788, 155748, 67722, 24875, 416212]",True,2021-05-12 10:57:01.079000,FM,20,11,mp-22106,oxide,NdNiO3,"{'functional': 'PBE', 'labels': ['Nd_3', 'Ni_pv', 'O'], 'pot_type': 'paw'}","{'Nd': 1.0, 'Ni': 1.0, 'O': 3.0}",GGA+U,mp-22106,"['mp-919926', 'mp-918860', 'mp-905914', 'mp-602303', 'mp-25591', 'mp-1189695', 'mp-22106', 'mp-1416651', 'mp-1701351', 'mp-1930748', 'mp-1599871']",1.00005245,"{'Nd': 4.0, 'Ni': 4.0, 'O': 12.0}",230.14298278419733,[],FM,True,62,1,"[0.0, 0.0, 0.0, 0.0, 1.4, 1.4, 1.4, 1.4, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0173814111193255,1.00005245,4,4.0002098,MP,data/source/MP/cleaned/cifs/MP-mp-22106.cif,True,,data/final/MP/graphs/Nd0.97Ni1Th0.03O3-MP-mp-22106-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Al0.29B2Mg0.71,3,0.1399999999999999,2.0,False,Al0.58B4Mg1.42,Al1B4Mg1,24.0,Other,True,Al9.667B66.667Mg23.667,Al-B-Mg,3,Supercon,Mg0.71Al0.29B2,MP-mp-1207086,Mg1Al1B4,Al-B-Mg,Al16.667B66.667Mg16.667,P 6/m m m,hexagonal,3.0390800030457754,3.03908045,6.743851,data/final/MP/cifs/Al0.29B2Mg0.71-MP-mp-1207086-synth_doped.cif,data/source/MP/raw/cifs/mp-1207086.cif,mp-1207086,0.0,,2019-01-12 10:15:58.939000,2.9100354640166017,,,,0.0,7.97438235,520.0,-32.93890018,-5.489816696666666,"{'tags': ['MgAlB4', 'MgAlB4 rt', 'AlB2 family']}",-32.93890018,-5.489816696666666,-0.1459128694444433,[],False,[],True,2021-05-12 11:00:19.396000,NM,6,3,mp-1207086,,MgAlB4,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Al', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Al': 1.0, 'B': 4.0}",GGA,mp-1207086,"['mp-1207086', 'mp-1420258', 'mp-1781830']",0.0064715,"{'Mg': 1.0, 'Al': 1.0, 'B': 4.0}",53.94149118560149,[],NM,False,191,0,"[0, 0, 0, 0, 0, 0]",0.0001199725824733,0.0064715,0,0.0064715,MP,data/source/MP/cleaned/cifs/MP-mp-1207086.cif,True,,data/final/MP/graphs/Al0.29B2Mg0.71-MP-mp-1207086-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
As2Co0.14Fe1.86Sr1,3,0.0559999999999999,1.0,True,As2Co0.14Fe1.86Sr1,As2Fe2Sr1,7.2,Ferrite,True,As40Co2.8Fe37.2Sr20,As-Co-Fe-Sr,4,Supercon,Sr1Fe1.86Co0.14As2,MP-mp-4488,Sr1Fe2As2,As-Fe-Sr,As40Fe40Sr20,I 4/m m m,tetragonal,3.9729799997357778,3.9729799997357778,6.45523327,data/final/MP/cifs/As2Co0.14Fe1.86Sr1-MP-mp-4488-synth_doped.cif,data/source/MP/raw/cifs/mp-4488.cif,mp-4488,0.0,,2011-05-13 03:37:13,6.319998834487784,10.17188/1208187,"@misc{osti_1208187,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr(FeAs)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208187"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672865'}},0.0,5.13397273,520.0,-30.61898897,-6.123797794,"{'tags': ['Strontium diiron arsenide - HT', 'Strontium diiron arsenide', 'Strontium diiron diarsenide', 'Iron strontium arsenide (2/1/2)', 'Strontium diiron arsenide - LT']}",-30.61898897,-6.123797794,-0.5342483613333335,"['xas', 'elasticity', 'bandstructure']",True,"[182330, 181993, 610527, 163209, 163208, 163869]",True,2021-05-12 10:56:20.740000,NM,5,8,mp-4488,,Sr(FeAs)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Fe': 2.0, 'As': 2.0}",GGA,mp-4488,"['mp-906356', 'mp-920135', 'mp-919110', 'mp-4488', 'mp-1439153', 'mp-1672865', 'mp-1873948', 'mp-1592272']",0.0029206,"{'Sr': 1.0, 'Fe': 2.0, 'As': 2.0}",91.7377588211838,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",3.183640016422098e-05,0.0029206,0,0.0029206,MP,data/source/MP/cleaned/cifs/MP-mp-4488.cif,True,,data/final/MP/graphs/As2Co0.14Fe1.86Sr1-MP-mp-4488-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ca0.15Cu3Pb2Sr2Y0.85O8,2,0.01875,2.0,False,Ca0.3Cu6Pb4Sr4Y1.7O16,Cu6Pb4Sr4Y2O16,47.0,Cuprate,True,Ca0.938Cu18.75Pb12.5Sr12.5Y5.312O50,Ca-Cu-Pb-Sr-Y-O,6,Supercon,Pb2Sr2Y0.85Ca0.15Cu3O8,MP-mp-1198573,Sr4Y2Cu6Pb4O16,Cu-Pb-Sr-Y-O,Cu18.75Pb12.5Sr12.5Y6.25O50,P m n a,orthorhombic,5.415744,5.488367,15.951096,data/final/MP/cifs/Ca0.15Cu3Pb2Sr2Y0.85O8-MP-mp-1198573-synth_doped.cif,data/source/MP/raw/cifs/mp-1198573.cif,mp-1198573,0.0,,2019-01-12 03:19:55.890000,6.984903949344623,,,{'GGA': {'task_id': 'mp-1733220'}},0.0235427039355471,4.6568914,520.0,-193.37804115,-6.0430637859375,{'tags': ['Lead strontium yttrium copper oxide (2/2/1/3/8)']},-193.37804115,-6.0430637859375,-2.0645600228125,['bandstructure'],True,[71478],True,2021-05-12 10:58:37.524000,NM,32,5,mp-1198573,oxide,Sr2YCu3(PbO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Y_sv', 'Cu_pv', 'Pb_d', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Y': 1.0, 'Cu': 3.0, 'Pb': 2.0, 'O': 8.0}",GGA,mp-1198573,"['mp-1198573', 'mp-1384845', 'mp-1733220', 'mp-1823228', 'mp-1654304']",0.00063755,"{'Sr': 4.0, 'Y': 2.0, 'Cu': 6.0, 'Pb': 4.0, 'O': 16.0}",474.1238479236181,[],NM,False,53,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.689381699706065e-06,0.00063755,0,0.0012751,MP,data/source/MP/cleaned/cifs/MP-mp-1198573.cif,True,,data/final/MP/graphs/Ca0.15Cu3Pb2Sr2Y0.85O8-MP-mp-1198573-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
C2Er1,3,0.1333333333333334,6.0,False,C12Er6,C12Er8,0.0,Carbon,True,C66.667Er33.333,C-Er,2,Supercon,C2Er1,MP-mp-9544,Er8C12,C-Er,C60Er40,I -4 3 d,cubic,7.052091631563338,7.05209163,7.05209163,data/final/MP/cifs/C2Er1-MP-mp-9544-synth_doped.cif,data/source/MP/raw/cifs/mp-9544.cif,mp-9544,0.0,,2011-06-03 14:05:35,9.11641474508013,10.17188/1313321,"@misc{osti_1313321,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Er2C3 (SG:220) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1313321"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1669616'}},0.0577142785999997,5.22772959,520.0,-152.6737309,-7.633686545000001,{'tags': ['Erbium carbide (2/3)']},-152.6737309,-7.633686545000001,-0.2705306010000001,"['xas', 'bandstructure']",True,[86291],True,2021-05-12 10:57:55.580000,NM,20,7,mp-9544,,Er2C3,"{'functional': 'PBE', 'labels': ['Er_3', 'C'], 'pot_type': 'paw'}","{'Er': 2.0, 'C': 3.0}",GGA,mp-9544,"['mp-939961', 'mp-916847', 'mp-937431', 'mp-9544', 'mp-1432667', 'mp-1669616', 'mp-1607975']",0.004171325,"{'Er': 8.0, 'C': 12.0}",269.9802211234865,[],NM,False,220,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.180193471420373e-05,0.004171325,0,0.0166853,MP,data/source/MP/cleaned/cifs/MP-mp-9544.cif,True,,data/final/MP/graphs/C2Er1-MP-mp-9544-synth_doped.json,0,True,-43m,5,0,0,0,0,0,0,0,0,1,0,1.0,False
Ti1O0.91,2,0.0471204188481675,3.0,False,Ti3O2.73,Ti3O3,0.7,Oxide,True,Ti52.356O47.64397905759162,Ti-O,2,Supercon,O0.91Ti1,MP-mp-1071163,Ti3O3,Ti-O,Ti50O50,P -6 2 m,hexagonal,2.882,5.018533996843054,5.01853492,data/final/MP/cifs/Ti1O0.91-MP-mp-1071163-synth_doped.cif,data/source/MP/raw/cifs/mp-1071163.cif,mp-1071163,0.0,,2018-03-22 04:46:02,5.061326249939046,,,{'GGA': {'task_id': 'mp-1671500'}},0.0,8.43623776,520.0,-53.91709674,-8.986182789999999,{'tags': ['Titanium oxide']},-53.91709674,-8.986182789999999,-2.9079562791666667,['bandstructure'],True,[196273],True,2021-05-12 10:58:14.654000,NM,6,8,mp-1071163,oxide,TiO,"{'functional': 'PBE', 'labels': ['Ti_pv', 'O'], 'pot_type': 'paw'}","{'Ti': 1.0, 'O': 1.0}",GGA,mp-1071163,"['mp-1071163', 'mp-1071204', 'mp-1071247', 'mp-1301050', 'mp-1671500', 'mp-1792807', 'mp-1588087', 'mp-1071237']",1.07e-05,"{'Ti': 3.0, 'O': 3.0}",62.86059048913085,[],NM,False,189,0,"[0, 0, 0, 0, 0, 0]",5.106538094889576e-07,1.07e-05,0,3.21e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1071163.cif,True,,data/final/MP/graphs/Ti1O0.91-MP-mp-1071163-synth_doped.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Pt1Ti3,1,0.0,2.0,False,Pt2Ti6,Pt2Ti6,0.58,Other,True,Pt25Ti75,Pt-Ti,2,Supercon,Pt1Ti3,MP-mp-2339,Ti6Pt2,Pt-Ti,Pt25Ti75,P m -3 n,cubic,5.043666,5.043666,5.043666,data/final/MP/cifs/Pt1Ti3-MP-mp-2339.cif,data/source/MP/raw/cifs/mp-2339.cif,mp-2339,0.0,,2011-05-13 22:56:05,8.766699056128099,10.17188/1199472,"@misc{osti_1199472,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ti3Pt (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199472"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695131'}},0.0,6.52236689,520.0,-64.6876792,-8.0859599,{'tags': ['Platinum titanium (1/3)']},-64.6876792,-8.0859599,-0.6466139600000007,"['xas', 'elasticity', 'bandstructure']",True,"[649774, 105816, 150489]",True,2021-05-12 10:56:16.728000,NM,8,8,mp-2339,,Ti3Pt,"{'functional': 'PBE', 'labels': ['Ti_pv', 'Pt'], 'pot_type': 'paw'}","{'Ti': 3.0, 'Pt': 1.0}",GGA,mp-2339,"['mp-919553', 'mp-905351', 'mp-918555', 'mp-2339', 'mp-1431825', 'mp-1695131', 'mp-1877568', 'mp-1592357']",0.0224715,"{'Ti': 6.0, 'Pt': 2.0}",128.30363405215613,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0003502862590916,0.0224715,0,0.044943,MP,data/source/MP/cleaned/cifs/MP-mp-2339.cif,False,,data/final/MP/graphs/Pt1Ti3-MP-mp-2339.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ce0.9In5La0.1Rh1,2,0.0285714285714285,1.0,True,Ce0.9In5La0.1Rh1,Ce1In5Rh1,1.6,Heavy_fermion,True,Ce12.857In71.429La1.429Rh14.286,Ce-In-La-Rh,4,Supercon,Ce0.9La0.1Rh1In5,MP-mp-20294,Ce1In5Rh1,Ce-In-Rh,Ce14.286In71.429Rh14.286,P 4/m m m,tetragonal,4.709358,4.709358,7.592679,data/final/MP/cifs/Ce0.9In5La0.1Rh1-MP-mp-20294-synth_doped.cif,data/source/MP/raw/cifs/mp-20294.cif,mp-20294,0.0,,2015-11-23 15:12:00,8.05771622389016,10.17188/1195421,"@misc{osti_1195421,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeIn5Rh (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195421"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701496'}},0.0,7.74909127,520.0,-30.04466451,-4.29209493,"{'tags': ['High pressure experimental phase', 'Cerium rhodium indium (1/1/5) - HP', 'Cerium rhodium indide (1/1/5)']}",-30.04466451,-4.29209493,-0.4269784049999998,"['xas', 'bandstructure']",True,"[150226, 110780, 110777, 110779, 110778]",True,2021-05-12 10:56:57.051000,FM,7,8,mp-20294,,CeIn5Rh,"{'functional': 'PBE', 'labels': ['Ce', 'In_d', 'Rh_pv'], 'pot_type': 'paw'}","{'Ce': 1.0, 'In': 5.0, 'Rh': 1.0}",GGA,mp-20294,"['mp-986842', 'mp-988024', 'mp-1430916', 'mp-1701496', 'mp-1780117', 'mp-988278', 'mp-1588425', 'mp-20294']",0.0607598,"{'Ce': 1.0, 'In': 5.0, 'Rh': 1.0}",168.39083554410138,[],FM,True,123,1,"[0.1, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0003608260497293,0.0607598,1,0.0607598,MP,data/source/MP/cleaned/cifs/MP-mp-20294.cif,True,,data/final/MP/graphs/Ce0.9In5La0.1Rh1-MP-mp-20294-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ga1Pt1,1,0.0,4.0,False,Ga4Pt4,Ga4Pt4,1.74,Other,True,Ga50Pt50,Ga-Pt,2,Supercon,Ga1Pt1,MP-mp-1025551,Ga4Pt4,Ga-Pt,Ga50Pt50,P 21 3,cubic,4.972941,4.972941,4.972941,data/final/MP/cifs/Ga1Pt1-MP-mp-1025551.cif,data/source/MP/raw/cifs/mp-1025551.cif,mp-1025551,0.0,,2016-10-13 07:43:29,14.302061127329177,10.17188/1355508,"@article{osti_1355508,
    author = ""Persson, Kristin"",
    title = ""Materials Data on GaPt (SG:198) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1355508"",
    place = ""United States"",
    year = ""2017"",
    month = ""5""
}
",{'GGA': {'task_id': 'mp-1695784'}},0.0,6.30491891,520.0,-41.43681667,-5.17960208375,"{'tags': ['PtGa', 'Platinum gallide (1/1)', 'FeSi']}",-41.43681667,-5.17960208375,-0.6301002174999999,"['bandstructure', 'elasticity']",True,[635132],True,2021-05-12 10:56:10.715000,NM,8,7,mp-1025551,,GaPt,"{'functional': 'PBE', 'labels': ['Ga_d', 'Pt'], 'pot_type': 'paw'}","{'Ga': 1.0, 'Pt': 1.0}",GGA,mp-1025551,"['mp-1025551', 'mp-1079359', 'mp-1115602', 'mp-1428151', 'mp-1695784', 'mp-1803518', 'mp-1592868']",0.0001719,"{'Ga': 4.0, 'Pt': 4.0}",122.9815380298998,[],NM,False,198,0,"[0, 0, 0, 0, 0, 0, 0, 0]",5.591083109017775e-06,0.0001719,0,0.0006876,MP,data/source/MP/cleaned/cifs/MP-mp-1025551.cif,False,,data/final/MP/graphs/Ga1Pt1-MP-mp-1025551.json,0,True,23,1,0,0,0,0,0,0,1,0,0,0,1.0,False
Pd1Si3Y2,1,0.0,4.0,False,Pd4Si12Y8,Pd4Si12Y8,0.0,Other,True,Pd16.667Si50Y33.333,Pd-Si-Y,3,Supercon,Y2Pd1Si3,MP-mp-1207726,Y8Si12Pd4,Pd-Si-Y,Pd16.667Si50Y33.333,P 63/m m c,hexagonal,7.918131,8.226578002562189,8.22657754,data/final/MP/cifs/Pd1Si3Y2-MP-mp-1207726.cif,data/source/MP/raw/cifs/mp-1207726.cif,mp-1207726,0.0,,2019-01-12 10:46:45.770000,5.274010044541648,,,{'GGA': {'task_id': 'mp-1682468'}},0.0,6.28076909,520.0,-159.06941401,-6.627892250416667,"{'tags': ['Lu2CoGa3', 'Y2PdSi3', 'AlB2 family']}",-159.06941401,-6.627892250416667,-0.896431234305556,[],False,[],True,2021-05-12 11:00:19.396000,NM,24,4,mp-1207726,,Y2Si3Pd,"{'functional': 'PBE', 'labels': ['Y_sv', 'Si', 'Pd'], 'pot_type': 'paw'}","{'Y': 2.0, 'Si': 3.0, 'Pd': 1.0}",GGA,mp-1207726,"['mp-1207726', 'mp-1347657', 'mp-1682468', 'mp-1817871']",4.425e-05,"{'Y': 8.0, 'Si': 12.0, 'Pd': 4.0}",464.0787912904264,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.814007520314178e-07,4.425e-05,0,0.000177,MP,data/source/MP/cleaned/cifs/MP-mp-1207726.cif,False,,data/final/MP/graphs/Pd1Si3Y2-MP-mp-1207726.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Cu3Lu0.8Pr0.2O7,3,0.0307692307692307,1.0,True,Ba2Cu3Lu0.8Pr0.2O7,Ba2Cu3Lu1O7,86.8,Cuprate,True,Ba15.385Cu23.077Lu6.154Pr1.538O53.84615384615385,Ba-Cu-Lu-Pr-O,5,Supercon,Lu0.8Pr0.2Ba2Cu3O7,MP-mp-20324,Ba2Lu1Cu3O7,Ba-Cu-Lu-O,Ba15.385Cu23.077Lu7.692O53.84615384615385,P m m m,orthorhombic,3.818903,3.898469,11.801871,data/final/MP/cifs/Ba2Cu3Lu0.8Pr0.2O7-MP-mp-20324-synth_doped.cif,data/source/MP/raw/cifs/mp-20324.cif,mp-20324,0.0,,2014-02-22 11:14:13,7.109359718686039,10.17188/1195446,"@misc{osti_1195446,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2LuCu3O7 (SG:47) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195446"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1705063'}},0.0403003135096193,3.25942075,520.0,-79.03066785,-6.079282142307692,{'tags': ['Lutetium barium copper oxide (1/2/3/7)']},-79.03066785,-6.079282142307692,-2.1959560480769227,['bandstructure'],True,[161972],True,2021-05-12 10:58:49.477000,NM,13,8,mp-20324,oxide,Ba2LuCu3O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Lu_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Lu': 1.0, 'Cu': 3.0, 'O': 7.0}",GGA,mp-20324,"['mp-991834', 'mp-992281', 'mp-20324', 'mp-1421391', 'mp-1705063', 'mp-1786269', 'mp-993914', 'mp-1597533']",0.0008559,"{'Ba': 2.0, 'Lu': 1.0, 'Cu': 3.0, 'O': 7.0}",175.70477973623184,[],NM,False,47,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.871239139224771e-06,0.0008559,0,0.0008559,MP,data/source/MP/cleaned/cifs/MP-mp-20324.cif,True,,data/final/MP/graphs/Ba2Cu3Lu0.8Pr0.2O7-MP-mp-20324-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Bi2Cu1Sr2O6.13,2,0.0106183125051049,1.9576464110929848,False,Bi3.915Cu1.958Sr3.915O12,Bi4Cu2Sr4O12,16.0,Cuprate,True,Bi17.969Cu8.985Sr17.969O55.076370170709794,Bi-Cu-Sr-O,4,Supercon,Bi2Sr2Cu1O6.13,MP-mp-555827,Sr4Cu2Bi4O12,Bi-Cu-Sr-O,Bi18.182Cu9.091Sr18.182O54.54545454545455,C c c m,orthorhombic,5.133052,5.52519599964684,13.01880065,data/final/MP/cifs/Bi2Cu1Sr2O6.13-MP-mp-555827-synth_doped.cif,data/source/MP/raw/cifs/mp-555827.cif,mp-555827,0.0,,2014-02-22 10:13:35,6.928457216674172,10.17188/1269010,"@misc{osti_1269010,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr2Cu(BiO3)2 (SG:66) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1269010"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1707731'}},0.0585641377272736,4.75363105,520.0,-126.5422218,-5.7519191727272725,{'tags': ['Dibismuth distrontium copper hexaoxide']},-126.5422218,-5.7519191727272725,-2.0406438793939388,"['xas', 'bandstructure']",True,[67426],True,2021-05-12 10:57:17.297000,NM,22,8,mp-555827,oxide,Sr2Cu(BiO3)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Cu': 1.0, 'Bi': 2.0, 'O': 6.0}",GGA,mp-555827,"['mp-932594', 'mp-931549', 'mp-918058', 'mp-555827', 'mp-1418436', 'mp-1707731', 'mp-1837530', 'mp-1605675']",0.00627605,"{'Sr': 4.0, 'Cu': 2.0, 'Bi': 4.0, 'O': 12.0}",360.8189966762927,[],NM,False,66,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",3.478780251490214e-05,0.00627605,0,0.0125521,MP,data/source/MP/cleaned/cifs/MP-mp-555827.cif,True,,data/final/MP/graphs/Bi2Cu1Sr2O6.13-MP-mp-555827-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ga0.236V0.764,2,0.028,8.0,False,Ga1.888V6.112,Ga2V6,14.6,Other,True,Ga23.6V76.4,Ga-V,2,Supercon,Ga0.236V0.764,MP-mp-22568,V6Ga2,Ga-V,Ga25V75,P m -3 n,cubic,4.789645,4.789645,4.789645,data/final/MP/cifs/Ga0.236V0.764-MP-mp-22568-synth_doped.cif,data/source/MP/raw/cifs/mp-22568.cif,mp-22568,0.0,,2014-02-22 11:36:40,6.726541666276222,10.17188/1198793,"@misc{osti_1198793,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Ga (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198793"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686867'}},0.0,5.67452231,520.0,-61.95244347,-7.74405543375,{'tags': ['Gallium vanadium (1/3)']},-61.95244347,-7.74405543375,-0.1741018756249994,"['xas', 'elasticity', 'bandstructure']",True,"[635643, 635628, 635619, 635634, 104021, 635646, 635604, 635610, 635617, 635624, 635626, 635605, 635631, 635625, 635636, 635603, 104020, 635616, 635607]",True,2021-05-12 10:56:16.728000,FM,8,9,mp-22568,,V3Ga,"{'functional': 'PBE', 'labels': ['V_pv', 'Ga_d'], 'pot_type': 'paw'}","{'V': 3.0, 'Ga': 1.0}",GGA,mp-22568,"['mp-941343', 'mp-941663', 'mp-934924', 'mp-22568', 'mp-1440749', 'mp-1686867', 'mp-1804076', 'mp-1593784', 'mp-1595713']",0.09063635,"{'V': 6.0, 'Ga': 2.0}",109.87780534443452,[],FM,True,131,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.0, -0.0, -0.0]",0.0016497662965852,0.09063635,2,0.1812727,MP,data/source/MP/cleaned/cifs/MP-mp-22568.cif,True,,data/final/MP/graphs/Ga0.236V0.764-MP-mp-22568-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Pd4Se1,1,0.0,2.0,False,Pd8Se2,Pd8Se2,0.21,Other,True,Pd80Se20,Pd-Se,2,Supercon,Pd4Se1,MP-mp-7818,Pd8Se2,Pd-Se,Pd80Se20,P -4 21 c,tetragonal,5.314807,5.314807,5.762397,data/final/MP/cifs/Pd4Se1-MP-mp-7818.cif,data/source/MP/raw/cifs/mp-7818.cif,mp-7818,0.0,,2011-05-30 06:45:10,10.29633329731544,10.17188/1307580,"@misc{osti_1307580,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Pd4Se (SG:114) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1307580"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696479'}},0.0,5.07601896,520.0,-50.03404921,-5.003404921,{'tags': ['Palladium selenide (4/1)']},-50.03404921,-5.003404921,-0.2547171774687499,"['bandstructure', 'elasticity']",True,[23864],True,2021-05-12 10:56:31.128000,NM,10,8,mp-7818,,Pd4Se,"{'functional': 'PBE', 'labels': ['Pd', 'Se'], 'pot_type': 'paw'}","{'Pd': 4.0, 'Se': 1.0}",GGA,mp-7818,"['mp-913043', 'mp-7818', 'mp-929268', 'mp-930128', 'mp-1429762', 'mp-1696479', 'mp-1779253', 'mp-1601294']",9.195e-05,"{'Pd': 8.0, 'Se': 2.0}",162.7714275309073,[],NM,False,114,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.1298051678331617e-06,9.195e-05,0,0.0001839,MP,data/source/MP/cleaned/cifs/MP-mp-7818.cif,False,,data/final/MP/graphs/Pd4Se1-MP-mp-7818.json,0,True,-42m,0,0,0,0,6,0,0,1,0,0,0,1.0,False
Co0.9Cu0.1Zr2,3,0.0666666666666666,2.0,False,Co1.8Cu0.2Zr4,Co2Zr4,6.07,Other,True,Co30Cu3.333Zr66.667,Co-Cu-Zr,3,Supercon,Zr2Co0.9Cu0.1,MP-mp-628,Zr4Co2,Co-Zr,Co33.333Zr66.667,I 4/m c m,tetragonal,5.27792884001752,5.27792884,5.277928840000001,data/final/MP/cifs/Co0.9Cu0.1Zr2-MP-mp-628-synth_doped.cif,data/source/MP/raw/cifs/mp-628.cif,mp-628,0.0,,2011-05-13 12:16:44,7.17077101131263,10.17188/1278899,"@misc{osti_1278899,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Zr2Co (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278899"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677545'}},0.0,4.51380976,520.0,-49.95120762,-8.325201269999999,"{'tags': ['Cobalt zirconium (1/2)', 'Zirconium cobalt (2/1)']}",-49.95120762,-8.325201269999999,-0.2572949183333328,"['xas', 'elasticity', 'bandstructure']",True,"[625671, 191386, 625688, 102740, 625665]",True,2021-05-12 10:56:27.046000,NM,6,20,mp-628,,Zr2Co,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Co'], 'pot_type': 'paw'}","{'Zr': 2.0, 'Co': 1.0}",GGA,mp-628,"['mp-928347', 'mp-912327', 'mp-928866', 'mp-628', 'mp-1071352', 'mp-1071381', 'mp-1071431', 'mp-1071762', 'mp-1071803', 'mp-1071859', 'mp-1071883', 'mp-1071742', 'mp-1071925', 'mp-1441633', 'mp-1677545', 'mp-1802810', 'mp-1591799', 'mp-1071792', 'mp-1071416', 'mp-1071915']",0.0001226,"{'Zr': 4.0, 'Co': 2.0}",111.79353060019714,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0]",2.1933290654975308e-06,0.0001226,0,0.0002452,MP,data/source/MP/cleaned/cifs/MP-mp-628.cif,True,,data/final/MP/graphs/Co0.9Cu0.1Zr2-MP-mp-628-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Al0.6Mg0.4,3,0.1333333333333333,3.0,False,Al1.8Mg1.2,Al2Mg1,1.2775,Other,True,Al60Mg40,Al-Mg,2,Supercon,Al0.6Mg0.4,MP-mp-1222013,Mg1Al2,Al-Mg,Al66.667Mg33.333,P -3 m 1,trigonal,3.025555998685988,3.02555569,7.035691,data/final/MP/cifs/Al0.6Mg0.4-MP-mp-1222013-synth_doped.cif,data/source/MP/raw/cifs/mp-1222013.cif,mp-1222013,0.0,,2019-01-12 22:36:55.486000,2.3301615984815167,,,,0.0658194083333332,6.20317385,520.0,-8.95984036,-2.9866134533333333,{'tags': []},-8.95984036,-2.9866134533333333,0.0438637833333335,[],False,[],True,2021-05-12 11:00:49.659000,NM,3,3,mp-1222013,,MgAl2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Al'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Al': 2.0}",GGA,mp-1222013,"['mp-1222013', 'mp-1424906', 'mp-1794299']",0.0012407,"{'Mg': 1.0, 'Al': 2.0}",55.7760457227343,[],NM,False,164,0,"[0, 0, 0]",2.2244316245859123e-05,0.0012407,0,0.0012407,MP,data/source/MP/cleaned/cifs/MP-mp-1222013.cif,True,,data/final/MP/graphs/Al0.6Mg0.4-MP-mp-1222013-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
C1Nb0.9W0.1,3,0.0999999999999999,1.0,True,C1Nb0.9W0.1,C1Nb1,11.6,Other,True,C50Nb45W5,C-Nb-W,3,Supercon,Nb0.9W0.1C1,MP-mp-910,Nb1C1,C-Nb,C50Nb50,F m -3 m,cubic,3.18634336,3.1863433599999995,3.1863433599999995,data/final/MP/cifs/C1Nb0.9W0.1-MP-mp-910-synth_doped.cif,data/source/MP/raw/cifs/mp-910.cif,mp-910,0.0,,2011-05-12 17:28:40,7.616098778357742,10.17188/1282001,"@misc{osti_1282001,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbC (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1282001"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686610'}},0.0408750508333302,7.39992982,520.0,-20.24633413,-10.123167065,"{'tags': ['Niobium carbide (1/1)', 'Niobium carbide (1/1) - RS-type']}",-20.24633413,-10.123167065,-0.4591241950000011,"['xas', 'elasticity', 'bandstructure']",True,"[618465, 77214, 187077, 618456, 181792, 618453, 94449, 618472, 183163, 237582, 618457, 159872, 618480, 618475, 618482, 618469, 155164, 618466, 44355, 618450, 618458, 618449, 44496, 618463, 618462, 618460, 618481, 618471, 618476, 181052, 601142, 618448, 189089, 618478, 26955, 618473, 618484, 618483]",True,2021-05-12 10:56:35.166000,NM,2,25,mp-910,,NbC,"{'functional': 'PBE', 'labels': ['Nb_pv', 'C'], 'pot_type': 'paw'}","{'Nb': 1.0, 'C': 1.0}",GGA,mp-910,"['mp-1000444', 'mp-1001333', 'mp-910', 'mp-1057158', 'mp-1057178', 'mp-1057130', 'mp-1057651', 'mp-1057669', 'mp-1057682', 'mp-1057771', 'mp-1057779', 'mp-1057802', 'mp-1060960', 'mp-1060978', 'mp-1061015', 'mp-1440938', 'mp-1686610', 'mp-1805660', 'mp-1007673', 'mp-1593845', 'mp-1596940', 'mp-1061007', 'mp-1057677', 'mp-1057792', 'mp-1057174']",3.33e-05,"{'Nb': 1.0, 'C': 1.0}",22.87508541625878,[],NM,False,225,0,"[0, 0]",1.4557322691495426e-06,3.33e-05,0,3.33e-05,MP,data/source/MP/cleaned/cifs/MP-mp-910.cif,True,,data/final/MP/graphs/C1Nb0.9W0.1-MP-mp-910-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Mo3Sn1,1,0.0,2.0,False,Mo6Sn2,Mo6Sn2,0.0,Other,True,Mo75Sn25,Mo-Sn,2,Supercon,Mo3Sn1,MP-mp-30788,Sn2Mo6,Mo-Sn,Mo75Sn25,P m -3 n,cubic,5.12774,5.12774,5.12774,data/final/MP/cifs/Mo3Sn1-MP-mp-30788.cif,data/source/MP/raw/cifs/mp-30788.cif,mp-30788,0.0,,2014-02-24 10:44:10,10.013679890663555,10.17188/1205149,"@misc{osti_1205149,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SnMo3 (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1205149"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698917'}},0.0519166962500001,9.6066344,520.0,-72.67766832,-9.08470854,"{'tags': ['Molybdenum tin (3/1)', 'Molybdenum stannide (3/1)']}",-72.67766832,-9.08470854,0.0519166962500001,"['xas', 'elasticity', 'bandstructure']",True,"[105094, 644455]",True,2021-05-12 10:56:18.721000,NM,8,8,mp-30788,,SnMo3,"{'functional': 'PBE', 'labels': ['Sn_d', 'Mo_pv'], 'pot_type': 'paw'}","{'Sn': 1.0, 'Mo': 3.0}",GGA,mp-30788,"['mp-941792', 'mp-935144', 'mp-941972', 'mp-30788', 'mp-1425230', 'mp-1698917', 'mp-1787829', 'mp-1587349']",0.00052115,"{'Sn': 2.0, 'Mo': 6.0}",134.82734701242083,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",7.730627525467657e-06,0.00052115,0,0.0010423,MP,data/source/MP/cleaned/cifs/MP-mp-30788.cif,False,,data/final/MP/graphs/Mo3Sn1-MP-mp-30788.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
B2C1Gd0.26Ni2Y0.74,3,0.0866666666666666,1.0,True,B2C1Gd0.26Ni2Y0.74,B2C1Ni2Y1,5.935,Other,True,B33.333C16.667Gd4.333Ni33.333Y12.333,B-C-Gd-Ni-Y,5,Supercon,Y0.74Gd0.26Ni2B2C1,MP-mp-6576,Y1Ni2B2C1,B-C-Ni-Y,B33.333C16.667Ni33.333Y16.667,I 4/m m m,tetragonal,3.548790000501972,3.548790000501972,5.76144136,data/final/MP/cifs/B2C1Gd0.26Ni2Y0.74-MP-mp-6576-synth_doped.cif,data/source/MP/raw/cifs/mp-6576.cif,mp-6576,0.0,,2011-05-13 05:21:43,6.099730998852292,10.17188/1281366,"@misc{osti_1281366,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281366"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688230'}},0.0,6.81083016,520.0,-43.677878,-7.279646333333333,{'tags': []},-43.677878,-7.279646333333333,-0.5109282141666659,"['xas', 'bandstructure']",True,"[75816, 89142, 83231, 79574, 41549]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6576,,YNi2B2C,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6576,"['mp-6576', 'mp-1007054', 'mp-1000583', 'mp-1439516', 'mp-1688230', 'mp-1794280', 'mp-1011792', 'mp-1597064']",0.0006603,"{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.3152437079014,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",1.010943177297096e-05,0.0006603,0,0.0006603,MP,data/source/MP/cleaned/cifs/MP-mp-6576.cif,True,,data/final/MP/graphs/B2C1Gd0.26Ni2Y0.74-MP-mp-6576-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B2C1Ni2Pr0.8Y0.2,3,0.0666666666666666,1.0,True,B2C1Ni2Pr0.8Y0.2,B2C1Ni2Pr1,0.0,Heavy_fermion,True,B33.333C16.667Ni33.333Pr13.333Y3.333,B-C-Ni-Pr-Y,5,Supercon,Y0.2Pr0.8Ni2B2C1,MP-mp-6140,Pr1Ni2B2C1,B-C-Ni-Pr,B33.333C16.667Ni33.333Pr16.667,I 4/m m m,tetragonal,3.725709997077651,3.725709997077651,5.63293197,data/final/MP/cifs/B2C1Ni2Pr0.8Y0.2-MP-mp-6140-synth_doped.cif,data/source/MP/raw/cifs/mp-6140.cif,mp-6140,0.0,,2011-05-13 05:19:07,7.014099329459356,10.17188/1272832,"@misc{osti_1272832,
    author = ""Persson, Kristin"",
    title = ""Materials Data on PrNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1272832"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699456'}},0.0,6.67668873,520.0,-41.52498831,-6.920831385,{'tags': []},-41.52498831,-6.920831385,-0.4330419272222213,"['xas', 'bandstructure']",True,"[56646, 79568, 157582]",True,2021-05-12 10:57:28.836000,NM,6,8,mp-6140,,PrNi2B2C,"{'functional': 'PBE', 'labels': ['Pr_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Pr': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6140,"['mp-1000385', 'mp-1001321', 'mp-6140', 'mp-1412904', 'mp-1699456', 'mp-1800276', 'mp-1007675', 'mp-1593561']",0.0044921,"{'Pr': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",69.11171547574348,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",6.499766311800807e-05,0.0044921,0,0.0044921,MP,data/source/MP/cleaned/cifs/MP-mp-6140.cif,True,,data/final/MP/graphs/B2C1Ni2Pr0.8Y0.2-MP-mp-6140-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Au0.22Nb0.78,3,0.06,8.0,False,Au1.76Nb6.24,Au2Nb6,7.6,Other,True,Au22Nb78,Au-Nb,2,Supercon,Au0.22Nb0.78,MP-mp-2752,Nb6Au2,Au-Nb,Au25Nb75,P m -3 n,cubic,5.256336,5.256336,5.256336,data/final/MP/cifs/Au0.22Nb0.78-MP-mp-2752-synth_doped.cif,data/source/MP/raw/cifs/mp-2752.cif,mp-2752,0.0,,2011-05-14 04:00:34,10.878019698243486,10.17188/1201733,"@misc{osti_1201733,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Au (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201733"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677627'}},0.0265571000000033,5.43391329,520.0,-67.6805768,-8.4600721,{'tags': ['Gold niobium (1/3)']},-67.6805768,-8.4600721,-0.0656229350000003,"['xas', 'elasticity', 'bandstructure']",True,"[612199, 58557, 612192, 612186, 612203, 612188, 612198, 612185]",True,2021-05-12 10:56:18.721000,FM,8,8,mp-2752,,Nb3Au,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Au'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Au': 1.0}",GGA,mp-2752,"['mp-941043', 'mp-934500', 'mp-940884', 'mp-2752', 'mp-1437534', 'mp-1677627', 'mp-1787383', 'mp-1591584']",0.84123765,"{'Nb': 6.0, 'Au': 2.0}",145.22766553647008,[],FM,True,223,1,"[0.2, 0.2, 0.2, 0.2, 0.2, 0.2, 0.0, 0.0]",0.0115850881013954,0.84123765,6,1.6824753,MP,data/source/MP/cleaned/cifs/MP-mp-2752.cif,True,,data/final/MP/graphs/Au0.22Nb0.78-MP-mp-2752-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Co1Cu2Er1O7.07,2,0.004943793773174,0.990019801980198,True,Ba1.98Co0.99Cu1.98Er0.99O7,Ba2Co1Cu2Er1O7,0.0,Cuprate,True,Ba15.302Co7.651Cu15.302Er7.651O54.09334353481255,Ba-Co-Cu-Er-O,5,Supercon,Er1Ba2Cu2Co1O7.07,MP-mp-1214699,Ba2Er1Co1Cu2O7,Ba-Co-Cu-Er-O,Ba15.385Co7.692Cu15.385Er7.692O53.84615384615385,P m m m,orthorhombic,3.864579,3.922106,11.80339,data/final/MP/cifs/Ba2Co1Cu2Er1O7.07-MP-mp-1214699-synth_doped.cif,data/source/MP/raw/cifs/mp-1214699.cif,mp-1214699,0.0,,2019-01-12 16:29:55.440000,6.867739358698149,,,{'GGA+U': {'task_id': 'mp-1733232'}},0.0403327442307697,3.34082261,520.0,-80.92409095,-6.224930073076923,"{'tags': ['Ba2Cu2(Cu0.89Al0.11)YO7', 'Ba2Cu2ErCoO7', 'high-Tc cuprate family']}",-80.92409095,-6.224930073076923,-2.232536331538461,[],False,[],True,2021-05-12 11:00:37.845000,FM,13,4,mp-1214699,oxide,Ba2ErCoCu2O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Er_3', 'Co', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Er': 1.0, 'Co': 1.0, 'Cu': 2.0, 'O': 7.0}",GGA+U,mp-1214699,"['mp-1214699', 'mp-1406876', 'mp-1733232', 'mp-1789809']",2.2308477,"{'Ba': 2.0, 'Er': 1.0, 'Co': 1.0, 'Cu': 2.0, 'O': 7.0}",178.90738731177183,[],FM,True,47,1,"[0.0, 0.0, 0.0, 2.1, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0124692877891756,2.2308477,1,2.2308477,MP,data/source/MP/cleaned/cifs/MP-mp-1214699.cif,True,,data/final/MP/graphs/Ba2Co1Cu2Er1O7.07-MP-mp-1214699-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Si1U3,1,0.0,2.0,False,Si2U6,Si2U6,0.0,Heavy_fermion,True,Si25U75,Si-U,2,Supercon,Si1U3,MP-mp-956,U6Si2,Si-U,Si25U75,I 4/m c m,tetragonal,6.000787899780198,6.0007879,6.0007879,data/final/MP/cifs/Si1U3-MP-mp-956.cif,data/source/MP/raw/cifs/mp-956.cif,mp-956,0.0,,2011-05-14 09:08:57,16.09933598629275,10.17188/1282229,"@misc{osti_1282229,
    author = ""Persson, Kristin"",
    title = ""Materials Data on U3Si (SG:0) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1282229"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699741'}},0.0,13.62952791,520.0,-80.54954618,-10.0686932725,"{'tags': ['Uranium silicide (3/1) - low temperature', 'Uranium silicide (3/1)']}",-80.54954618,-10.0686932725,-0.2260572599999992,"['xas', 'elasticity', 'bandstructure']",True,"[652468, 657097, 41561, 1890, 654561, 69199]",True,2021-05-12 10:56:35.166000,NM,8,15,mp-956,,U3Si,"{'functional': 'PBE', 'labels': ['U', 'Si'], 'pot_type': 'paw'}","{'U': 3.0, 'Si': 1.0}",GGA,mp-956,"['mp-574058', 'mp-1007044', 'mp-1000570', 'mp-956', 'mp-1078496', 'mp-1078681', 'mp-1080690', 'mp-1087529', 'mp-1125040', 'mp-1132720', 'mp-1414635', 'mp-1699741', 'mp-1926315', 'mp-1011781', 'mp-1587355']",0.0311213,"{'U': 6.0, 'Si': 2.0}",153.10022514095388,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0004065480631572,0.0311213,0,0.0622426,MP,data/source/MP/cleaned/cifs/MP-mp-956.cif,False,,data/final/MP/graphs/Si1U3-MP-mp-956.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As2Cs1Fe2,1,0.0,1.0,True,As2Cs1Fe2,As2Cs1Fe2,2.08,Ferrite,True,As40Cs20Fe40,As-Cs-Fe,3,Supercon,Cs1Fe2As2,MP-mp-28884,Cs1Fe2As2,As-Cs-Fe,As40Cs20Fe40,I 4/m m m,tetragonal,3.798310001233126,3.798310001233126,8.174365759999999,data/final/MP/cifs/As2Cs1Fe2-MP-mp-28884.cif,data/source/MP/raw/cifs/mp-28884.cif,mp-28884,0.0,,2014-02-25 21:24:48,5.880311017592191,10.17188/1202962,"@misc{osti_1202962,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Cs(FeAs)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1202962"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699866'}},0.0,4.01492755,520.0,-28.47042276,-5.6940845520000005,{'tags': ['Cesium iron arsenide (1/2/2)']},-28.47042276,-5.6940845520000005,-0.2633533355862077,"['xas', 'elasticity', 'bandstructure']",True,[74877],True,2021-05-12 10:56:18.721000,FM,5,6,mp-28884,,Cs(FeAs)2,"{'functional': 'PBE', 'labels': ['Cs_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Cs': 1.0, 'Fe': 2.0, 'As': 2.0}",GGA,mp-28884,"['mp-505188', 'mp-28884', 'mp-1434118', 'mp-1699866', 'mp-1803203', 'mp-1589595']",1.4350623,"{'Cs': 1.0, 'Fe': 2.0, 'As': 2.0}",111.38539932623888,[],FM,True,139,1,"[0.0, 0.9, 0.9, 0.0, 0.0]",0.012883755938216,1.4350623,2,1.4350623,MP,data/source/MP/cleaned/cifs/MP-mp-28884.cif,False,,data/final/MP/graphs/As2Cs1Fe2-MP-mp-28884.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Hf0.34Mo0.66,2,0.0133333333333333,6.0,False,Hf2.04Mo3.96,Hf2Mo4,1.0,Other,True,Hf34Mo66,Hf-Mo,2,Supercon,Hf0.34Mo0.66,MP-mp-2363,Hf2Mo4,Hf-Mo,Hf33.333Mo66.667,F d -3 m,cubic,5.363400690000001,5.36340069,5.36340069,data/final/MP/cifs/Hf0.34Mo0.66-MP-mp-2363-synth_doped.cif,data/source/MP/raw/cifs/mp-2363.cif,mp-2363,0.0,,2011-05-13 13:35:34,11.274808163534129,10.17188/1199626,"@misc{osti_1199626,
    author = ""Persson, Kristin"",
    title = ""Materials Data on HfMo2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199626"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-930018'}},0.0,6.52746893,520.0,-64.32233909,-10.720389848333332,{'tags': ['Hafnium molybdenum (1/2)']},-64.32233909,-10.720389848333332,-0.1708982116666675,"['xas', 'elasticity', 'bandstructure']",True,"[638612, 104216, 638607, 638619, 104217, 638621]",True,2021-05-12 10:56:16.728000,NM,6,7,mp-2363,,HfMo2,"{'functional': 'PBE', 'labels': ['Hf_pv', 'Mo_pv'], 'pot_type': 'paw'}","{'Hf': 1.0, 'Mo': 2.0}",GGA,mp-2363,"['mp-913706', 'mp-930018', 'mp-930539', 'mp-2363', 'mp-1437600', 'mp-1805163', 'mp-1591067']",2.265e-05,"{'Hf': 2.0, 'Mo': 4.0}",109.0952227614423,[],NM,False,166,0,"[0.0, 0.0, 0.0, 0.0, -0.0, 0.0]",4.152335808420977e-07,2.265e-05,0,4.53e-05,MP,data/source/MP/cleaned/cifs/MP-mp-2363.cif,True,,data/final/MP/graphs/Hf0.34Mo0.66-MP-mp-2363-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
C2Y1,3,0.1333333333333334,6.0,False,C12Y6,C12Y8,3.895428571,Carbon,True,C66.667Y33.333,C-Y,2,Supercon,C2Y1,MP-mp-1695,Y8C12,C-Y,C60Y40,I -4 3 d,cubic,7.157130121586623,7.15713012,7.157130119999999,data/final/MP/cifs/C2Y1-MP-mp-1695-synth_doped.cif,data/source/MP/raw/cifs/mp-1695.cif,mp-1695,0.0,,2011-05-15 19:04:09,5.032814278610675,10.17188/1192250,"@misc{osti_1192250,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Y2C3 (SG:220) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1192250"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1669276'}},0.0442951846600028,5.37066524,520.0,-167.58612106,-8.379306053,{'tags': ['Yttrium carbide (2/3)']},-167.58612106,-8.379306053,-0.256649187666666,"['xas', 'elasticity', 'bandstructure']",True,"[155382, 77572, 619114, 601153, 155383]",True,2021-05-12 10:56:14.760000,NM,20,8,mp-1695,,Y2C3,"{'functional': 'PBE', 'labels': ['Y_sv', 'C'], 'pot_type': 'paw'}","{'Y': 2.0, 'C': 3.0}",GGA,mp-1695,"['mp-927691', 'mp-927238', 'mp-911194', 'mp-1695', 'mp-1425550', 'mp-1669276', 'mp-1872240', 'mp-1598231']",0.0001762,"{'Y': 8.0, 'C': 12.0}",282.22458798795367,[],NM,False,220,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.497301900676646e-06,0.0001762,0,0.0007048,MP,data/source/MP/cleaned/cifs/MP-mp-1695.cif,True,,data/final/MP/graphs/C2Y1-MP-mp-1695-synth_doped.json,0,True,-43m,5,0,0,0,0,0,0,0,0,1,0,1.0,False
C1K1,1,0.0,8.0,False,C8K8,C8K8,0.55,Other,True,C50K50,C-K,2,Supercon,C1K1,MP-mp-243,K8C8,C-K,C50K50,I 41/a c d,tetragonal,7.66554800210324,7.665548002103241,9.1164737,data/final/MP/cifs/C1K1-MP-mp-243.cif,data/source/MP/raw/cifs/mp-243.cif,mp-243,3.3007,,2011-05-14 20:13:35,1.5763132409708716,10.17188/1200022,"@misc{osti_1200022,
    author = ""Persson, Kristin"",
    title = ""Materials Data on KC (SG:142) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1200022"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1669249'}},0.2685206680625001,-0.99758353,520.0,-78.72915517,-4.920572198125,{'tags': ['Potassium carbide (2/2)']},-78.72915517,-4.920572198125,0.2480176253750006,"['xas', 'bandstructure']",True,"[89529, 89528, 36142, 89530]",True,2021-05-12 10:57:01.079000,NM,16,9,mp-243,,KC,"{'functional': 'PBE', 'labels': ['K_sv', 'C'], 'pot_type': 'paw'}","{'K': 1.0, 'C': 1.0}",GGA,mp-243,"['mp-670866', 'mp-661336', 'mp-660614', 'mp-243', 'mp-570519', 'mp-1475492', 'mp-1669249', 'mp-1820903', 'mp-1605012']",5.08e-05,"{'K': 8.0, 'C': 8.0}",430.7189152459967,[],NM,False,142,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",9.435387804315316e-07,5.08e-05,0,0.0004064,MP,data/source/MP/cleaned/cifs/MP-mp-243.cif,False,,data/final/MP/graphs/C1K1-MP-mp-243.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As1Cu3,1,0.0,8.0,False,As8Cu24,As8Cu24,0.0,Other,True,As25Cu75,As-Cu,2,Supercon,As1Cu3,MP-mp-1966,Cu24As8,As-Cu,As25Cu75,I -4 3 d,cubic,8.354585181852082,8.35458518,8.35458518,data/final/MP/cifs/As1Cu3-MP-mp-1966.cif,data/source/MP/raw/cifs/mp-1966.cif,mp-1966,0.0,,2011-08-12 12:54:56,7.85865652973913,10.17188/1194869,"@misc{osti_1194869,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Cu3As (SG:220) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1194869"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1757645'}},0.0233216734374996,6.50220391,520.0,-134.90761377,-4.2158629303125,"{'tags': ['Domeykite', 'Domeykite low', 'Copper arsenide (3/1)', 'Copper(I) arsenide']}",-134.90761377,-4.2158629303125,0.0233216734374996,"['xas', 'bandstructure']",True,"[100149, 64715, 655109]",True,2021-05-12 10:56:57.051000,NM,32,9,mp-1966,,Cu3As,"{'functional': 'PBE', 'labels': ['Cu_pv', 'As'], 'pot_type': 'paw'}","{'Cu': 3.0, 'As': 1.0}",GGA,mp-1966,"['mp-907914', 'mp-923219', 'mp-922439', 'mp-1966', 'mp-1115967', 'mp-1444114', 'mp-1757645', 'mp-1822240', 'mp-1620248']",0.0095807125,"{'Cu': 24.0, 'As': 8.0}",448.90328380370886,[],NM,False,220,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0001707398960207,0.0095807125,0,0.0766457,MP,data/source/MP/cleaned/cifs/MP-mp-1966.cif,False,,data/final/MP/graphs/As1Cu3-MP-mp-1966.json,0,True,-43m,5,0,0,0,0,0,0,0,0,1,0,1.0,False
Al3Gd0.01Pd2U0.99,2,0.0033333333333333,1.0,True,Al3Gd0.01Pd2U0.99,Al3Pd2U1,1.16,Heavy_fermion,True,Al50Gd0.167Pd33.333U16.5,Al-Gd-Pd-U,4,Supercon,U0.99Gd0.01Pd2Al3,MP-mp-4561,U1Al3Pd2,Al-Pd-U,Al50Pd33.333U16.667,P 6/m m m,hexagonal,4.239652,5.384229999094356,5.3842309,data/final/MP/cifs/Al3Gd0.01Pd2U0.99-MP-mp-4561-synth_doped.cif,data/source/MP/raw/cifs/mp-4561.cif,mp-4561,0.0,,2011-05-12 23:59:10,8.296603403902926,10.17188/1208253,"@misc{osti_1208253,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UAl3Pd2 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208253"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700804'}},0.0796314472916668,8.0468212,520.0,-36.36476907,-6.060794845,"{'tags': ['Aluminium palladium uranium (3/2/1)', 'Aluminum palladium uranium (3/2/1)']}",-36.36476907,-6.060794845,-0.5794779916666665,"['xas', 'elasticity', 'bandstructure']",True,"[657574, 106242, 659234]",True,2021-05-12 10:56:20.740000,FM,6,9,mp-4561,,UAl3Pd2,"{'functional': 'PBE', 'labels': ['U', 'Al', 'Pd'], 'pot_type': 'paw'}","{'U': 1.0, 'Al': 3.0, 'Pd': 2.0}",GGA,mp-4561,"['mp-4561', 'mp-991619', 'mp-993538', 'mp-1251974', 'mp-1441898', 'mp-1700804', 'mp-1933710', 'mp-994863', 'mp-1593816']",2.2050571,"{'U': 1.0, 'Al': 3.0, 'Pd': 2.0}",106.4408038742404,[],FM,True,191,1,"[2.2, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0207162762750765,2.2050571,1,2.2050571,MP,data/source/MP/cleaned/cifs/MP-mp-4561.cif,True,,data/final/MP/graphs/Al3Gd0.01Pd2U0.99-MP-mp-4561-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Cu1La1.937Sr0.063O4,2,0.0179999999999999,1.0,True,Cu1La1.937Sr0.063O4,Cu1La2O4,11.7,Cuprate,True,Cu14.286La27.671Sr0.9O57.142857142857146,Cu-La-Sr-O,4,Supercon,La1.937Sr0.063Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La1.937Sr0.063O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La1.937Sr0.063O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Mo0.03Si1V2.97,2,0.0149999999999999,2.0,False,Mo0.06Si2V5.94,Si2V6,16.0,Other,True,Mo0.75Si25V74.25,Mo-Si-V,3,Supercon,V2.97Mo0.03Si1,MP-mp-2567,V6Si2,Si-V,Si25V75,P m -3 n,cubic,4.702381,4.702381,4.702381,data/final/MP/cifs/Mo0.03Si1V2.97-MP-mp-2567-synth_doped.cif,data/source/MP/raw/cifs/mp-2567.cif,mp-2567,0.0,,2011-05-13 19:15:43,5.778142190030859,10.17188/1200874,"@misc{osti_1200874,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Si (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1200874"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668672'}},0.0,7.30599425,520.0,-69.05773321,-8.63221665125,{'tags': ['Vanadium silicide (3/1)']},-69.05773321,-8.63221665125,-0.4452085937499994,"['xas', 'elasticity', 'bandstructure']",True,"[652491, 87328, 652522, 652502, 652510, 652520, 600518, 186003, 652507, 652513, 652497, 601150, 652514, 652487, 22412, 652509, 652529, 652532, 652499, 652539, 652537, 652533, 652512, 652538, 652490, 652493, 652494, 652511, 652519, 87329, 652526, 652500]",True,2021-05-12 10:56:18.721000,FM,8,13,mp-2567,,V3Si,"{'functional': 'PBE', 'labels': ['V_pv', 'Si'], 'pot_type': 'paw'}","{'V': 3.0, 'Si': 1.0}",GGA,mp-2567,"['mp-920081', 'mp-906309', 'mp-919083', 'mp-2567', 'mp-1078474', 'mp-1078852', 'mp-1138781', 'mp-1145907', 'mp-1440678', 'mp-1668672', 'mp-1795955', 'mp-1593554', 'mp-1596575']",0.8382519,"{'V': 6.0, 'Si': 2.0}",103.98086881866836,[],FM,True,131,1,"[0.2, 0.3, 0.3, 0.2, 0.3, 0.3, 0.0, 0.0]",0.0161231947669493,0.8382519,6,1.6765038,MP,data/source/MP/cleaned/cifs/MP-mp-2567.cif,True,,data/final/MP/graphs/Mo0.03Si1V2.97-MP-mp-2567-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Cu0.78Ir2S4Zn0.22,3,0.0628571428571428,2.0,False,Cu1.56Ir4S8Zn0.44,Cu2Ir4S8,3.3,Other,True,Cu11.143Ir28.571S57.143Zn3.143,Cu-Ir-S-Zn,4,Supercon,Cu0.78Zn0.22Ir2S4,MP-mp-15065,Cu2Ir4S8,Cu-Ir-S,Cu14.286Ir28.571S57.143,F d -3 m,cubic,7.0146421,7.014642099999999,7.0146421,data/final/MP/cifs/Cu0.78Ir2S4Zn0.22-MP-mp-15065-synth_doped.cif,data/source/MP/raw/cifs/mp-15065.cif,mp-15065,0.0,,2011-06-03 14:22:46,7.841171261871164,10.17188/1191009,"@misc{osti_1191009,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Cu(IrS2)2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191009"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703593'}},0.0,5.93564872,520.0,-81.88317445,-5.848798175,"{'tags': ['Cuproiridsite', 'Copper tetrathiodiiridate(III)']}",-81.88317445,-5.848798175,-0.6616743210714284,"['xas', 'bandstructure']",True,[75531],True,2021-05-12 10:56:53.126000,NM,14,11,mp-15065,,Cu(IrS2)2,"{'functional': 'PBE', 'labels': ['Cu_pv', 'Ir', 'S'], 'pot_type': 'paw'}","{'Cu': 1.0, 'Ir': 2.0, 'S': 4.0}",GGA,mp-15065,"['mp-923885', 'mp-924531', 'mp-908944', 'mp-22362', 'mp-15065', 'mp-1104143', 'mp-1104190', 'mp-1419385', 'mp-1703593', 'mp-1882020', 'mp-1598621']",0.00084405,"{'Cu': 2.0, 'Ir': 4.0, 'S': 8.0}",244.06278087318373,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.916662974831648e-06,0.00084405,0,0.0016881,MP,data/source/MP/cleaned/cifs/MP-mp-15065.cif,True,,data/final/MP/graphs/Cu0.78Ir2S4Zn0.22-MP-mp-15065-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Cu1Eu0.2La1.8O4,3,0.0571428571428571,1.0,True,Cu1Eu0.2La1.8O4,Cu1La2O4,0.0,Cuprate,True,Cu14.286Eu2.857La25.714O57.142857142857146,Cu-Eu-La-O,4,Supercon,La1.8Eu0.2Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1Eu0.2La1.8O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1Eu0.2La1.8O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Er0.1Pd2Sn1Y0.9,2,0.0499999999999999,1.0,True,Er0.1Pd2Sn1Y0.9,Pd2Sn1Y1,3.87,Other,True,Er2.5Pd50Sn25Y22.5,Er-Pd-Sn-Y,4,Supercon,Pd2Y0.9Er0.1Sn1,MP-mp-5538,Y1Sn1Pd2,Pd-Sn-Y,Pd50Sn25Y25,F m -3 m,cubic,4.81595014,4.81595014,4.81595014,data/final/MP/cifs/Er0.1Pd2Sn1Y0.9-MP-mp-5538-synth_doped.cif,data/source/MP/raw/cifs/mp-5538.cif,mp-5538,0.0,,2011-05-13 01:04:13,8.839720826473608,10.17188/1267618,"@misc{osti_1267618,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YSnPd2 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1267618"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687523'}},0.0,6.33853657,520.0,-24.32859047,-6.0821476175,"{'tags': ['Palladium yttrium stannide (2/1/1)', 'Palladium tin yttrium (2/1/1)']}",-24.32859047,-6.0821476175,-0.873195970416667,"['xas', 'elasticity', 'bandstructure']",True,"[105699, 648949, 105700, 424011, 648950]",True,2021-05-12 10:56:22.739000,NM,4,12,mp-5538,,YSnPd2,"{'functional': 'PBE', 'labels': ['Y_sv', 'Sn_d', 'Pd'], 'pot_type': 'paw'}","{'Y': 1.0, 'Sn': 1.0, 'Pd': 2.0}",GGA,mp-5538,"['mp-1008093', 'mp-1001657', 'mp-5538', 'mp-1065654', 'mp-1065644', 'mp-1065683', 'mp-1439031', 'mp-1687523', 'mp-1801498', 'mp-1012418', 'mp-1593849', 'mp-1065696']",0.0001592,"{'Y': 1.0, 'Sn': 1.0, 'Pd': 2.0}",78.98251295612837,[],NM,False,225,0,"[0, 0, 0, 0]",2.015636044505563e-06,0.0001592,0,0.0001592,MP,data/source/MP/cleaned/cifs/MP-mp-5538.cif,True,,data/final/MP/graphs/Er0.1Pd2Sn1Y0.9-MP-mp-5538-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Fe3Si5Yb2,1,0.0,4.0,False,Fe12Si20Yb8,Fe12Si20Yb8,0.0,Heavy_fermion,True,Fe30Si50Yb20,Fe-Si-Yb,3,Supercon,Yb2Fe3Si5,MP-mp-1198337,Yb8Fe12Si20,Fe-Si-Yb,Fe30Si50Yb20,P 4/m n c,tetragonal,5.459556,10.424793,10.424793,data/final/MP/cifs/Fe3Si5Yb2-MP-mp-1198337.cif,data/source/MP/raw/cifs/mp-1198337.cif,mp-1198337,0.0,,2019-01-12 03:08:26.246000,7.321884156118635,,,,0.0008730279999999,6.39317326,520.0,-243.52881515,-6.08822037875,"{'tags': ['U2Mn3Si5', 'Ytterbium iron silicide (2/3/5)', 'Yb2Fe3Si5']}",-243.52881515,-6.08822037875,-0.4911391777500007,[],False,[633661],True,2021-05-12 11:00:03.538000,FM,40,3,mp-1198337,,Yb2Fe3Si5,"{'functional': 'PBE', 'labels': ['Yb_2', 'Fe_pv', 'Si'], 'pot_type': 'paw'}","{'Yb': 2.0, 'Fe': 3.0, 'Si': 5.0}",GGA,mp-1198337,"['mp-1198337', 'mp-1330709', 'mp-1892963']",0.4199115,"{'Yb': 8.0, 'Fe': 12.0, 'Si': 20.0}",593.3243953657183,[],FM,True,128,2,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.2, 0.2, 0.2, 0.2, 0.2, 0.2, 0.2, 0.2, 0.4, 0.4, 0.4, 0.4, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0028309066896949,0.4199115,12,1.679646,MP,data/source/MP/cleaned/cifs/MP-mp-1198337.cif,False,,data/final/MP/graphs/Fe3Si5Yb2-MP-mp-1198337.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ba2Ca0.15Cu4Y0.85O8,2,0.02,1.0,True,Ba2Ca0.15Cu4Y0.85O8,Ba2Cu4Y1O8,88.9,Cuprate,True,Ba13.333Ca1Cu26.667Y5.667O53.333333333333336,Ba-Ca-Cu-Y-O,5,Supercon,Y0.85Ca0.15Ba2Cu4O8,MP-mp-6790,Ba2Y1Cu4O8,Ba-Cu-Y-O,Ba13.333Cu26.667Y6.667O53.333333333333336,C m m m,orthorhombic,3.889922,3.899603999537882,13.88942687,data/final/MP/cifs/Ba2Ca0.15Cu4Y0.85O8-MP-mp-6790-synth_doped.cif,data/source/MP/raw/cifs/mp-6790.cif,mp-6790,0.0,,2011-05-16 03:21:24,5.936250568336678,10.17188/1283441,"@misc{osti_1283441,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Y(CuO2)4 (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1283441"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686864'}},0.0,3.31391536,520.0,-91.58381472,-6.105587648,"{'tags': ['Yttrium barium copper oxide (1/2/4/8)', 'High pressure experimental phase']}",-91.58381472,-6.105587648,-2.0529924817777783,"['xas', 'bandstructure']",True,"[72261, 85273, 74251, 400273, 85277, 85275, 400280, 67632, 85272, 67631, 83920, 66613, 85279, 400277, 75689, 74259, 85278, 85280, 66603, 94265, 400276, 88873, 71417, 75712, 97052, 66605, 72258, 85281, 85274, 400279, 66604, 69698]",True,2021-05-12 10:57:34.594000,NM,15,10,mp-6790,oxide,Ba2Y(CuO2)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-6790,"['mp-1000664', 'mp-6790', 'mp-1007136', 'mp-1237713', 'mp-1440937', 'mp-1686864', 'mp-1834179', 'mp-1011883', 'mp-1590064', 'mp-1590433']",0.0004643,"{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",208.60454115924333,[],NM,False,65,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.225742533790601e-06,0.0004643,0,0.0004643,MP,data/source/MP/cleaned/cifs/MP-mp-6790.cif,True,,data/final/MP/graphs/Ba2Ca0.15Cu4Y0.85O8-MP-mp-6790-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ba2Ca2Cu3Tl2O10,1,0.0,1.0,True,Ba2Ca2Cu3Tl2O10,Ba2Ca2Cu3Tl2O10,118.975,Cuprate,True,Ba10.526Ca10.526Cu15.789Tl10.526O52.631578947368425,Ba-Ca-Cu-Tl-O,5,Supercon,Tl2Ca2Ba2Cu3O10,MP-mp-1228620,Ba2Ca2Tl2Cu3O10,Ba-Ca-Cu-Tl-O,Ba10.526Ca10.526Cu15.789Tl10.526O52.631578947368425,I m m 2,orthorhombic,3.879983,3.894882,18.58130498978468,data/final/MP/cifs/Ba2Ca2Cu3Tl2O10-MP-mp-1228620.cif,data/source/MP/raw/cifs/mp-1228620.cif,mp-1228620,0.0,,2019-01-13 04:18:41.003000,6.662240214169086,,,,0.0064522815789507,4.23680995,520.0,-104.31950535,-5.490500281578948,{'tags': []},-104.31950535,-5.490500281578948,-1.9388340829824569,[],False,[],True,2021-05-12 11:00:59.151000,NM,19,2,mp-1228620,oxide,Ba2Ca2Tl2Cu3O10,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ca_sv', 'Tl_d', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Ca': 2.0, 'Tl': 2.0, 'Cu': 3.0, 'O': 10.0}",GGA,mp-1228620,"['mp-1228620', 'mp-1923508']",0.002528,"{'Ba': 2.0, 'Ca': 2.0, 'Tl': 2.0, 'Cu': 3.0, 'O': 10.0}",277.71242842711695,[],NM,False,8,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, 0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",9.102941536746707e-06,0.002528,0,0.002528,MP,data/source/MP/cleaned/cifs/MP-mp-1228620.cif,False,,data/final/MP/graphs/Ba2Ca2Cu3Tl2O10-MP-mp-1228620.json,0,True,mm2,0,0,0,6,0,0,0,0,0,1,0,1.0,False
Al1Nb2.94Ta0.06,2,0.03,2.0,False,Al2Nb5.88Ta0.12,Al2Nb6,17.7,Other,True,Al25Nb73.5Ta1.5,Al-Nb-Ta,3,Supercon,Nb2.94Ta0.06Al1,MP-mp-796,Nb6Al2,Al-Nb,Al25Nb75,P m -3 n,cubic,5.215254,5.215254,5.215254,data/final/MP/cifs/Al1Nb2.94Ta0.06-MP-mp-796-synth_doped.cif,data/source/MP/raw/cifs/mp-796.cif,mp-796,0.0,,2011-05-13 16:07:37,7.157298025966356,,,{'GGA': {'task_id': 'mp-1686893'}},0.0460773865000003,5.52947534,520.0,-69.48918494,-8.6861481175,"{'tags': ['Aluminium niobium (1/3)', 'Niobium aluminide (3/1)', 'Aluminum niobium (1/3)']}",-69.48918494,-8.6861481175,-0.1737753800000003,"['bandstructure', 'elasticity']",True,"[608675, 608654, 608688, 608668, 608669, 608685, 608676, 608683, 58014, 608657, 107856, 608655, 608666, 608691, 608656, 608665, 608673, 608653, 608661]",True,2021-05-12 10:56:31.128000,NM,8,10,mp-796,,Nb3Al,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Al': 1.0}",GGA,mp-796,"['mp-911586', 'mp-927906', 'mp-796', 'mp-927472', 'mp-1260512', 'mp-1440919', 'mp-1686893', 'mp-1927652', 'mp-1591599', 'mp-1587739']",0.16323955,"{'Nb': 6.0, 'Al': 2.0}",141.8490379078192,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0023015954483396,0.16323955,0,0.3264791,MP,data/source/MP/cleaned/cifs/MP-mp-796.cif,True,,data/final/MP/graphs/Al1Nb2.94Ta0.06-MP-mp-796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Nb2.7Sn1Ta0.3,3,0.1499999999999999,2.0,False,Nb5.4Sn2Ta0.6,Nb6Sn2,18.0,Other,True,Nb67.5Sn25Ta7.5,Nb-Sn-Ta,3,Supercon,Nb2.7Ta0.3Sn1,MP-mp-1326,Nb6Sn2,Nb-Sn,Nb75Sn25,P m -3 n,cubic,5.334611,5.334611,5.334611,data/final/MP/cifs/Nb2.7Sn1Ta0.3-MP-mp-1326-synth_doped.cif,data/source/MP/raw/cifs/mp-1326.cif,mp-1326,0.0,,2011-05-14 09:51:48,8.694218121896231,10.17188/1189484,"@misc{osti_1189484,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Sn (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189484"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668415'}},0.0,6.59372491,520.0,-69.93787048,-8.74223381,{'tags': ['Niobium tin (3/1)']},-69.93787048,-8.74223381,-0.163862066250001,"['xas', 'elasticity', 'bandstructure']",True,"[105230, 645503, 645489, 105231, 645498, 645485, 645474, 645496, 645480, 645488, 645482, 645487, 645500, 645493, 645477, 645484, 645502, 645483, 150878, 645479, 645481, 645486, 645473]",True,2021-05-12 10:56:12.755000,NM,8,9,mp-1326,,Nb3Sn,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Sn_d'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Sn': 1.0}",GGA,mp-1326,"['mp-930046', 'mp-913770', 'mp-930577', 'mp-1326', 'mp-1440651', 'mp-1668415', 'mp-1880085', 'mp-1594093', 'mp-1594507']",0.62023085,"{'Nb': 6.0, 'Sn': 2.0}",151.81275738025872,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0081709977567491,0.62023085,0,1.2404617,MP,data/source/MP/cleaned/cifs/MP-mp-1326.cif,True,,data/final/MP/graphs/Nb2.7Sn1Ta0.3-MP-mp-1326-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Cu0.04Ru0.96Sr2Y1O6,2,0.008,2.0,False,Cu0.08Ru1.92Sr4Y2O12,Ru2Sr4Y2O12,5.1,Cuprate,True,Cu0.4Ru9.6Sr20Y10O60,Cu-Ru-Sr-Y-O,5,Supercon,Sr2Y1Ru0.96Cu0.04O6,MP-mp-14430,Sr4Y2Ru2O12,Ru-Sr-Y-O,Ru10Sr20Y10O60,P 1 21/c 1,monoclinic,5.816658,5.885394,8.254861792272742,data/final/MP/cifs/Cu0.04Ru0.96Sr2Y1O6-MP-mp-14430-synth_doped.cif,data/source/MP/raw/cifs/mp-14430.cif,mp-14430,0.0,,2011-06-07 07:34:15,5.420400820723878,10.17188/1190674,"@misc{osti_1190674,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr2YRuO6 (SG:14) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1190674"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1669873'}},0.0,3.25749146,520.0,-146.31379286,-7.315689643000001,"{'tags': ['Distrontium yttrium ruthenium(V) oxide', 'Distrontium yttrium ruthenium hexaoxide']}",-146.31379286,-7.315689643000001,-2.847128272500001,"['xas', 'bandstructure']",True,"[192766, 49500]",True,2021-05-12 10:56:53.126000,FM,20,10,mp-14430,oxide,Sr2YRuO6,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Y_sv', 'Ru_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Y': 1.0, 'Ru': 1.0, 'O': 6.0}",GGA,mp-14430,"['mp-923119', 'mp-922143', 'mp-917338', 'mp-14430', 'mp-1106028', 'mp-1236895', 'mp-1431640', 'mp-1669873', 'mp-1931083', 'mp-1608013']",2.9996044,"{'Sr': 4.0, 'Y': 2.0, 'Ru': 2.0, 'O': 12.0}",282.584622226224,[],FM,True,14,1,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 2.0, 2.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0212297780138839,2.9996044,2,5.9992088,MP,data/source/MP/cleaned/cifs/MP-mp-14430.cif,True,,data/final/MP/graphs/Cu0.04Ru0.96Sr2Y1O6-MP-mp-14430-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,1,0,0,0,1.0,False
Dy1Fe2Ge2,1,0.0,1.0,True,Dy1Fe2Ge2,Dy1Fe2Ge2,0.0,Other,True,Dy20Fe40Ge40,Dy-Fe-Ge,3,Supercon,Dy1Fe2Ge2,MP-mp-21426,Dy1Fe2Ge2,Dy-Fe-Ge,Dy20Fe40Ge40,I 4/m m m,tetragonal,3.977118000856088,3.977118000856088,5.81413461,data/final/MP/cifs/Dy1Fe2Ge2-MP-mp-21426.cif,data/source/MP/raw/cifs/mp-21426.cif,mp-21426,0.0,,2014-02-21 10:15:51,8.65369348275188,10.17188/1196883,"@misc{osti_1196883,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Dy(FeGe)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196883"",
    place = ""United States"",
    year = ""2016"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695081'}},0.0,4.81431429,520.0,-33.07682046,-6.615364092,"{'tags': ['Dysprosium iron germanium (1/2/2)', 'Dysprosium iron germanide (1/2/2)']}",-33.07682046,-6.615364092,-0.4567922019999997,"['xas', 'bandstructure']",True,"[629622, 103175, 84173]",True,2021-05-12 10:56:59.077000,FM,5,8,mp-21426,,Dy(FeGe)2,"{'functional': 'PBE', 'labels': ['Dy_3', 'Fe_pv', 'Ge_d'], 'pot_type': 'paw'}","{'Dy': 1.0, 'Fe': 2.0, 'Ge': 2.0}",GGA,mp-21426,"['mp-992871', 'mp-990842', 'mp-21426', 'mp-1438716', 'mp-1695081', 'mp-1799201', 'mp-994193', 'mp-1593951']",1.6877192,"{'Dy': 1.0, 'Fe': 2.0, 'Ge': 2.0}",80.49121726520869,[],FM,True,139,1,"[-0.0, 0.9, 0.9, 0.0, 0.0]",0.0209677435295725,1.6877192,2,1.6877192,MP,data/source/MP/cleaned/cifs/MP-mp-21426.cif,False,,data/final/MP/graphs/Dy1Fe2Ge2-MP-mp-21426.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Be22Re0.95W0.05,2,0.0043478260869565,2.0,False,Be44Re1.9W0.1,Be44Re2,9.45,Other,True,Be95.652Re4.13W0.217,Be-Re-W,3,Supercon,Be22Re0.95W0.05,MP-mp-569364,Be44Re2,Be-Re,Be95.652Re4.348,F d -3 m,cubic,8.13033498,8.13033498,8.13033498,data/final/MP/cifs/Be22Re0.95W0.05-MP-mp-569364-synth_doped.cif,data/source/MP/raw/cifs/mp-569364.cif,mp-569364,0.0,,2014-02-18 16:00:38,3.359981469520108,10.17188/1275060,"@misc{osti_1275060,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Be22Re (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1275060"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1729467'}},0.0,5.02493221,520.0,-192.40958206,-4.182817001304348,"{'tags': ['Rhenium beryllium (1/22)', 'Beryllium rhenium (22/1)']}",-192.40958206,-4.182817001304348,-0.0649209050000001,"['xas', 'elasticity', 'bandstructure']",True,"[150540, 616399]",True,2021-05-12 10:56:22.739000,NM,46,7,mp-569364,,Be22Re,"{'functional': 'PBE', 'labels': ['Be_sv', 'Re_pv'], 'pot_type': 'paw'}","{'Be': 22.0, 'Re': 1.0}",GGA,mp-569364,"['mp-914535', 'mp-1001401', 'mp-569364', 'mp-1384180', 'mp-1729467', 'mp-1836331', 'mp-1007840']",9.15e-05,"{'Be': 44.0, 'Re': 2.0}",380.0233840958512,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.815493142228399e-07,9.15e-05,0,0.000183,MP,data/source/MP/cleaned/cifs/MP-mp-569364.cif,True,,data/final/MP/graphs/Be22Re0.95W0.05-MP-mp-569364-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
C1Cu11Sr8Y4O28,1,0.0,1.0,True,C1Cu11Sr8Y4O28,C1Cu11Sr8Y4O28,0.0,Cuprate,True,C1.923Cu21.154Sr15.385Y7.692O53.84615384615385,C-Cu-Sr-Y-O,5,Supercon,Y4Sr8Cu11C1O28,MP-mp-1173193,Sr8Y4Cu11C1O28,C-Cu-Sr-Y-O,C1.923Cu21.154Sr15.385Y7.692O53.84615384615385,A m m 2,orthorhombic,3.87579,13.70665416,13.70665416,data/final/MP/cifs/C1Cu11Sr8Y4O28-MP-mp-1173193.cif,data/source/MP/raw/cifs/mp-1173193.cif,mp-1173193,0.0,,2019-01-11 01:26:19.382000,5.459583433676477,,,,0.027804309254809,3.74851445,520.0,-332.03796178,-6.385345418846153,{'tags': []},-332.03796178,-6.385345418846153,-2.28906091326923,[],False,[],True,2021-05-12 10:59:37.456000,NM,52,4,mp-1173193,oxide,Sr8Y4Cu11CO28,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Y_sv', 'Cu_pv', 'C', 'O'], 'pot_type': 'paw'}","{'Sr': 8.0, 'Y': 4.0, 'Cu': 11.0, 'C': 1.0, 'O': 28.0}",GGA,mp-1173193,"['mp-1173193', 'mp-1218721', 'mp-1349855', 'mp-1891566']",0.0033682,"{'Sr': 8.0, 'Y': 4.0, 'Cu': 11.0, 'C': 1.0, 'O': 28.0}",673.8724061368672,[],NM,False,38,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.998275592421127e-06,0.0033682,0,0.0033682,MP,data/source/MP/cleaned/cifs/MP-mp-1173193.cif,False,,data/final/MP/graphs/C1Cu11Sr8Y4O28-MP-mp-1173193.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
B2C1Ce1Rh2,1,0.0,1.0,True,B2C1Ce1Rh2,B2C1Ce1Rh2,0.0,Heavy_fermion,True,B33.333C16.667Ce16.667Rh33.333,B-C-Ce-Rh,4,Supercon,Ce1Rh2B2C1,MP-mp-6191,Ce1B2Rh2C1,B-C-Ce-Rh,B33.333C16.667Ce16.667Rh33.333,I 4/m m m,tetragonal,3.861112000402576,3.861112000402576,5.78775437,data/final/MP/cifs/B2C1Ce1Rh2-MP-mp-6191.cif,data/source/MP/raw/cifs/mp-6191.cif,mp-6191,0.0,,2011-05-13 05:24:52,8.284198290561598,,,{'GGA': {'task_id': 'mp-1698342'}},0.0,7.61393531,520.0,-46.94062407,-7.823437344999999,{'tags': ['Cerium rhodium boride carbide (1/2/2/1)']},-46.94062407,-7.823437344999999,-0.6155591555555553,"['xas', 'bandstructure']",True,"[95097, 150150]",True,2021-05-12 10:57:28.836000,NM,6,8,mp-6191,,CeB2Rh2C,"{'functional': 'PBE', 'labels': ['Ce', 'B', 'Rh_pv', 'C'], 'pot_type': 'paw'}","{'Ce': 1.0, 'B': 2.0, 'Rh': 2.0, 'C': 1.0}",GGA,mp-6191,"['mp-919521', 'mp-917155', 'mp-918524', 'mp-6191', 'mp-1441911', 'mp-1698342', 'mp-1801003', 'mp-1587125']",0.0116138,"{'Ce': 1.0, 'B': 2.0, 'Rh': 2.0, 'C': 1.0}",76.0814369539009,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001526495879282,0.0116138,0,0.0116138,MP,data/source/MP/cleaned/cifs/MP-mp-6191.cif,False,,data/final/MP/graphs/B2C1Ce1Rh2-MP-mp-6191.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ca1Ga1Si1,1,0.0,1.0,True,Ca1Ga1Si1,Ca1Ga1Si1,4.2375,Other,True,Ca33.333Ga33.333Si33.333,Ca-Ga-Si,3,Supercon,Ca1Ga1Si1,MP-mp-1227042,Ca1Ga1Si1,Ca-Ga-Si,Ca33.333Ga33.333Si33.333,P -6 m 2,hexagonal,4.1465960017798045,4.14659559,4.415886,data/final/MP/cifs/Ca1Ga1Si1-MP-mp-1227042.cif,data/source/MP/raw/cifs/mp-1227042.cif,mp-1227042,0.0,,2019-01-13 02:55:48.108000,3.4820817999200977,,,{'GGA': {'task_id': 'mp-1765640'}},0.0067707200000004,4.63147582,520.0,-11.79118587,-3.93039529,{'tags': []},-11.79118587,-3.93039529,-0.4203919825,['bandstructure'],True,[],True,2021-05-12 10:58:45.495000,NM,3,5,mp-1227042,,CaGaSi,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Ga_d', 'Si'], 'pot_type': 'paw'}","{'Ca': 1.0, 'Ga': 1.0, 'Si': 1.0}",GGA,mp-1227042,"['mp-1227042', 'mp-1409280', 'mp-1765640', 'mp-1792240', 'mp-1609418']",0.0016061,"{'Ca': 1.0, 'Ga': 1.0, 'Si': 1.0}",65.75546847061287,[],NM,False,187,0,"[0, 0, 0]",2.442534495389978e-05,0.0016061,0,0.0016061,MP,data/source/MP/cleaned/cifs/MP-mp-1227042.cif,False,,data/final/MP/graphs/Ca1Ga1Si1-MP-mp-1227042.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
C3Sc0.2Th1.8,3,0.0799999999999999,4.0,False,C12Sc0.8Th7.2,C12Th8,6.7,Other,True,C60Sc4Th36,C-Sc-Th,3,Supercon,Th1.8Sc0.2C3,MP-mp-1188514,Th8C12,C-Th,C60Th40,I -4 3 d,cubic,7.414620251643706,7.41462025,7.41462025,data/final/MP/cifs/C3Sc0.2Th1.8-MP-mp-1188514-synth_doped.cif,data/source/MP/raw/cifs/mp-1188514.cif,mp-1188514,0.0,,2019-01-11 19:30:01.530000,10.585910862659652,,,{'GGA': {'task_id': 'mp-1669546'}},0.0,8.12401413,520.0,-175.32363419,-8.7661817095,"{'tags': ['Pu2C3', 'Th2C3 hp', 'Thorium carbide (2/3)']}",-175.32363419,-8.7661817095,-0.2645699894999992,['bandstructure'],True,[618903],True,2021-05-12 10:58:33.577000,NM,20,5,mp-1188514,,Th2C3,"{'functional': 'PBE', 'labels': ['Th', 'C'], 'pot_type': 'paw'}","{'Th': 2.0, 'C': 3.0}",GGA,mp-1188514,"['mp-1188514', 'mp-1415692', 'mp-1669546', 'mp-1811506', 'mp-1605961']",0.000101475,"{'Th': 8.0, 'C': 12.0}",313.7941543668512,[],NM,False,220,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.2935231404134748e-06,0.000101475,0,0.0004059,MP,data/source/MP/cleaned/cifs/MP-mp-1188514.cif,True,,data/final/MP/graphs/C3Sc0.2Th1.8-MP-mp-1188514-synth_doped.json,0,True,-43m,5,0,0,0,0,0,0,0,0,1,0,1.0,False
Ga1Nb4Se8,1,0.0,1.0,True,Ga1Nb4Se8,Ga1Nb4Se8,2.9,Other,True,Ga7.692Nb30.769Se61.538,Ga-Nb-Se,3,Supercon,Ga1Nb4Se8,MP-mp-15208,Nb4Ga1Se8,Ga-Nb-Se,Ga7.692Nb30.769Se61.538,F -4 3 m,cubic,7.46376522,7.463765219999999,7.46376522,data/final/MP/cifs/Ga1Nb4Se8-MP-mp-15208.cif,data/source/MP/raw/cifs/mp-15208.cif,mp-15208,0.0,,2011-06-02 15:25:49,6.060402255958096,10.17188/1191056,"@misc{osti_1191056,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb4GaSe8 (SG:216) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191056"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1670334'}},0.005008535288459,4.0690443,520.0,-81.85331112,-6.296408547692308,"{'tags': ['Gallium tetraniobium octaselenide', 'Gallium octaselenotetraniobate(III/IV)']}",-81.85331112,-6.296408547692308,-1.0945156243269234,['bandstructure'],True,"[195266, 84196]",True,2021-05-12 10:58:49.477000,NM,13,10,mp-15208,,Nb4GaSe8,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Ga_d', 'Se'], 'pot_type': 'paw'}","{'Nb': 4.0, 'Ga': 1.0, 'Se': 8.0}",GGA,mp-15208,"['mp-992018', 'mp-993704', 'mp-15208', 'mp-1103794', 'mp-1115829', 'mp-1431316', 'mp-1670334', 'mp-1813574', 'mp-995016', 'mp-1597642']",0.1048708,"{'Nb': 4.0, 'Ga': 1.0, 'Se': 8.0}",294.0078400380523,[],NM,False,216,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0003566938894773,0.1048708,0,0.1048708,MP,data/source/MP/cleaned/cifs/MP-mp-15208.cif,False,,data/final/MP/graphs/Ga1Nb4Se8-MP-mp-15208.json,0,True,-43m,5,0,0,0,0,0,0,0,0,0,1,1.0,False
C2Ni1Th0.1Y0.9,2,0.0499999999999999,1.0,True,C2Ni1Th0.1Y0.9,C2Ni1Y1,6.005,Other,True,C50Ni25Th2.5Y22.5,C-Ni-Th-Y,4,Supercon,Y0.9Th0.1Ni1C2,MP-mp-1066566,Y1Ni1C2,C-Ni-Y,C50Ni25Y25,A m m 2,orthorhombic,3.602745,3.76432531,3.76432531,data/final/MP/cifs/C2Ni1Th0.1Y0.9-MP-mp-1066566-synth_doped.cif,data/source/MP/raw/cifs/mp-1066566.cif,mp-1066566,0.0,,2018-03-21 19:57:05,5.814059904528103,,,{'GGA': {'task_id': 'mp-1671332'}},0.0,6.53268675,520.0,-32.01396232,-8.00349058,"{'tags': ['YNiC2', 'Yttrium nickel carbide (1/1/2)', 'CeNiC2']}",-32.01396232,-8.00349058,-0.3284482816666658,['bandstructure'],True,"[618597, 618595]",True,2021-05-12 10:58:14.654000,NM,4,12,mp-1066566,,YNiC2,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ni_pv', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ni': 1.0, 'C': 2.0}",GGA,mp-1066566,"['mp-1066566', 'mp-1066591', 'mp-1066663', 'mp-1066963', 'mp-1066912', 'mp-1067057', 'mp-1437809', 'mp-1671332', 'mp-1792644', 'mp-1588942', 'mp-1066615', 'mp-1066986']",0.000243,"{'Y': 1.0, 'Ni': 1.0, 'C': 2.0}",49.0161433903244,[],NM,False,38,0,"[0, 0, 0, 0]",4.957550374066501e-06,0.000243,0,0.000243,MP,data/source/MP/cleaned/cifs/MP-mp-1066566.cif,True,,data/final/MP/graphs/C2Ni1Th0.1Y0.9-MP-mp-1066566-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Ge10Lu5Rh4,1,0.0,2.0,False,Ge20Lu10Rh8,Ge20Lu10Rh8,2.79,Other,True,Ge52.632Lu26.316Rh21.053,Ge-Lu-Rh,3,Supercon,Lu5Rh4Ge10,MP-mp-1197583,Lu10Ge20Rh8,Ge-Lu-Rh,Ge52.632Lu26.316Rh21.053,P 4/m b m,tetragonal,4.212974,13.031801,13.031801,data/final/MP/cifs/Ge10Lu5Rh4-MP-mp-1197583.cif,data/source/MP/raw/cifs/mp-1197583.cif,mp-1197583,0.0,,2019-01-12 02:31:56.390000,9.343172290441483,,,{'GGA': {'task_id': 'mp-1681908'}},0.0,5.91911797,520.0,-225.40841682,-5.931800442631579,"{'tags': ['Lutetium rhodium germanide (5/4/10)', 'Lu5Rh4Ge10', 'Sc5Co4Si10']}",-225.40841682,-5.931800442631579,-0.758523462105263,[],False,[636934],True,2021-05-12 11:00:01.375000,NM,38,3,mp-1197583,,Lu5(Ge5Rh2)2,"{'functional': 'PBE', 'labels': ['Lu_3', 'Ge_d', 'Rh_pv'], 'pot_type': 'paw'}","{'Lu': 5.0, 'Ge': 10.0, 'Rh': 4.0}",GGA,mp-1197583,"['mp-1197583', 'mp-1369566', 'mp-1681908']",0.00019845,"{'Lu': 10.0, 'Ge': 20.0, 'Rh': 8.0}",715.4802630363012,[],NM,False,127,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.547322833416337e-07,0.00019845,0,0.0003969,MP,data/source/MP/cleaned/cifs/MP-mp-1197583.cif,False,,data/final/MP/graphs/Ge10Lu5Rh4-MP-mp-1197583.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Mg24Y5,1,0.0,1.0,True,Mg24Y5,Mg24Y5,0.0,Other,True,Mg82.759Y17.241,Mg-Y,2,Supercon,Mg24Y5,MP-mp-1988,Y5Mg24,Mg-Y,Mg82.759Y17.241,I -4 3 m,cubic,9.7665859021651,9.7665859,9.7665859,data/final/MP/cifs/Mg24Y5-MP-mp-1988.cif,data/source/MP/raw/cifs/mp-1988.cif,mp-1988,0.0,,2011-05-20 21:06:38,2.379973320671373,10.17188/1195069,"@misc{osti_1195069,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Y5Mg24 (SG:217) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195069"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-993634'}},0.0160790444402456,3.19139012,520.0,-72.30764645,-2.493367118965517,"{'tags': ['Yttrium magnesium (5/24)', 'Magnesium yttrium (24/5)']}",-72.30764645,-2.493367118965517,-0.0540886097701145,"['xas', 'bandstructure']",True,"[109138, 642900, 642912, 163479]",True,2021-05-12 10:56:57.051000,NM,29,9,mp-1988,,Y5Mg24,"{'functional': 'PBE', 'labels': ['Y_sv', 'Mg_pv'], 'pot_type': 'paw'}","{'Y': 5.0, 'Mg': 24.0}",GGA,mp-1988,"['mp-991860', 'mp-993634', 'mp-1988', 'mp-1193077', 'mp-1194298', 'mp-1115976', 'mp-1389138', 'mp-1891650', 'mp-995018']",0.0356077,"{'Y': 5.0, 'Mg': 24.0}",717.1441038334995,[],NM,False,217,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.9652084998898767e-05,0.0356077,0,0.0356077,MP,data/source/MP/cleaned/cifs/MP-mp-1988.cif,False,,data/final/MP/graphs/Mg24Y5-MP-mp-1988.json,0,True,-43m,5,0,0,0,0,0,0,0,0,1,0,1.0,False
Ba2Co0.9Cu2Eu1O7.29,2,0.0284597888843529,0.9600438957475994,True,Ba1.92Co0.864Cu1.92Eu0.96O7,Ba2Co1Cu2Eu1O7,0.0,Cuprate,True,Ba15.163Co6.823Cu15.163Eu7.582O55.26914329037149,Ba-Co-Cu-Eu-O,5,Supercon,Eu1Ba2Cu2Co0.9O7.29,MP-mp-1214711,Ba2Eu1Co1Cu2O7,Ba-Co-Cu-Eu-O,Ba15.385Co7.692Cu15.385Eu7.692O53.84615384615385,P m m m,orthorhombic,3.901791,3.927605,11.985016,data/final/MP/cifs/Ba2Co0.9Cu2Eu1O7.29-MP-mp-1214711-synth_doped.cif,data/source/MP/raw/cifs/mp-1214711.cif,mp-1214711,0.0,,2019-01-12 16:30:30.966000,6.551494389849945,,,{'GGA+U': {'task_id': 'mp-1742590'}},0.0361571532692215,2.95093856,520.0,-84.67312685,-6.513317450000001,"{'tags': ['Ba2Cu2EuCoO7', 'high-Tc cuprate family', 'Ba2Cu2(Cu0.89Al0.11)YO7']}",-84.67312685,-6.513317450000001,-2.0805910419230766,[],False,[],True,2021-05-12 11:00:37.845000,FiM,13,4,mp-1214711,oxide,Ba2EuCoCu2O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Eu', 'Co', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Eu': 1.0, 'Co': 1.0, 'Cu': 2.0, 'O': 7.0}",GGA+U,mp-1214711,"['mp-1214711', 'mp-1402850', 'mp-1742590', 'mp-1788389']",8.5329526,"{'Ba': 2.0, 'Eu': 1.0, 'Co': 1.0, 'Cu': 2.0, 'O': 7.0}",183.6667008741531,[],FiM,True,47,3,"[0.0, 0.0, 6.3, 2.2, -0.1, -0.1, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0464588984251789,8.5329526,4,8.5329526,MP,data/source/MP/cleaned/cifs/MP-mp-1214711.cif,True,,data/final/MP/graphs/Ba2Co0.9Cu2Eu1O7.29-MP-mp-1214711-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Cd2Re2O7,1,0.0,2.0,False,Cd4Re4O14,Cd4Re4O14,1.102857143,Oxide,True,Cd18.182Re18.182O63.63636363636364,Cd-Re-O,3,Supercon,Cd2Re2O7,MP-mp-16783,Cd4Re4O14,Cd-Re-O,Cd18.182Re18.182O63.63636363636364,F d -3 m,cubic,7.34230549,7.342305489999999,7.342305489999999,data/final/MP/cifs/Cd2Re2O7-MP-mp-16783.cif,data/source/MP/raw/cifs/mp-16783.cif,mp-16783,0.0,,2014-02-16 11:20:58,8.415597206873366,10.17188/1192162,"@misc{osti_1192162,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Cd2Re2O7 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1192162"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1707971'}},0.0442170945454556,3.654358,520.0,-151.77536418,-6.89888019,{'tags': ['Dicadmium dirhenate(V)']},-151.77536418,-6.89888019,-1.75692010590909,"['xas', 'bandstructure']",True,[28445],True,2021-05-12 10:56:55.092000,FM,22,8,mp-16783,oxide,Cd2Re2O7,"{'functional': 'PBE', 'labels': ['Cd', 'Re_pv', 'O'], 'pot_type': 'paw'}","{'Cd': 2.0, 'Re': 2.0, 'O': 7.0}",GGA,mp-16783,"['mp-914760', 'mp-1001440', 'mp-16783', 'mp-1435795', 'mp-1707971', 'mp-1925291', 'mp-1007953', 'mp-1606557']",1.17431205,"{'Cd': 4.0, 'Re': 4.0, 'O': 14.0}",279.8867584140448,[],FM,True,166,1,"[-0.0, -0.0, -0.0, -0.0, 0.5, 0.5, 0.3, 0.5, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0083913369582336,1.17431205,4,2.3486241,MP,data/source/MP/cleaned/cifs/MP-mp-16783.cif,False,,data/final/MP/graphs/Cd2Re2O7-MP-mp-16783.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Cu1La1.945Sr0.055O4,2,0.0157142857142857,1.0,True,Cu1La1.945Sr0.055O4,Cu1La2O4,0.0,Cuprate,True,Cu14.286La27.786Sr0.786O57.142857142857146,Cu-La-Sr-O,4,Supercon,La1.945Sr0.055Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La1.945Sr0.055O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La1.945Sr0.055O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As2Fe1.75Pt0.25Sr1,3,0.1,1.0,True,As2Fe1.75Pt0.25Sr1,As2Fe2Sr1,16.3,Ferrite,True,As40Fe35Pt5Sr20,As-Fe-Pt-Sr,4,Supercon,Sr1Fe1.75Pt0.25As2,MP-mp-4488,Sr1Fe2As2,As-Fe-Sr,As40Fe40Sr20,I 4/m m m,tetragonal,3.9729799997357778,3.9729799997357778,6.45523327,data/final/MP/cifs/As2Fe1.75Pt0.25Sr1-MP-mp-4488-synth_doped.cif,data/source/MP/raw/cifs/mp-4488.cif,mp-4488,0.0,,2011-05-13 03:37:13,6.319998834487784,10.17188/1208187,"@misc{osti_1208187,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr(FeAs)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208187"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672865'}},0.0,5.13397273,520.0,-30.61898897,-6.123797794,"{'tags': ['Strontium diiron arsenide - HT', 'Strontium diiron arsenide', 'Strontium diiron diarsenide', 'Iron strontium arsenide (2/1/2)', 'Strontium diiron arsenide - LT']}",-30.61898897,-6.123797794,-0.5342483613333335,"['xas', 'elasticity', 'bandstructure']",True,"[182330, 181993, 610527, 163209, 163208, 163869]",True,2021-05-12 10:56:20.740000,NM,5,8,mp-4488,,Sr(FeAs)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Fe': 2.0, 'As': 2.0}",GGA,mp-4488,"['mp-906356', 'mp-920135', 'mp-919110', 'mp-4488', 'mp-1439153', 'mp-1672865', 'mp-1873948', 'mp-1592272']",0.0029206,"{'Sr': 1.0, 'Fe': 2.0, 'As': 2.0}",91.7377588211838,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",3.183640016422098e-05,0.0029206,0,0.0029206,MP,data/source/MP/cleaned/cifs/MP-mp-4488.cif,True,,data/final/MP/graphs/As2Fe1.75Pt0.25Sr1-MP-mp-4488-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Er0.8Pd2Sn1Y0.2,3,0.0999999999999999,1.0,True,Er0.8Pd2Sn1Y0.2,Er1Pd2Sn1,2.08,Other,True,Er20Pd50Sn25Y5,Er-Pd-Sn-Y,4,Supercon,Er0.8Y0.2Pd2Sn1,MP-mp-5850,Er1Sn1Pd2,Er-Pd-Sn,Er25Pd50Sn25,F m -3 m,cubic,4.78219427,4.78219427,4.78219427,data/final/MP/cifs/Er0.8Pd2Sn1Y0.2-MP-mp-5850-synth_doped.cif,data/source/MP/raw/cifs/mp-5850.cif,mp-5850,0.0,,2011-05-13 00:05:51,10.71067227167776,10.17188/1277090,"@misc{osti_1277090,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ErSnPd2 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277090"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700202'}},0.0,6.39384258,520.0,-22.50225514,-5.625563785,{'tags': ['Erbium palladium tin (1/2/1)']},-22.50225514,-5.625563785,-0.8913002137499992,"['xas', 'bandstructure']",True,"[103283, 103284]",True,2021-05-12 10:57:26.891000,NM,4,8,mp-5850,,ErSnPd2,"{'functional': 'PBE', 'labels': ['Er_3', 'Sn_d', 'Pd'], 'pot_type': 'paw'}","{'Er': 1.0, 'Sn': 1.0, 'Pd': 2.0}",GGA,mp-5850,"['mp-991640', 'mp-5850', 'mp-993556', 'mp-1438533', 'mp-1700202', 'mp-1801714', 'mp-994862', 'mp-1588611']",0.0008924,"{'Er': 1.0, 'Sn': 1.0, 'Pd': 2.0}",77.33331860614689,[],NM,False,225,0,"[0, 0, 0, 0]",1.1539657370000246e-05,0.0008924,0,0.0008924,MP,data/source/MP/cleaned/cifs/MP-mp-5850.cif,True,,data/final/MP/graphs/Er0.8Pd2Sn1Y0.2-MP-mp-5850-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
C1Mo0.75Nb0.25,1,0.0,4.0,False,C4Mo3Nb1,C4Mo3Nb1,13.1,Other,True,C50Mo37.5Nb12.5,C-Mo-Nb,3,Supercon,Nb0.25Mo0.75C1,MP-mp-1220378,Nb1Mo3C4,C-Mo-Nb,C50Mo37.5Nb12.5,R -3 m,trigonal,3.109218437349666,3.109218437349666,10.47404602,data/final/MP/cifs/C1Mo0.75Nb0.25-MP-mp-1220378.cif,data/source/MP/raw/cifs/mp-1220378.cif,mp-1220378,0.0,,2019-01-12 21:14:04.945000,8.241362197847382,,,{'GGA': {'task_id': 'mp-1759151'}},0.2574532889583327,9.1475218,520.0,-78.99504802,-9.8743810025,{'tags': []},-78.99504802,-9.8743810025,0.0687886137499997,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,8,5,mp-1220378,,NbMo3C4,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Mo_pv', 'C'], 'pot_type': 'paw'}","{'Nb': 1.0, 'Mo': 3.0, 'C': 4.0}",GGA,mp-1220378,"['mp-1220378', 'mp-1398704', 'mp-1759151', 'mp-1782990', 'mp-1619245']",0.0045647,"{'Nb': 1.0, 'Mo': 3.0, 'C': 4.0}",86.39202559620743,[],NM,False,166,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",5.283705259250673e-05,0.0045647,0,0.0045647,MP,data/source/MP/cleaned/cifs/MP-mp-1220378.cif,False,,data/final/MP/graphs/C1Mo0.75Nb0.25-MP-mp-1220378.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Be13Th0.018U0.982,2,0.0025714285714285,2.0,False,Be26Th0.036U1.964,Be26U2,0.519,Heavy_fermion,True,Be92.857Th0.129U7.014,Be-Th-U,3,Supercon,U0.9822Th0.0178Be13,MP-mp-1163,U2Be26,Be-U,Be92.857U7.143,F m -3 c,cubic,7.174675929999999,7.174675929999999,7.174675929999999,data/final/MP/cifs/Be13Th0.018U0.982-MP-mp-1163-synth_doped.cif,data/source/MP/raw/cifs/mp-1163.cif,mp-1163,0.0,,2011-05-15 13:39:09,4.516943134220159,10.17188/1188115,"@misc{osti_1188115,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UBe13 (SG:226) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188115"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1676276'}},0.0,5.60901004,520.0,-121.44122023,-4.337186436785714,"{'tags': ['Uranium beryllium (1/13)', 'Beryllium uranium (13/1)']}",-121.44122023,-4.337186436785714,-0.0583452042857146,"['xas', 'bandstructure']",True,"[616470, 58748, 616481, 58747, 58749, 659562, 107528, 600563, 58750, 616488, 58751]",True,2021-05-12 10:56:51.169000,NM,28,8,mp-1163,,UBe13,"{'functional': 'PBE', 'labels': ['U', 'Be_sv'], 'pot_type': 'paw'}","{'U': 1.0, 'Be': 13.0}",GGA,mp-1163,"['mp-1163', 'mp-906858', 'mp-920459', 'mp-921486', 'mp-1381018', 'mp-1676276', 'mp-1775695', 'mp-1603627']",0.0460573,"{'U': 2.0, 'Be': 26.0}",261.15110606061,[],NM,False,226,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0003527252914587,0.0460573,0,0.0921146,MP,data/source/MP/cleaned/cifs/MP-mp-1163.cif,True,,data/final/MP/graphs/Be13Th0.018U0.982-MP-mp-1163-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Fe1Se0.85,3,0.081081081081081,2.0,False,Fe2Se1.7,Fe2Se2,9.62,Ferrite,True,Fe54.054Se45.946,Fe-Se,2,Supercon,Fe1Se0.85,MP-mp-20311,Fe2Se2,Fe-Se,Fe50Se50,P 4/n m m,tetragonal,3.688905,3.688905,5.854194,data/final/MP/cifs/Fe1Se0.85-MP-mp-20311-synth_doped.cif,data/source/MP/raw/cifs/mp-20311.cif,mp-20311,0.0,,2013-10-20 07:09:24,5.619828229873189,10.17188/1195438,"@misc{osti_1195438,
    author = ""Persson, Kristin"",
    title = ""Materials Data on FeSe (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195438"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668877'}},0.0,3.48880228,520.0,-25.01949237,-6.2548730925,"{'tags': ['Iron selenide - NN AFM', 'Iron selenide - orthorhombic, LT', 'Iron selenide', 'Iron sulfide', 'Iron selenide (1/1) - nonmagnetic', 'Iron selenide - tetragonal', 'Iron selenide - alpha LT', 'Iron selenide - LT', 'High pressure experimental phase', 'Iron selenide - alpha']}",-25.01949237,-6.2548730925,-0.5079131286718743,"['xas', 'elasticity', 'bandstructure']",True,"[196301, 196298, 196299, 196297, 290701, 165958, 185464, 163561, 169257, 163560, 977900, 169311, 169303, 26889, 166440, 162901, 169283, 165957, 169271, 977903, 169259, 977901, 185465, 165959, 169306, 169267, 163557, 169287, 169297, 169289, 163556, 169299, 163562, 166441, 182544, 163559, 169269, 169263, 169265, 169315, 169255, 166439, 169293, 169313, 163555, 169291, 169301, 165960, 169253, 169295, 169970, 163558, 169285, 169261, 169309]",True,2021-05-12 10:56:14.760000,NM,4,55,mp-20311,,FeSe,"{'functional': 'PBE', 'labels': ['Fe_pv', 'Se'], 'pot_type': 'paw'}","{'Fe': 1.0, 'Se': 1.0}",GGA,mp-20311,"['mp-684656', 'mp-20311', 'mp-1063646', 'mp-1063662', 'mp-1063681', 'mp-1063669', 'mp-1063680', 'mp-1063695', 'mp-1063686', 'mp-1063699', 'mp-1063715', 'mp-1063717', 'mp-1063876', 'mp-1063734', 'mp-1063891', 'mp-1063735', 'mp-1063910', 'mp-1063918', 'mp-1063922', 'mp-1063931', 'mp-1063774', 'mp-1063781', 'mp-1064091', 'mp-1064111', 'mp-1063801', 'mp-1064112', 'mp-1064180', 'mp-1064138', 'mp-1064153', 'mp-1065102', 'mp-1065123', 'mp-1065075', 'mp-1065161', 'mp-1065131', 'mp-1065030', 'mp-1065055', 'mp-1065085', 'mp-1065094', 'mp-1440814', 'mp-1668877', 'mp-1799618', 'mp-1593782', 'mp-1592730', 'mp-1065081', 'mp-1065148', 'mp-1063928', 'mp-1063726', 'mp-1063683', 'mp-1063709', 'mp-1063911', 'mp-1063795', 'mp-1065121', 'mp-1063725', 'mp-1064139', 'mp-1064165']",3.455e-05,"{'Fe': 2.0, 'Se': 2.0}",79.66398961559156,[],NM,False,129,0,"[0, 0, 0, 0]",8.673931638803586e-07,3.455e-05,0,6.91e-05,MP,data/source/MP/cleaned/cifs/MP-mp-20311.cif,True,,data/final/MP/graphs/Fe1Se0.85-MP-mp-20311-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Be1Rh1,1,0.0,1.0,True,Be1Rh1,Be1Rh1,0.0,Other,True,Be50Rh50,Be-Rh,2,Supercon,Be1Rh1,MP-mp-11276,Be1Rh1,Be-Rh,Be50Rh50,P m -3 m,cubic,2.786392,2.786392,2.786392,data/final/MP/cifs/Be1Rh1-MP-mp-11276.cif,data/source/MP/raw/cifs/mp-11276.cif,mp-11276,0.0,,2011-05-27 17:56:25,8.590553768419028,10.17188/1187698,"@misc{osti_1187698,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BeRh (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187698"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688100'}},0.0,5.67572067,520.0,-12.31935258,-6.15967629,{'tags': ['Beryllium rhodium (1/1)']},-12.31935258,-6.15967629,-0.6078159225000004,"['xas', 'elasticity', 'bandstructure']",True,[58734],True,2021-05-12 10:56:10.715000,NM,2,9,mp-11276,,BeRh,"{'functional': 'PBE', 'labels': ['Be_sv', 'Rh_pv'], 'pot_type': 'paw'}","{'Be': 1.0, 'Rh': 1.0}",GGA,mp-11276,"['mp-11276', 'mp-991394', 'mp-993340', 'mp-1141816', 'mp-1439194', 'mp-1688100', 'mp-1790705', 'mp-994648', 'mp-1592256']",0.0010401,"{'Be': 1.0, 'Rh': 1.0}",21.63349281247996,[],NM,False,221,0,"[0, 0]",4.80782280057886e-05,0.0010401,0,0.0010401,MP,data/source/MP/cleaned/cifs/MP-mp-11276.cif,False,,data/final/MP/graphs/Be1Rh1-MP-mp-11276.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ni2Sn1V1,1,0.0,1.0,True,Ni2Sn1V1,Ni2Sn1V1,0.0,Other,True,Ni50Sn25V25,Ni-Sn-V,3,Supercon,Ni2V1Sn1,MP-mp-20864,V1Ni2Sn1,Ni-Sn-V,Ni50Sn25V25,F m -3 m,cubic,4.26684354,4.26684354,4.26684354,data/final/MP/cifs/Ni2Sn1V1-MP-mp-20864.cif,data/source/MP/raw/cifs/mp-20864.cif,mp-20864,0.0,,2014-02-21 09:09:35,8.677283582015702,10.17188/1196060,"@misc{osti_1196060,
    author = ""Persson, Kristin"",
    title = ""Materials Data on VNi2Sn (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196060"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-993478'}},0.1141680004861118,9.36074719,520.0,-25.11280137,-6.2782003425,{'tags': ['Nickel tin vanadium (2/1/1)']},-25.11280137,-6.2782003425,-0.1147625212499994,"['xas', 'elasticity', 'bandstructure']",True,"[105376, 646810, 105377]",True,2021-05-12 10:56:14.760000,FM,4,7,mp-20864,,VNi2Sn,"{'functional': 'PBE', 'labels': ['V_pv', 'Ni_pv', 'Sn_d'], 'pot_type': 'paw'}","{'V': 1.0, 'Ni': 2.0, 'Sn': 1.0}",GGA,mp-20864,"['mp-993478', 'mp-991531', 'mp-20864', 'mp-1439744', 'mp-1781464', 'mp-994810', 'mp-1592872']",0.6728722,"{'V': 1.0, 'Ni': 2.0, 'Sn': 1.0}",54.929438026932544,[],FM,True,225,1,"[0.7, -0.0, -0.0, 0.0]",0.0122497557624762,0.6728722,1,0.6728722,MP,data/source/MP/cleaned/cifs/MP-mp-20864.cif,False,,data/final/MP/graphs/Ni2Sn1V1-MP-mp-20864.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ce1Co0.87In5Rh0.13,2,0.0371428571428571,1.0,True,Ce1Co0.87In5Rh0.13,Ce1Co1In5,1.73,Heavy_fermion,True,Ce14.286Co12.429In71.429Rh1.857,Ce-Co-In-Rh,4,Supercon,Ce1Rh0.13Co0.87In5,MP-mp-19961,Ce1In5Co1,Ce-Co-In,Ce14.286Co14.286In71.429,P 4/m m m,tetragonal,4.635989,4.635989,7.564124,data/final/MP/cifs/Ce1Co0.87In5Rh0.13-MP-mp-19961-synth_doped.cif,data/source/MP/raw/cifs/mp-19961.cif,mp-19961,0.0,,2014-02-21 14:08:25,7.897022127398995,10.17188/1195145,"@misc{osti_1195145,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeIn5Co (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195145"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701944'}},0.0,7.80626318,520.0,-28.52795357,-4.075421938571429,{'tags': ['Cerium cobalt indium (1/1/5)']},-28.52795357,-4.075421938571429,-0.2468754242857146,"['xas', 'bandstructure']",True,[102108],True,2021-05-12 10:56:57.051000,FM,7,8,mp-19961,,CeIn5Co,"{'functional': 'PBE', 'labels': ['Ce', 'In_d', 'Co'], 'pot_type': 'paw'}","{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",GGA,mp-19961,"['mp-928775', 'mp-912209', 'mp-928270', 'mp-19961', 'mp-1504062', 'mp-1701944', 'mp-1785253', 'mp-1593180']",0.9310323,"{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",162.57113333428427,[],FM,True,123,1,"[0.7, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0057269226147644,0.9310323,1,0.9310323,MP,data/source/MP/cleaned/cifs/MP-mp-19961.cif,True,,data/final/MP/graphs/Ce1Co0.87In5Rh0.13-MP-mp-19961-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Fe4Nd1P12,1,0.0,1.0,True,Fe4Nd1P12,Fe4Nd1P12,0.0,Ferrite,True,Fe23.529Nd5.882P70.588,Fe-Nd-P,3,Supercon,Nd1Fe4P12,MP-mp-16431,Nd1Fe4P12,Fe-Nd-P,Fe23.529Nd5.882P70.588,I m -3,cubic,6.7645417514995945,6.764541750000001,6.76454175,data/final/MP/cifs/Fe4Nd1P12-MP-mp-16431.cif,data/source/MP/raw/cifs/mp-16431.cif,mp-16431,0.0,,2011-06-04 00:52:59,5.152058035997023,10.17188/1191861,"@misc{osti_1191861,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nd(FeP3)4 (SG:204) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191861"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1669196'}},0.0,8.00474877,520.0,-113.71079314,-6.688870184705883,{'tags': ['Neodymium iron phosphide (1/4/12)']},-113.71079314,-6.688870184705883,-0.5942932970588243,"['xas', 'bandstructure']",True,"[93364, 632859]",True,2021-05-12 10:56:53.126000,NM,17,9,mp-16431,,Nd(FeP3)4,"{'functional': 'PBE', 'labels': ['Nd_3', 'Fe_pv', 'P'], 'pot_type': 'paw'}","{'Nd': 1.0, 'Fe': 4.0, 'P': 12.0}",GGA,mp-16431,"['mp-991302', 'mp-993264', 'mp-16431', 'mp-1189236', 'mp-1422780', 'mp-1669196', 'mp-1775646', 'mp-994595', 'mp-1597700']",0.0019509,"{'Nd': 1.0, 'Fe': 4.0, 'P': 12.0}",238.2831067218166,[],NM,False,204,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",8.187319809782304e-06,0.0019509,0,0.0019509,MP,data/source/MP/cleaned/cifs/MP-mp-16431.cif,False,,data/final/MP/graphs/Fe4Nd1P12-MP-mp-16431.json,0,True,m-3,2,0,0,0,0,0,0,0,0,1,0,1.0,False
La0.92Sn3Tm0.08,2,0.0399999999999999,1.0,True,La0.92Sn3Tm0.08,La1Sn3,5.17,Other,True,La23Sn75Tm2,La-Sn-Tm,3,Supercon,La0.92Tm0.08Sn3,MP-mp-633,La1Sn3,La-Sn,La25Sn75,P m -3 m,cubic,4.820061,4.820061,4.820061,data/final/MP/cifs/La0.92Sn3Tm0.08-MP-mp-633-synth_doped.cif,data/source/MP/raw/cifs/mp-633.cif,mp-633,0.0,,2011-05-13 04:30:54,7.340536659909055,10.17188/1279358,"@misc{osti_1279358,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaSn3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1279358"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688008'}},0.0,8.68748013,520.0,-19.26482408,-4.81620602,"{'tags': ['Lanthanum stannide (1/3)', 'Lanthanum tin (1/3)']}",-19.26482408,-4.81620602,-0.5750253525,"['xas', 'bandstructure']",True,"[641991, 104721, 641986, 261870, 104720, 151359, 642000, 641998, 191074]",True,2021-05-12 10:57:30.779000,NM,4,12,mp-633,,LaSn3,"{'functional': 'PBE', 'labels': ['La', 'Sn_d'], 'pot_type': 'paw'}","{'La': 1.0, 'Sn': 3.0}",GGA,mp-633,"['mp-991111', 'mp-993073', 'mp-633', 'mp-1066557', 'mp-1066573', 'mp-1066594', 'mp-1442023', 'mp-1688008', 'mp-1787436', 'mp-994393', 'mp-1590336', 'mp-1066601']",0.0055557,"{'La': 1.0, 'Sn': 3.0}",111.98441958300587,[],NM,False,221,0,"[0, 0, 0, 0]",4.961136576577034e-05,0.0055557,0,0.0055557,MP,data/source/MP/cleaned/cifs/MP-mp-633.cif,True,,data/final/MP/graphs/La0.92Sn3Tm0.08-MP-mp-633-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ce0.054La0.946Sn3,2,0.027,1.0,True,Ce0.054La0.946Sn3,La1Sn3,1.86,Other,True,Ce1.35La23.65Sn75,Ce-La-Sn,3,Supercon,La0.9462Ce0.0538Sn3,MP-mp-633,La1Sn3,La-Sn,La25Sn75,P m -3 m,cubic,4.820061,4.820061,4.820061,data/final/MP/cifs/Ce0.054La0.946Sn3-MP-mp-633-synth_doped.cif,data/source/MP/raw/cifs/mp-633.cif,mp-633,0.0,,2011-05-13 04:30:54,7.340536659909055,10.17188/1279358,"@misc{osti_1279358,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaSn3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1279358"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688008'}},0.0,8.68748013,520.0,-19.26482408,-4.81620602,"{'tags': ['Lanthanum stannide (1/3)', 'Lanthanum tin (1/3)']}",-19.26482408,-4.81620602,-0.5750253525,"['xas', 'bandstructure']",True,"[641991, 104721, 641986, 261870, 104720, 151359, 642000, 641998, 191074]",True,2021-05-12 10:57:30.779000,NM,4,12,mp-633,,LaSn3,"{'functional': 'PBE', 'labels': ['La', 'Sn_d'], 'pot_type': 'paw'}","{'La': 1.0, 'Sn': 3.0}",GGA,mp-633,"['mp-991111', 'mp-993073', 'mp-633', 'mp-1066557', 'mp-1066573', 'mp-1066594', 'mp-1442023', 'mp-1688008', 'mp-1787436', 'mp-994393', 'mp-1590336', 'mp-1066601']",0.0055557,"{'La': 1.0, 'Sn': 3.0}",111.98441958300587,[],NM,False,221,0,"[0, 0, 0, 0]",4.961136576577034e-05,0.0055557,0,0.0055557,MP,data/source/MP/cleaned/cifs/MP-mp-633.cif,True,,data/final/MP/graphs/Ce0.054La0.946Sn3-MP-mp-633-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ca0.9Cu2Pb0.5Sr2Tl0.5Y0.1O7,2,0.0153846153846153,2.0,False,Ca1.8Cu4Pb1Sr4Tl1Y0.2O14,Ca2Cu4Pb1Sr4Tl1O14,99.3,Cuprate,True,Ca6.923Cu15.385Pb3.846Sr15.385Tl3.846Y0.769O53.84615384615385,Ca-Cu-Pb-Sr-Tl-Y-O,7,Supercon,Tl0.5Pb0.5Sr2Ca0.9Y0.1Cu2O7,MP-mp-1173221,Sr4Ca2Tl1Cu4Pb1O14,Ca-Cu-Pb-Sr-Tl-O,Ca7.692Cu15.385Pb3.846Sr15.385Tl3.846O53.84615384615385,I 4/m m m,tetragonal,5.374731999708263,5.374731999708263,12.82905816,data/final/MP/cifs/Ca0.9Cu2Pb0.5Sr2Tl0.5Y0.1O7-MP-mp-1173221-synth_doped.cif,data/source/MP/raw/cifs/mp-1173221.cif,mp-1173221,0.0,,2019-01-11 01:27:33.089000,6.194266073733895,,,,0.0254255932211506,3.8256747,520.0,-146.89191057,-5.649688868076923,{'tags': []},-146.89191057,-5.649688868076923,-2.0768140780769224,[],False,[],True,2021-05-12 10:59:37.456000,NM,26,4,mp-1173221,oxide,Sr4Ca2TlCu4PbO14,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Tl_d', 'Cu_pv', 'Pb_d', 'O'], 'pot_type': 'paw'}","{'Sr': 4.0, 'Ca': 2.0, 'Tl': 1.0, 'Cu': 4.0, 'Pb': 1.0, 'O': 14.0}",GGA,mp-1173221,"['mp-1173221', 'mp-1218598', 'mp-1366452', 'mp-1839546']",0.0074263,"{'Sr': 4.0, 'Ca': 2.0, 'Tl': 1.0, 'Cu': 4.0, 'Pb': 1.0, 'O': 14.0}",353.9672478853857,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",2.098018967677097e-05,0.0074263,0,0.0074263,MP,data/source/MP/cleaned/cifs/MP-mp-1173221.cif,True,,data/final/MP/graphs/Ca0.9Cu2Pb0.5Sr2Tl0.5Y0.1O7-MP-mp-1173221-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ca0.05Nd0.95Ni1O3,2,0.02,4.0,False,Ca0.2Nd3.8Ni4O12,Nd4Ni4O12,0.0,Oxide,True,Ca1Nd19Ni20O60,Ca-Nd-Ni-O,4,Supercon,Nd0.95Ca0.05Ni1O3,MP-mp-22106,Nd4Ni4O12,Nd-Ni-O,Nd20Ni20O60,P n m a,orthorhombic,5.431762,5.495849,7.709429,data/final/MP/cifs/Ca0.05Nd0.95Ni1O3-MP-mp-22106-synth_doped.cif,data/source/MP/raw/cifs/mp-22106.cif,mp-22106,0.0,,2014-02-19 13:18:08,7.242194237367626,,,{'GGA+U': {'task_id': 'mp-1701351'}},0.0,3.99854667,520.0,-131.66600273,-6.5833001365,"{'tags': ['Neodymium nickel(III) oxide', 'Dineodymium niccolate', 'Neodymium niccolate', 'Neodymium nickel oxide', 'Neodymium niccolate(III)']}",-131.66600273,-6.5833001365,-2.425267555500001,"['xas', 'bandstructure']",True,"[155746, 67725, 164825, 67724, 416213, 78319, 164562, 155747, 67723, 69788, 155748, 67722, 24875, 416212]",True,2021-05-12 10:57:01.079000,FM,20,11,mp-22106,oxide,NdNiO3,"{'functional': 'PBE', 'labels': ['Nd_3', 'Ni_pv', 'O'], 'pot_type': 'paw'}","{'Nd': 1.0, 'Ni': 1.0, 'O': 3.0}",GGA+U,mp-22106,"['mp-919926', 'mp-918860', 'mp-905914', 'mp-602303', 'mp-25591', 'mp-1189695', 'mp-22106', 'mp-1416651', 'mp-1701351', 'mp-1930748', 'mp-1599871']",1.00005245,"{'Nd': 4.0, 'Ni': 4.0, 'O': 12.0}",230.14298278419733,[],FM,True,62,1,"[0.0, 0.0, 0.0, 0.0, 1.4, 1.4, 1.4, 1.4, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0173814111193255,1.00005245,4,4.0002098,MP,data/source/MP/cleaned/cifs/MP-mp-22106.cif,True,,data/final/MP/graphs/Ca0.05Nd0.95Ni1O3-MP-mp-22106-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ba2Ca0.8Ce0.2Cu2Tl2O8,3,0.0266666666666666,1.0,True,Ba2Ca0.8Ce0.2Cu2Tl2O8,Ba2Ca1Cu2Tl2O8,103.0,Cuprate,True,Ba13.333Ca5.333Ce1.333Cu13.333Tl13.333O53.333333333333336,Ba-Ca-Ce-Cu-Tl-O,6,Supercon,Tl2Ba2Ca0.8Ce0.2Cu2O8,MP-mp-6885,Ba2Ca1Tl2Cu2O8,Ba-Ca-Cu-Tl-O,Ba13.333Ca6.667Cu13.333Tl13.333O53.333333333333336,I 4/m m m,tetragonal,3.8887880015527454,3.8887880015527454,15.44888372,data/final/MP/cifs/Ba2Ca0.8Ce0.2Cu2Tl2O8-MP-mp-6885-synth_doped.cif,data/source/MP/raw/cifs/mp-6885.cif,mp-6885,0.0,,2011-05-16 00:12:29,7.06827160481344,10.17188/1284435,"@misc{osti_1284435,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2CaTl2(CuO4)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1284435"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1676611'}},0.0059098983148224,4.22920004,520.0,-81.10596699,-5.407064466,"{'tags': ['Dithallium(III) dibarium calcium dicopper oxide', 'Dithallium dibarium calcium dicopper oxide']}",-81.10596699,-5.407064466,-1.8834025184444445,"['xas', 'bandstructure']",True,"[78592, 78593, 65554]",True,2021-05-12 10:57:38.495000,NM,15,8,mp-6885,oxide,Ba2CaTl2(CuO4)2,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ca_sv', 'Tl_d', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Ca': 1.0, 'Tl': 2.0, 'Cu': 2.0, 'O': 8.0}",GGA,mp-6885,"['mp-6885', 'mp-556042', 'mvc-16338', 'mp-1423335', 'mp-1676611', 'mp-1777344', 'mp-1931767', 'mp-1607471']",0.0018692,"{'Ba': 2.0, 'Ca': 1.0, 'Tl': 2.0, 'Cu': 2.0, 'O': 8.0}",229.8977800758837,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",8.130570027179132e-06,0.0018692,0,0.0018692,MP,data/source/MP/cleaned/cifs/MP-mp-6885.cif,True,,data/final/MP/graphs/Ba2Ca0.8Ce0.2Cu2Tl2O8-MP-mp-6885-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
In0.45Tl0.55,3,0.1,2.0,False,In0.9Tl1.1,In1Tl1,2.48,Other,True,In45Tl55,In-Tl,2,Supercon,In0.45Tl0.55,MP-mp-1216527,Tl1In1,In-Tl,In50Tl50,R -3 m,trigonal,3.465208377400084,3.465208377400083,5.92551669,data/final/MP/cifs/In0.45Tl0.55-MP-mp-1216527-synth_doped.cif,data/source/MP/raw/cifs/mp-1216527.cif,mp-1216527,0.0,,2019-01-12 18:01:17.267000,9.138608211841577,,,{'GGA': {'task_id': 'mp-1767444'}},0.0373205783333334,6.42227178,520.0,-5.03968572,-2.51984286,{'tags': []},-5.03968572,-2.51984286,0.0373205783333334,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,2,5,mp-1216527,,TlIn,"{'functional': 'PBE', 'labels': ['Tl_d', 'In_d'], 'pot_type': 'paw'}","{'Tl': 1.0, 'In': 1.0}",GGA,mp-1216527,"['mp-1216527', 'mp-1382459', 'mp-1767444', 'mp-1794136', 'mp-1610213']",0.0003752,"{'Tl': 1.0, 'In': 1.0}",58.00076078025602,[],NM,False,166,0,"[0, 0]",6.468880665574329e-06,0.0003752,0,0.0003752,MP,data/source/MP/cleaned/cifs/MP-mp-1216527.cif,True,,data/final/MP/graphs/In0.45Tl0.55-MP-mp-1216527-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ca1Rh2,1,0.0,2.0,False,Ca2Rh4,Ca2Rh4,6.4,Other,True,Ca33.333Rh66.667,Ca-Rh,2,Supercon,Ca1Rh2,MP-mp-571262,Ca2Rh4,Ca-Rh,Ca33.333Rh66.667,F d -3 m,cubic,5.36328614,5.36328614,5.36328614,data/final/MP/cifs/Ca1Rh2-MP-mp-571262.cif,data/source/MP/raw/cifs/mp-571262.cif,mp-571262,0.0,,2015-02-18 17:50:46,7.485835643863895,10.17188/1276171,"@misc{osti_1276171,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CaRh2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1276171"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698918'}},0.0,4.71549312,520.0,-35.93479448,-5.9891324133333335,{'tags': ['Calcium rhodium (1/2)']},-35.93479448,-5.9891324133333335,-0.41106054,"['xas', 'elasticity', 'bandstructure']",True,[108145],True,2021-05-12 10:56:27.046000,FM,6,8,mp-571262,,CaRh2,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Rh_pv'], 'pot_type': 'paw'}","{'Ca': 1.0, 'Rh': 2.0}",GGA,mp-571262,"['mp-934064', 'mp-944129', 'mp-944752', 'mp-1420316', 'mp-1698918', 'mp-1805415', 'mp-1594324', 'mp-571262']",0.38029645,"{'Ca': 2.0, 'Rh': 4.0}",109.08823275645808,[],FM,True,12,1,"[0.0, 0.0, 0.3, 0.0, 0.2, 0.0]",0.0069722726345566,0.38029645,2,0.7605929,MP,data/source/MP/cleaned/cifs/MP-mp-571262.cif,False,,data/final/MP/graphs/Ca1Rh2-MP-mp-571262.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ce0.13Cu1Pr1.87O4,2,0.0371428571428571,1.0,True,Ce0.13Cu1Pr1.87O4,Cu1Pr2O4,9.4,Cuprate,True,Ce1.857Cu14.286Pr26.714O57.142857142857146,Ce-Cu-Pr-O,4,Supercon,Pr1.87Ce0.13Cu1O4,MP-mp-4181,Pr2Cu1O4,Cu-Pr-O,Cu14.286Pr28.571O57.142857142857146,I 4/m m m,tetragonal,3.995734002478021,3.995734002478021,6.85109716,data/final/MP/cifs/Ce0.13Cu1Pr1.87O4-MP-mp-4181-synth_doped.cif,data/source/MP/raw/cifs/mp-4181.cif,mp-4181,0.0,,2011-05-13 10:21:01,6.821515862307185,10.17188/1207928,"@misc{osti_1207928,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Pr2CuO4 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207928"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-669887'}},0.0,3.15418113,520.0,-51.2919541,-7.327422014285714,"{'tags': ['Dipraseodymium cuprate', 'Dipraseodymium copper oxide', 'Praseodymium cuprate', 'Dipraseodymium copper tetraoxide']}",-51.2919541,-7.327422014285714,-2.9410150171428566,"['xas', 'elasticity', 'bandstructure']",True,"[91071, 261374, 71180, 186589, 185267, 185268, 65925, 65924, 191813, 261373, 202884, 72241]",True,2021-05-12 10:56:20.740000,NM,7,12,mp-4181,oxide,Pr2CuO4,"{'functional': 'PBE', 'labels': ['Pr_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Pr': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-4181,"['mp-669887', 'mp-660138', 'mp-4181', 'mp-1077961', 'mp-1077976', 'mp-1077987', 'mp-1078042', 'mp-1442060', 'mp-1687781', 'mp-1797293', 'mp-1589370', 'mp-688743']",0.0084498,"{'Pr': 2.0, 'Cu': 1.0, 'O': 4.0}",99.64888441679796,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",8.479573102552068e-05,0.0084498,0,0.0084498,MP,data/source/MP/cleaned/cifs/MP-mp-4181.cif,True,,data/final/MP/graphs/Ce0.13Cu1Pr1.87O4-MP-mp-4181-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
La1P2Ru2,1,0.0,1.0,True,La1P2Ru2,La1P2Ru2,3.933333333,Other,True,La20P40Ru40,La-P-Ru,3,Supercon,La1Ru2P2,MP-mp-9886,La1P2Ru2,La-P-Ru,La20P40Ru40,I 4/m m m,tetragonal,4.053517996994749,4.053517996994749,6.14790314,data/final/MP/cifs/La1P2Ru2-MP-mp-9886.cif,data/source/MP/raw/cifs/mp-9886.cif,mp-9886,0.0,,2011-05-28 04:37:44,7.488148043278911,10.17188/1316770,"@misc{osti_1316770,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La(PRu)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1316770"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698168'}},0.0,9.07971162,520.0,-39.54958952,-7.909917903999999,{'tags': ['Lanthanum ruthenium phosphide (1/2/2)']},-39.54958952,-7.909917903999999,-1.047639618333332,"['xas', 'bandstructure']",True,[40795],True,2021-05-12 10:57:57.486000,NM,5,8,mp-9886,,La(PRu)2,"{'functional': 'PBE', 'labels': ['La', 'P', 'Ru_pv'], 'pot_type': 'paw'}","{'La': 1.0, 'P': 2.0, 'Ru': 2.0}",GGA,mp-9886,"['mp-9886', 'mp-1007200', 'mp-1000752', 'mp-1476100', 'mp-1698168', 'mp-1927527', 'mp-1011941', 'mp-1595954']",0.0018829,"{'La': 1.0, 'P': 2.0, 'Ru': 2.0}",89.36596956088975,[],NM,False,139,0,"[0, 0, 0, 0, 0]",2.106954145131365e-05,0.0018829,0,0.0018829,MP,data/source/MP/cleaned/cifs/MP-mp-9886.cif,False,,data/final/MP/graphs/La1P2Ru2-MP-mp-9886.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ir1U1,1,0.0,8.0,False,Ir8U8,Ir8U8,0.14,Heavy_fermion,True,Ir50U50,Ir-U,2,Supercon,Ir1U1,MP-mp-1105762,U8Ir8,Ir-U,Ir50U50,P 1 21 1,monoclinic,5.597811000000001,5.61447109,10.630335,data/final/MP/cifs/Ir1U1-MP-mp-1105762.cif,data/source/MP/raw/cifs/mp-1105762.cif,mp-1105762,0.0,,2018-07-19 06:08:52,17.29227028162275,,,{'GGA': {'task_id': 'mp-1676522'}},0.0,10.64115199,520.0,-168.99018252,-10.5618864075,{'tags': ['Iridium uranium (1/1)']},-168.99018252,-10.5618864075,-0.4969661924999986,['bandstructure'],True,"[108570, 104582, 104583, 104584]",True,2021-05-12 10:58:22.271000,FM,16,5,mp-1105762,,UIr,"{'functional': 'PBE', 'labels': ['U', 'Ir'], 'pot_type': 'paw'}","{'U': 1.0, 'Ir': 1.0}",GGA,mp-1105762,"['mp-1105762', 'mp-1381384', 'mp-1676522', 'mp-1807028', 'mp-1603567']",1.655187025,"{'U': 8.0, 'Ir': 8.0}",330.5246240843849,[],FM,True,4,4,"[1.6, 1.6, 1.7, 1.7, 1.6, 1.6, 1.7, 1.7, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0400620566067699,1.655187025,8,13.2414962,MP,data/source/MP/cleaned/cifs/MP-mp-1105762.cif,False,,data/final/MP/graphs/Ir1U1-MP-mp-1105762.json,0,True,2,0,0,1,0,0,0,0,1,0,0,0,1.0,False
Ce0.05Cu1Pr1.95O4,2,0.0142857142857142,1.0,True,Ce0.05Cu1Pr1.95O4,Cu1Pr2O4,0.0,Cuprate,True,Ce0.714Cu14.286Pr27.857O57.142857142857146,Ce-Cu-Pr-O,4,Supercon,Pr1.95Ce0.05Cu1O4,MP-mp-4181,Pr2Cu1O4,Cu-Pr-O,Cu14.286Pr28.571O57.142857142857146,I 4/m m m,tetragonal,3.995734002478021,3.995734002478021,6.85109716,data/final/MP/cifs/Ce0.05Cu1Pr1.95O4-MP-mp-4181-synth_doped.cif,data/source/MP/raw/cifs/mp-4181.cif,mp-4181,0.0,,2011-05-13 10:21:01,6.821515862307185,10.17188/1207928,"@misc{osti_1207928,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Pr2CuO4 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207928"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-669887'}},0.0,3.15418113,520.0,-51.2919541,-7.327422014285714,"{'tags': ['Dipraseodymium cuprate', 'Dipraseodymium copper oxide', 'Praseodymium cuprate', 'Dipraseodymium copper tetraoxide']}",-51.2919541,-7.327422014285714,-2.9410150171428566,"['xas', 'elasticity', 'bandstructure']",True,"[91071, 261374, 71180, 186589, 185267, 185268, 65925, 65924, 191813, 261373, 202884, 72241]",True,2021-05-12 10:56:20.740000,NM,7,12,mp-4181,oxide,Pr2CuO4,"{'functional': 'PBE', 'labels': ['Pr_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Pr': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-4181,"['mp-669887', 'mp-660138', 'mp-4181', 'mp-1077961', 'mp-1077976', 'mp-1077987', 'mp-1078042', 'mp-1442060', 'mp-1687781', 'mp-1797293', 'mp-1589370', 'mp-688743']",0.0084498,"{'Pr': 2.0, 'Cu': 1.0, 'O': 4.0}",99.64888441679796,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",8.479573102552068e-05,0.0084498,0,0.0084498,MP,data/source/MP/cleaned/cifs/MP-mp-4181.cif,True,,data/final/MP/graphs/Ce0.05Cu1Pr1.95O4-MP-mp-4181-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Cu1La1.887Sr0.113O4,2,0.0322857142857142,1.0,True,Cu1La1.887Sr0.113O4,Cu1La2O4,29.7,Cuprate,True,Cu14.286La26.957Sr1.614O57.142857142857146,Cu-La-Sr-O,4,Supercon,La1.887Sr0.113Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La1.887Sr0.113O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La1.887Sr0.113O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ce1Cu1Sb2,1,0.0,2.0,False,Ce2Cu2Sb4,Ce2Cu2Sb4,0.0,Heavy_fermion,True,Ce25Cu25Sb50,Ce-Cu-Sb,3,Supercon,Ce1Cu1Sb2,MP-mp-672238,Ce2Cu2Sb4,Ce-Cu-Sb,Ce25Cu25Sb50,P 4/n m m,tetragonal,4.400565,4.400565,9.872623,data/final/MP/cifs/Ce1Cu1Sb2-MP-mp-672238.cif,data/source/MP/raw/cifs/mp-672238.cif,mp-672238,0.0,,2013-10-13 04:33:57,7.768085077374497,10.17188/1281795,"@misc{osti_1281795,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeCuSb2 (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281795"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688611'}},0.0,8.24123792,520.0,-41.813969,-5.226746125,{'tags': ['Cerium copper antimonide (1/1/2)']},-41.813969,-5.226746125,-0.75017154875,"['xas', 'bandstructure']",True,"[658226, 106383]",True,2021-05-12 10:57:32.679000,FM,8,10,mp-672238,,CeCuSb2,"{'functional': 'PBE', 'labels': ['Ce', 'Cu_pv', 'Sb'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Cu': 1.0, 'Sb': 2.0}",GGA,mp-672238,"['mp-672238', 'mp-1001729', 'mp-1008182', 'mp-1080091', 'mp-1182002', 'mp-1300465', 'mp-1688611', 'mp-1829823', 'mp-1012505', 'mp-1602458']",0.5295092,"{'Ce': 2.0, 'Cu': 2.0, 'Sb': 4.0}",191.1830711131441,[],FM,True,129,1,"[0.5, 0.5, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0]",0.0055392896130079,0.5295092,2,1.0590184,MP,data/source/MP/cleaned/cifs/MP-mp-672238.cif,False,,data/final/MP/graphs/Ce1Cu1Sb2-MP-mp-672238.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ge10Rh4Y5,1,0.0,2.0,False,Ge20Rh8Y10,Ge20Rh8Y10,1.35,Other,True,Ge52.632Rh21.053Y26.316,Ge-Rh-Y,3,Supercon,Y5Rh4Ge10,MP-mp-1198948,Y10Ge20Rh8,Ge-Rh-Y,Ge52.632Rh21.053Y26.316,P 4/m b m,tetragonal,4.317926,13.104588,13.104588,data/final/MP/cifs/Ge10Rh4Y5-MP-mp-1198948.cif,data/source/MP/raw/cifs/mp-1198948.cif,mp-1198948,0.0,,2019-01-12 03:38:06.617000,7.087856856486703,,,,0.0,4.65937586,520.0,-246.94347285,-6.498512443421053,"{'tags': ['Yttrium rhodium germanide (5/4/10)', 'Sc5Co4Si10', 'Y5Rh4Ge10']}",-246.94347285,-6.498512443421053,-0.8132563593859653,[],False,[637728],True,2021-05-12 11:00:03.538000,NM,38,2,mp-1198948,,Y5(Ge5Rh2)2,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ge_d', 'Rh_pv'], 'pot_type': 'paw'}","{'Y': 5.0, 'Ge': 10.0, 'Rh': 4.0}",GGA,mp-1198948,"['mp-1198948', 'mp-1368515']",0.00152315,"{'Y': 10.0, 'Ge': 20.0, 'Rh': 8.0}",741.5184106368225,[],NM,False,127,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.1081919967217145e-06,0.00152315,0,0.0030463,MP,data/source/MP/cleaned/cifs/MP-mp-1198948.cif,False,,data/final/MP/graphs/Ge10Rh4Y5-MP-mp-1198948.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
As2Fe2K0.1Sr0.9,2,0.0399999999999999,1.0,True,As2Fe2K0.1Sr0.9,As2Fe2Sr1,5.11,Ferrite,True,As40Fe40K2Sr18,As-Fe-K-Sr,4,Supercon,Sr0.9K0.1Fe2As2,MP-mp-4488,Sr1Fe2As2,As-Fe-Sr,As40Fe40Sr20,I 4/m m m,tetragonal,3.9729799997357778,3.9729799997357778,6.45523327,data/final/MP/cifs/As2Fe2K0.1Sr0.9-MP-mp-4488-synth_doped.cif,data/source/MP/raw/cifs/mp-4488.cif,mp-4488,0.0,,2011-05-13 03:37:13,6.319998834487784,10.17188/1208187,"@misc{osti_1208187,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr(FeAs)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208187"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672865'}},0.0,5.13397273,520.0,-30.61898897,-6.123797794,"{'tags': ['Strontium diiron arsenide - HT', 'Strontium diiron arsenide', 'Strontium diiron diarsenide', 'Iron strontium arsenide (2/1/2)', 'Strontium diiron arsenide - LT']}",-30.61898897,-6.123797794,-0.5342483613333335,"['xas', 'elasticity', 'bandstructure']",True,"[182330, 181993, 610527, 163209, 163208, 163869]",True,2021-05-12 10:56:20.740000,NM,5,8,mp-4488,,Sr(FeAs)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Fe': 2.0, 'As': 2.0}",GGA,mp-4488,"['mp-906356', 'mp-920135', 'mp-919110', 'mp-4488', 'mp-1439153', 'mp-1672865', 'mp-1873948', 'mp-1592272']",0.0029206,"{'Sr': 1.0, 'Fe': 2.0, 'As': 2.0}",91.7377588211838,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",3.183640016422098e-05,0.0029206,0,0.0029206,MP,data/source/MP/cleaned/cifs/MP-mp-4488.cif,True,,data/final/MP/graphs/As2Fe2K0.1Sr0.9-MP-mp-4488-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
K0.45W1O3,1,0.0,20.0,False,K9W20O60,K9W20O60,0.885,Oxide,True,K10.112W22.472O67.41573033707864,K-W-O,3,Supercon,K0.45W1O3,MP-mp-761779,K9W20O60,K-W-O,K10.112W22.472O67.41573033707866,P -1,triclinic,7.840794090000001,13.131254757479574,13.147021618607384,data/final/MP/cifs/K0.45W1O3-MP-mp-761779-synth_doped.cif,data/source/MP/raw/cifs/mp-761779.cif,mp-761779,0.0,,2014-05-05 16:18:54,6.717726008027503,10.17188/1292276,"@misc{osti_1292276,
    author = ""Persson, Kristin"",
    title = ""Materials Data on K9(WO3)20 (SG:2) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1292276"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",,0.0,3.20579893,520.0,-635.33390436,-7.13858319505618,{'tags': []},-635.33390436,-7.13858319505618,-2.239102518393259,[],False,[],True,2021-05-12 11:01:49.706000,FM,89,5,mp-761779,oxide,K9(WO3)20,"{'functional': 'PBE', 'labels': ['K_sv', 'W_pv', 'O'], 'pot_type': 'paw'}","{'K': 9.0, 'W': 20.0, 'O': 60.0}",GGA+U,mp-761779,"['mp-761779', 'mp-1178169', 'mp-1366000', 'mp-1659809', 'mp-1845254']",8.5334164,"{'K': 9.0, 'W': 20.0, 'O': 60.0}",1233.1324686351195,[],FM,True,2,12,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.2, 0.1, 0.2, 1.0, 0.1, 0.9, 0.1, 0.9, 0.9, 0.1, 0.1, 0.9, 0.9, 0.1, 1.0, 0.2, 0.2, 0.1, 0.7, 0.1, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0069201133025433,8.5334164,20,8.5334164,MP,data/source/MP/cleaned/cifs/MP-mp-761779.cif,True,,data/final/MP/graphs/K0.45W1O3-MP-mp-761779-synth_doped.json,0,True,-1,0,0,0,0,0,2,0,1,0,0,0,1.0,False
Ge4La3Pd4,1,0.0,1.0,True,Ge4La3Pd4,Ge4La3Pd4,2.493333333,Other,True,Ge36.364La27.273Pd36.364,Ge-La-Pd,3,Supercon,La3Pd4Ge4,MP-mp-22729,La3Ge4Pd4,Ge-La-Pd,Ge36.364La27.273Pd36.364,I m m m,orthorhombic,4.238645999823549,4.432722000514857,13.065604349999996,data/final/MP/cifs/Ge4La3Pd4-MP-mp-22729.cif,data/source/MP/raw/cifs/mp-22729.cif,mp-22729,0.0,,2014-02-22 19:14:25,7.883863279929546,10.17188/1198931,"@misc{osti_1198931,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La3(GePd)4 (SG:71) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198931"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1676328'}},0.0,6.22844954,520.0,-64.04420054,-5.82220004909091,{'tags': ['Lanthanum palladium germanide (3/4/4)']},-64.04420054,-5.82220004909091,-0.9113218695454554,"['xas', 'bandstructure']",True,[246415],True,2021-05-12 10:56:59.077000,NM,11,5,mp-22729,,La3(GePd)4,"{'functional': 'PBE', 'labels': ['La', 'Ge_d', 'Pd'], 'pot_type': 'paw'}","{'La': 3.0, 'Ge': 4.0, 'Pd': 4.0}",GGA,mp-22729,"['mp-22729', 'mp-1381500', 'mp-1676328', 'mp-1923501', 'mp-1608054']",0.0155364,"{'La': 3.0, 'Ge': 4.0, 'Pd': 4.0}",238.6289960594927,[],NM,False,71,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.510692437446544e-05,0.0155364,0,0.0155364,MP,data/source/MP/cleaned/cifs/MP-mp-22729.cif,False,,data/final/MP/graphs/Ge4La3Pd4-MP-mp-22729.json,0,True,mmm,0,0,0,7,0,0,0,0,0,1,0,1.0,False
Pb1Pd3,1,0.0,1.0,True,Pb1Pd3,Pb1Pd3,0.0,Other,True,Pb25Pd75,Pb-Pd,2,Supercon,Pb1Pd3,MP-mp-20849,Pd3Pb1,Pb-Pd,Pb25Pd75,P m -3 m,cubic,4.120301,4.120301,4.120301,data/final/MP/cifs/Pb1Pd3-MP-mp-20849.cif,data/source/MP/raw/cifs/mp-20849.cif,mp-20849,0.0,,2014-02-21 08:17:41,12.497629508578518,10.17188/1196049,"@misc{osti_1196049,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Pd3Pb (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196049"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-924875'}},0.0,6.22699666,520.0,-20.45200501,-5.1130012525,"{'tags': ['Zvyagintsevite', 'Lead palladium (1/3)']}",-20.45200501,-5.1130012525,-0.2999281275000003,"['xas', 'elasticity', 'bandstructure']",True,"[648358, 42600, 648357]",True,2021-05-12 10:56:14.760000,NM,4,7,mp-20849,,Pd3Pb,"{'functional': 'PBE', 'labels': ['Pd', 'Pb_d'], 'pot_type': 'paw'}","{'Pd': 3.0, 'Pb': 1.0}",GGA,mp-20849,"['mp-924875', 'mp-909847', 'mp-925455', 'mp-20849', 'mp-1439837', 'mp-1801593', 'mp-1592492']",9.23e-05,"{'Pd': 3.0, 'Pb': 1.0}",69.94985700305564,[],NM,False,221,0,"[0, 0, 0, 0]",1.3195166359806572e-06,9.23e-05,0,9.23e-05,MP,data/source/MP/cleaned/cifs/MP-mp-20849.cif,False,,data/final/MP/graphs/Pb1Pd3-MP-mp-20849.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
B2C1Ni2Tb0.05Y0.95,2,0.0166666666666666,1.0,True,B2C1Ni2Tb0.05Y0.95,B2C1Ni2Y1,14.42,Other,True,B33.333C16.667Ni33.333Tb0.833Y15.833,B-C-Ni-Tb-Y,5,Supercon,Y0.95Tb0.05Ni2B2C1,MP-mp-6576,Y1Ni2B2C1,B-C-Ni-Y,B33.333C16.667Ni33.333Y16.667,I 4/m m m,tetragonal,3.548790000501972,3.548790000501972,5.76144136,data/final/MP/cifs/B2C1Ni2Tb0.05Y0.95-MP-mp-6576-synth_doped.cif,data/source/MP/raw/cifs/mp-6576.cif,mp-6576,0.0,,2011-05-13 05:21:43,6.099730998852292,10.17188/1281366,"@misc{osti_1281366,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281366"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688230'}},0.0,6.81083016,520.0,-43.677878,-7.279646333333333,{'tags': []},-43.677878,-7.279646333333333,-0.5109282141666659,"['xas', 'bandstructure']",True,"[75816, 89142, 83231, 79574, 41549]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6576,,YNi2B2C,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6576,"['mp-6576', 'mp-1007054', 'mp-1000583', 'mp-1439516', 'mp-1688230', 'mp-1794280', 'mp-1011792', 'mp-1597064']",0.0006603,"{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.3152437079014,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",1.010943177297096e-05,0.0006603,0,0.0006603,MP,data/source/MP/cleaned/cifs/MP-mp-6576.cif,True,,data/final/MP/graphs/B2C1Ni2Tb0.05Y0.95-MP-mp-6576-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As1Ce1Co0.1Fe0.9O1,2,0.0499999999999999,2.0,False,As2Ce2Co0.2Fe1.8O2,As2Ce2Fe2O2,10.0,Ferrite,True,As25Ce25Co2.5Fe22.5O25,As-Ce-Co-Fe-O,5,Supercon,Ce1Fe0.9Co0.1As1O1,MP-mp-605060,Ce2Fe2As2O2,As-Ce-Fe-O,As25Ce25Fe25O25,P 4 m m,tetragonal,3.992256,3.992256,9.041971,data/final/MP/cifs/As1Ce1Co0.1Fe0.9O1-MP-mp-605060-synth_doped.cif,data/source/MP/raw/cifs/mp-605060.cif,mp-605060,0.0,,2014-02-14 20:12:08,6.611233843492404,10.17188/1277425,"@misc{osti_1277425,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeFeAsO (SG:99) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277425"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-1751604'}},0.2072581873958352,6.30288445,520.0,-55.74271596,-6.967839495,{'tags': []},-55.74271596,-6.967839495,-1.7010452412499992,['bandstructure'],True,[],True,2021-05-12 10:58:51.532000,FiM,8,10,mp-605060,oxide,CeFeAsO,"{'functional': 'PBE', 'labels': ['Ce', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-605060,"['mp-605060', 'mp-917114', 'mp-918266', 'mp-919274', 'mp-1443189', 'mp-1751604', 'mp-1770633', 'mp-1779614', 'mp-1873964', 'mp-1622328']",2.99945325,"{'Ce': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",144.11191005541338,[],FiM,True,99,3,"[-0.5, -0.5, 3.5, 3.5, 0.0, 0.0, 0.0, 0.0]",0.0416267225775671,2.99945325,4,5.9989065,MP,data/source/MP/cleaned/cifs/MP-mp-605060.cif,True,,data/final/MP/graphs/As1Ce1Co0.1Fe0.9O1-MP-mp-605060-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
As2Fe2Mg1Sr4Ti1O6,1,0.0,1.0,True,As2Fe2Mg1Sr4Ti1O6,As2Fe2Mg1Sr4Ti1O6,6.0,Ferrite,True,As12.5Fe12.5Mg6.25Sr25Ti6.25O37.5,As-Fe-Mg-Sr-Ti-O,6,Supercon,Fe2As2Sr4Mg1Ti1O6,MP-mp-1218475,Sr4Mg1Ti1Fe2As2O6,As-Fe-Mg-Sr-Ti-O,As12.5Fe12.5Mg6.25Sr25Ti6.25O37.5,P 4 m m,tetragonal,4.015363,4.015363,16.837343,data/final/MP/cifs/As2Fe2Mg1Sr4Ti1O6-MP-mp-1218475.cif,data/source/MP/raw/cifs/mp-1218475.cif,mp-1218475,0.0,,2019-01-12 19:38:13.106000,4.772232743847063,,,,0.596506169999997,3.61641349,520.0,-93.06331959,-5.816457474375,{'tags': []},-93.06331959,-5.816457474375,-1.8435971231250008,[],False,[],True,2021-05-12 11:00:42.526000,FM,16,3,mp-1218475,oxide,Sr4MgTiFe2(AsO3)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Mg_pv', 'Ti_pv', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Sr': 4.0, 'Mg': 1.0, 'Ti': 1.0, 'Fe': 2.0, 'As': 2.0, 'O': 6.0}",GGA+U,mp-1218475,"['mp-1218475', 'mp-1332338', 'mp-1770100']",0.1094594,"{'Sr': 4.0, 'Mg': 1.0, 'Ti': 1.0, 'Fe': 2.0, 'As': 2.0, 'O': 6.0}",271.4708387835521,[],FM,True,25,1,"[-0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, 0.1, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0004032086852881,0.1094594,1,0.1094594,MP,data/source/MP/cleaned/cifs/MP-mp-1218475.cif,False,,data/final/MP/graphs/As2Fe2Mg1Sr4Ti1O6-MP-mp-1218475.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
Ga0.7Sn0.3V3,3,0.15,2.0,False,Ga1.4Sn0.6V6,Ga2V6,7.2,Other,True,Ga17.5Sn7.5V75,Ga-Sn-V,3,Supercon,V3Ga0.7Sn0.3,MP-mp-22568,V6Ga2,Ga-V,Ga25V75,P m -3 n,cubic,4.789645,4.789645,4.789645,data/final/MP/cifs/Ga0.7Sn0.3V3-MP-mp-22568-synth_doped.cif,data/source/MP/raw/cifs/mp-22568.cif,mp-22568,0.0,,2014-02-22 11:36:40,6.726541666276222,10.17188/1198793,"@misc{osti_1198793,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Ga (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198793"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686867'}},0.0,5.67452231,520.0,-61.95244347,-7.74405543375,{'tags': ['Gallium vanadium (1/3)']},-61.95244347,-7.74405543375,-0.1741018756249994,"['xas', 'elasticity', 'bandstructure']",True,"[635643, 635628, 635619, 635634, 104021, 635646, 635604, 635610, 635617, 635624, 635626, 635605, 635631, 635625, 635636, 635603, 104020, 635616, 635607]",True,2021-05-12 10:56:16.728000,FM,8,9,mp-22568,,V3Ga,"{'functional': 'PBE', 'labels': ['V_pv', 'Ga_d'], 'pot_type': 'paw'}","{'V': 3.0, 'Ga': 1.0}",GGA,mp-22568,"['mp-941343', 'mp-941663', 'mp-934924', 'mp-22568', 'mp-1440749', 'mp-1686867', 'mp-1804076', 'mp-1593784', 'mp-1595713']",0.09063635,"{'V': 6.0, 'Ga': 2.0}",109.87780534443452,[],FM,True,131,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.0, -0.0, -0.0]",0.0016497662965852,0.09063635,2,0.1812727,MP,data/source/MP/cleaned/cifs/MP-mp-22568.cif,True,,data/final/MP/graphs/Ga0.7Sn0.3V3-MP-mp-22568-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Al0.95B0.05Nb3,2,0.025,2.0,False,Al1.9B0.1Nb6,Al2Nb6,19.1,Other,True,Al23.75B1.25Nb75,Al-B-Nb,3,Supercon,Al0.95B0.05Nb3,MP-mp-796,Nb6Al2,Al-Nb,Al25Nb75,P m -3 n,cubic,5.215254,5.215254,5.215254,data/final/MP/cifs/Al0.95B0.05Nb3-MP-mp-796-synth_doped.cif,data/source/MP/raw/cifs/mp-796.cif,mp-796,0.0,,2011-05-13 16:07:37,7.157298025966356,,,{'GGA': {'task_id': 'mp-1686893'}},0.0460773865000003,5.52947534,520.0,-69.48918494,-8.6861481175,"{'tags': ['Aluminium niobium (1/3)', 'Niobium aluminide (3/1)', 'Aluminum niobium (1/3)']}",-69.48918494,-8.6861481175,-0.1737753800000003,"['bandstructure', 'elasticity']",True,"[608675, 608654, 608688, 608668, 608669, 608685, 608676, 608683, 58014, 608657, 107856, 608655, 608666, 608691, 608656, 608665, 608673, 608653, 608661]",True,2021-05-12 10:56:31.128000,NM,8,10,mp-796,,Nb3Al,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Al': 1.0}",GGA,mp-796,"['mp-911586', 'mp-927906', 'mp-796', 'mp-927472', 'mp-1260512', 'mp-1440919', 'mp-1686893', 'mp-1927652', 'mp-1591599', 'mp-1587739']",0.16323955,"{'Nb': 6.0, 'Al': 2.0}",141.8490379078192,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0023015954483396,0.16323955,0,0.3264791,MP,data/source/MP/cleaned/cifs/MP-mp-796.cif,True,,data/final/MP/graphs/Al0.95B0.05Nb3-MP-mp-796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Sb6Sn3,1,0.0,4.0,False,Ba8Sb24Sn12,Ba8Sb24Sn12,3.9,Other,True,Ba18.182Sb54.545Sn27.273,Ba-Sb-Sn,3,Supercon,Ba2Sn3Sb6,MP-mp-29087,Ba8Sn12Sb24,Ba-Sb-Sn,Ba18.182Sb54.545Sn27.273,P n m a,orthorhombic,4.493585,13.615608,25.00858,data/final/MP/cifs/Ba2Sb6Sn3-MP-mp-29087.cif,data/source/MP/raw/cifs/mp-29087.cif,mp-29087,0.0,,2014-02-18 00:28:32,5.90959797064918,10.17188/1203158,"@misc{osti_1203158,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2(SnSb2)3 (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1203158"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-931915'}},0.0,5.40516895,520.0,-180.92005175,-4.111819357954546,{'tags': ['Barium tin antimonide (2/3/6)']},-180.92005175,-4.111819357954546,-0.521940752045455,"['xas', 'bandstructure']",True,[82529],True,2021-05-12 10:57:03.017000,NM,44,5,mp-29087,,Ba2(SnSb2)3,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Sn_d', 'Sb'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Sn': 3.0, 'Sb': 6.0}",GGA,mp-29087,"['mp-916664', 'mp-937331', 'mp-931915', 'mp-29087', 'mp-1354498']",0.01133815,"{'Ba': 8.0, 'Sn': 12.0, 'Sb': 24.0}",1530.0972460792848,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.964033829628236e-05,0.01133815,0,0.0453526,MP,data/source/MP/cleaned/cifs/MP-mp-29087.cif,False,,data/final/MP/graphs/Ba2Sb6Sn3-MP-mp-29087.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
In1N1,1,0.0,2.0,False,In2N2,In2N2,1.975,Other,True,In50N50,In-N,2,Supercon,In1N1,MP-mp-22205,In2N2,In-N,In50N50,P 63 m c,hexagonal,3.583881995408173,3.58388212,5.790932,data/final/MP/cifs/In1N1-MP-mp-22205.cif,data/source/MP/raw/cifs/mp-22205.cif,mp-22205,0.4777000000000004,,2013-09-20 22:54:55,6.641890506103773,10.17188/1183678,"@misc{osti_1183678,
    author = ""Persson, Kristin"",
    title = ""Materials Data on InN (SG:186) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1183678"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668477'}},0.0,6.07833277,520.0,-21.76974227,-5.4424355675,"{'tags': ['Indium nitride', 'Indium nitride - wurtzite-type']}",-21.76974227,-5.4424355675,-0.0788462399999998,"['piezo', 'eos', 'xas', 'bandstructure', 'diel', 'elasticity']",True,"[184927, 162684, 157515, 67768, 181366, 41999, 640026, 191774, 41544, 190428, 25677, 109463]",True,2021-05-12 10:56:16.728000,NM,4,23,mp-22205,,InN,"{'functional': 'PBE', 'labels': ['In_d', 'N'], 'pot_type': 'paw'}","{'In': 1.0, 'N': 1.0}",GGA,mp-22205,"['mp-654614', 'mp-654674', 'mp-22205', 'mp-1063975', 'mp-1063995', 'mp-1064037', 'mp-1066436', 'mp-1066448', 'mp-1066487', 'mp-1067486', 'mp-1067514', 'mp-1067561', 'mp-1141928', 'mp-1114715', 'mp-1440588', 'mp-1668477', 'mp-1784320', 'mp-1594393', 'mp-1595007', 'mp-1067555', 'mp-1066478', 'mp-1064025', 'mp-654997']",5.79e-05,"{'In': 2.0, 'N': 2.0}",64.4149273151787,[],NM,False,186,0,"[0, 0, 0, 0]",1.797719951361537e-06,5.79e-05,0,0.0001158,MP,data/source/MP/cleaned/cifs/MP-mp-22205.cif,False,,data/final/MP/graphs/In1N1-MP-mp-22205.json,0,True,6mm,0,5,0,0,0,0,0,1,0,0,0,1.0,False
In31.5Sb68.5,2,0.0366666666666666,0.03,False,In0.945Sb2.055,In1Sb2,3.7,Other,True,In31.5Sb68.5,In-Sb,2,Supercon,In31.5Sb68.5,MP-mp-1212332,In1Sb2,In-Sb,In33.333Sb66.667,P m m m,orthorhombic,15.710309,16.547481,16.636454,data/final/MP/cifs/In31.5Sb68.5-MP-mp-1212332-synth_doped.cif,data/source/MP/raw/cifs/mp-1212332.cif,mp-1212332,0.0026999999999999,,2019-01-12 14:32:22.817000,0.1375829385914826,,,,1.4638931066666667,-4.4853512,520.0,-6.65211369,-2.21737123,"{'tags': ['InSb', 'InSb hp2']}",-6.65211369,-2.21737123,1.324524173333333,[],False,[],True,2021-05-12 11:00:28.874000,FM,3,2,mp-1212332,,InSb2,"{'functional': 'PBE', 'labels': ['In_d', 'Sb'], 'pot_type': 'paw'}","{'In': 1.0, 'Sb': 2.0}",GGA,mp-1212332,"['mp-1212332', 'mp-1338476']",2.9927222,"{'In': 1.0, 'Sb': 2.0}",4324.913060725596,[],FM,True,47,1,"[0.0, 0.5, 0.5]",0.0006919727999105,2.9927222,2,2.9927222,MP,data/source/MP/cleaned/cifs/MP-mp-1212332.cif,True,,data/final/MP/graphs/In31.5Sb68.5-MP-mp-1212332-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
La2Ni1O4.18,2,0.0214882610425785,3.82791706539075,False,La7.656Ni3.828O16,La8Ni4O16,0.0,Oxide,True,La27.855Ni13.928O58.21727019498607,La-Ni-O,3,Supercon,La2Ni1O4.18,MP-mp-21874,La8Ni4O16,La-Ni-O,La28.571Ni14.286O57.142857142857146,P 42/n c m,tetragonal,5.607892,5.607892,12.423229,data/final/MP/cifs/La2Ni1O4.18-MP-mp-21874-synth_doped.cif,data/source/MP/raw/cifs/mp-21874.cif,mp-21874,0.0346000000000001,,2013-06-09 07:15:40,6.808946783295827,,,{'GGA+U': {'task_id': 'mp-1767279'}},0.0468913437499995,7.93744356,520.0,-206.53456634,-7.376234512142857,"{'tags': ['Dilanthanum niccolate', 'Dilanthanum niccolate - LT']}",-206.53456634,-7.376234512142857,-3.0683780964285714,"['xas', 'bandstructure']",True,"[63396, 65920, 69753, 56319]",True,2021-05-12 10:57:01.079000,AFM,28,17,mp-21874,oxide,La2NiO4,"{'functional': 'PBE', 'labels': ['La', 'Ni_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Ni': 1.0, 'O': 4.0}",GGA+U,mp-21874,"['mp-795798', 'mp-819481', 'mp-616538', 'mp-25711', 'mp-21874', 'mp-1272397', 'mp-1287242', 'mp-1273910', 'mp-1289543', 'mp-1295462', 'mp-1287775', 'mp-1281171', 'mp-1283506', 'mp-1422956', 'mp-1767279', 'mp-820353', 'mp-1629609']",2.9e-06,"{'La': 8.0, 'Ni': 4.0, 'O': 16.0}",390.6913293848223,[],AFM,True,14,1,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -1.7, -1.7, 1.7, 1.7, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",2.9690958379509523e-08,2.9e-06,4,1.16e-05,MP,data/source/MP/cleaned/cifs/MP-mp-21874.cif,True,,data/final/MP/graphs/La2Ni1O4.18-MP-mp-21874-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B2C1Pd2Th1,1,0.0,1.0,True,B2C1Pd2Th1,B2C1Pd2Th1,14.5,Other,True,B33.333C16.667Pd33.333Th16.667,B-C-Pd-Th,4,Supercon,Th1Pd2B2C1,MP-mp-1025041,Th1B2Pd2C1,B-C-Pd-Th,B33.333C16.667Pd33.333Th16.667,I 4/m m m,tetragonal,3.856834002045447,3.856834002045447,6.04000088,data/final/MP/cifs/B2C1Pd2Th1-MP-mp-1025041.cif,data/source/MP/raw/cifs/mp-1025041.cif,mp-1025041,0.0,,2016-09-27 13:40:40,9.911753672573182,10.17188/1355476,"@article{osti_1355476,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ThB2Pd2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1355476"",
    place = ""United States"",
    year = ""2017"",
    month = ""5""
}
",{'GGA': {'task_id': 'mp-1757666'}},0.1050753561111008,7.18358172,520.0,-43.40440902,-7.23406817,{'tags': []},-43.40440902,-7.23406817,-0.5075371513888894,['bandstructure'],True,[],True,2021-05-12 10:58:09.072000,NM,6,5,mp-1025041,,ThB2Pd2C,"{'functional': 'PBE', 'labels': ['Th', 'B', 'Pd', 'C'], 'pot_type': 'paw'}","{'Th': 1.0, 'B': 2.0, 'Pd': 2.0, 'C': 1.0}",GGA,mp-1025041,"['mp-1025041', 'mp-1396120', 'mp-1757666', 'mp-1783345', 'mp-1623943']",0.0007285,"{'Th': 1.0, 'B': 2.0, 'Pd': 2.0, 'C': 1.0}",80.16601673295767,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",9.08739176135841e-06,0.0007285,0,0.0007285,MP,data/source/MP/cleaned/cifs/MP-mp-1025041.cif,False,,data/final/MP/graphs/B2C1Pd2Th1-MP-mp-1025041.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ag5Sr1,1,0.0,1.0,True,Ag5Sr1,Ag5Sr1,0.0,Other,True,Ag83.333Sr16.667,Ag-Sr,2,Supercon,Ag5Sr1,MP-mp-2410,Sr1Ag5,Ag-Sr,Ag83.333Sr16.667,P 6/m m m,hexagonal,4.692226,5.767348002767435,5.76734724,data/final/MP/cifs/Ag5Sr1-MP-mp-2410.cif,data/source/MP/raw/cifs/mp-2410.cif,mp-2410,0.0,,2011-05-13 11:30:24,7.702431281008088,10.17188/1199911,"@misc{osti_1199911,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SrAg5 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199911"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702800'}},0.0,2.81822674,520.0,-16.96795508,-2.827992513333333,{'tags': ['Silver strontium (5/1)']},-16.96795508,-2.827992513333333,-0.1859469349999999,"['xas', 'elasticity', 'bandstructure']",True,"[605874, 58361]",True,2021-05-12 10:56:16.728000,NM,6,8,mp-2410,,SrAg5,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ag'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Ag': 5.0}",GGA,mp-2410,"['mp-992598', 'mp-992659', 'mp-2410', 'mp-1429690', 'mp-1702800', 'mp-1925525', 'mp-994097', 'mp-1595481']",0.0062402,"{'Sr': 1.0, 'Ag': 5.0}",135.16423525927843,[],NM,False,191,0,"[0, 0, 0, 0, 0, 0]",4.616753823990313e-05,0.0062402,0,0.0062402,MP,data/source/MP/cleaned/cifs/MP-mp-2410.cif,False,,data/final/MP/graphs/Ag5Sr1-MP-mp-2410.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
La1Pt3Si1,1,0.0,1.0,True,La1Pt3Si1,La1Pt3Si1,0.3,Other,True,La20Pt60Si20,La-Pt-Si,3,Supercon,La1Pt3Si1,MP-mp-1206882,La1Si1Pt3,La-Pt-Si,La20Pt60Si20,P 4 m m,tetragonal,4.155867,4.155867,5.524663,data/final/MP/cifs/La1Pt3Si1-MP-mp-1206882.cif,data/source/MP/raw/cifs/mp-1206882.cif,mp-1206882,0.0,,2019-01-12 10:06:12.326000,13.091160966231165,,,,0.0,8.23955808,520.0,-34.03564008,-6.807128016,"{'tags': ['LaPt3Si', 'CePt3B']}",-34.03564008,-6.807128016,-1.092319165,[],False,[],True,2021-05-12 11:00:17.126000,NM,5,2,mp-1206882,,LaSiPt3,"{'functional': 'PBE', 'labels': ['La', 'Si', 'Pt'], 'pot_type': 'paw'}","{'La': 1.0, 'Si': 1.0, 'Pt': 3.0}",GGA,mp-1206882,"['mp-1206882', 'mp-1925606']",0.0007106,"{'La': 1.0, 'Si': 1.0, 'Pt': 3.0}",95.41772822764592,[],NM,False,99,0,"[0, 0, 0, 0, 0]",7.447253389901123e-06,0.0007106,0,0.0007106,MP,data/source/MP/cleaned/cifs/MP-mp-1206882.cif,False,,data/final/MP/graphs/La1Pt3Si1-MP-mp-1206882.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
Pd1Te1,1,0.0,2.0,False,Pd2Te2,Pd2Te2,3.01,Other,True,Pd50Te50,Pd-Te,2,Supercon,Pd1Te1,MP-mp-564,Te2Pd2,Pd-Te,Pd50Te50,P 63/m m c,hexagonal,4.211913996826707,4.21191441,5.750165,data/final/MP/cifs/Pd1Te1-MP-mp-564.cif,data/source/MP/raw/cifs/mp-564.cif,mp-564,0.0,,2011-05-12 20:38:42,8.797556863442345,10.17188/1272402,"@misc{osti_1272402,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TePd (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1272402"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672092'}},0.0,7.00857104,520.0,-18.10773598,-4.526933995,"{'tags': ['Kotulskite', 'Palladium telluride (1/1) - HT', 'Palladium telluride']}",-18.10773598,-4.526933995,-0.5763426250000006,"['bandstructure', 'elasticity']",True,"[42552, 659960, 648992, 649009, 42553]",True,2021-05-12 10:56:22.739000,NM,4,8,mp-564,,TePd,"{'functional': 'PBE', 'labels': ['Te', 'Pd'], 'pot_type': 'paw'}","{'Te': 1.0, 'Pd': 1.0}",GGA,mp-564,"['mp-924879', 'mp-925457', 'mp-564', 'mp-909859', 'mp-1439012', 'mp-1672092', 'mp-1802280', 'mp-1589565']",0.00130155,"{'Te': 2.0, 'Pd': 2.0}",88.34256109910021,[],NM,False,194,0,"[0, 0, 0, 0]",2.946597843229737e-05,0.00130155,0,0.0026031,MP,data/source/MP/cleaned/cifs/MP-mp-564.cif,False,,data/final/MP/graphs/Pd1Te1-MP-mp-564.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
C0.35N0.65Nb1,3,0.15,2.0,False,C0.7N1.3Nb2,C1N1Nb2,17.8,Other,True,C17.5N32.5Nb50,C-N-Nb,3,Supercon,C0.35N0.65Nb1,MP-mp-1220725,Nb2C1N1,C-N-Nb,C25N25Nb50,R -3 m,trigonal,3.176830066338471,3.176830066338471,5.50452744,data/final/MP/cifs/C0.35N0.65Nb1-MP-mp-1220725-synth_doped.cif,data/source/MP/raw/cifs/mp-1220725.cif,mp-1220725,0.0,,2019-01-12 21:31:38.750000,7.754501067535733,,,{'GGA': {'task_id': 'mp-1766607'}},0.0753444154166675,7.65744358,520.0,-40.59990484,-10.14997621,{'tags': []},-40.59990484,-10.14997621,-0.7987547837499989,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,4,5,mp-1220725,,Nb2CN,"{'functional': 'PBE', 'labels': ['Nb_pv', 'C', 'N'], 'pot_type': 'paw'}","{'Nb': 2.0, 'C': 1.0, 'N': 1.0}",GGA,mp-1220725,"['mp-1220725', 'mp-1422536', 'mp-1766607', 'mp-1794614', 'mp-1612365']",0.0016814,"{'Nb': 2.0, 'C': 1.0, 'N': 1.0}",45.36104297370486,[],NM,False,166,0,"[0, 0, 0, 0]",3.706704894273889e-05,0.0016814,0,0.0016814,MP,data/source/MP/cleaned/cifs/MP-mp-1220725.cif,True,,data/final/MP/graphs/C0.35N0.65Nb1-MP-mp-1220725-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Al0.39Ge0.61Nb3,3,0.0549999999999999,2.0,False,Al0.78Ge1.22Nb6,Al1Ge1Nb6,7.3,Other,True,Al9.75Ge15.25Nb75,Al-Ge-Nb,3,Supercon,Nb3Al0.39Ge0.61,MP-mp-1220344,Nb6Al1Ge1,Al-Ge-Nb,Al12.5Ge12.5Nb75,P m -3,cubic,5.193789,5.193789,5.193789,data/final/MP/cifs/Al0.39Ge0.61Nb3-MP-mp-1220344-synth_doped.cif,data/source/MP/raw/cifs/mp-1220344.cif,mp-1220344,0.0,,2019-01-12 21:12:22.670000,7.787554520755366,,,{'GGA': {'task_id': 'mp-1754189'}},0.0456705447083347,5.7081774,520.0,-70.77042247,-8.84630280875,{'tags': []},-70.77042247,-8.84630280875,-0.2242485681249988,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,8,5,mp-1220344,,Nb6AlGe,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al', 'Ge_d'], 'pot_type': 'paw'}","{'Nb': 6.0, 'Al': 1.0, 'Ge': 1.0}",GGA,mp-1220344,"['mp-1220344', 'mp-1388432', 'mp-1754189', 'mp-1925908', 'mp-1619029']",0.0004952,"{'Nb': 6.0, 'Al': 1.0, 'Ge': 1.0}",140.10476523412882,[],NM,False,200,0,"[0, 0, 0, 0, 0, 0, 0, 0]",3.534497910706122e-06,0.0004952,0,0.0004952,MP,data/source/MP/cleaned/cifs/MP-mp-1220344.cif,True,,data/final/MP/graphs/Al0.39Ge0.61Nb3-MP-mp-1220344-synth_doped.json,0,True,m-3,2,0,0,0,0,0,0,1,0,0,0,1.0,False
C2La0.95Ni1Y0.05,2,0.025,1.0,True,C2La0.95Ni1Y0.05,C2La1Ni1,2.79,Other,True,C50La23.75Ni25Y1.25,C-La-Ni-Y,4,Supercon,La0.95Y0.05Ni1C2,MP-mp-1018048,La1Ni1C2,C-La-Ni,C50La25Ni25,A m m 2,orthorhombic,3.82731293,3.82731293,3.977635,data/final/MP/cifs/C2La0.95Ni1Y0.05-MP-mp-1018048-synth_doped.cif,data/source/MP/raw/cifs/mp-1018048.cif,mp-1018048,0.0,,2017-04-06 23:27:44,6.5955568384756855,10.17188/1350127,"@article{osti_1350127,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaNiC2 (SG:38) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1350127"",
    place = ""United States"",
    year = ""2017"",
    month = ""4""
}
",{'GGA': {'task_id': 'mp-1697101'}},0.0,8.87914765,520.0,-30.18892584,-7.54723146,"{'tags': ['LaNiC2', 'Lanthanum nickel carbide (1/1/2)', 'CeNiC2']}",-30.18892584,-7.54723146,-0.2548051637499995,"['bandstructure', 'elasticity']",True,[618179],True,2021-05-12 10:56:08.727000,NM,4,12,mp-1018048,,LaNiC2,"{'functional': 'PBE', 'labels': ['La', 'Ni_pv', 'C'], 'pot_type': 'paw'}","{'La': 1.0, 'Ni': 1.0, 'C': 2.0}",GGA,mp-1018048,"['mp-1018048', 'mp-1018270', 'mp-1018463', 'mp-1067001', 'mp-1067047', 'mp-1067181', 'mp-1115476', 'mp-1412950', 'mp-1697101', 'mp-1783297', 'mp-1594865', 'mp-1067093']",0.005804,"{'La': 1.0, 'Ni': 1.0, 'C': 2.0}",55.79651958097468,[],NM,False,38,0,"[0.0, -0.0, 0.0, 0.0]",0.0001040208250189,0.005804,0,0.005804,MP,data/source/MP/cleaned/cifs/MP-mp-1018048.cif,True,,data/final/MP/graphs/C2La0.95Ni1Y0.05-MP-mp-1018048-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Ba2Cu3Nd0.92Pr0.08O7,2,0.0123076923076923,1.0,True,Ba2Cu3Nd0.92Pr0.08O7,Ba2Cu3Nd1O7,68.2,Cuprate,True,Ba15.385Cu23.077Nd7.077Pr0.615O53.84615384615385,Ba-Cu-Nd-Pr-O,5,Supercon,Nd0.92Pr0.08Ba2Cu3O7,MP-mp-22719,Ba2Nd1Cu3O7,Ba-Cu-Nd-O,Ba15.385Cu23.077Nd7.692O53.84615384615385,P m m m,orthorhombic,3.893817,3.958458,11.89947,data/final/MP/cifs/Ba2Cu3Nd0.92Pr0.08O7-MP-mp-22719-synth_doped.cif,data/source/MP/raw/cifs/mp-22719.cif,mp-22719,0.0,,2015-01-22 21:32:23,6.532421108031168,10.17188/1198922,"@misc{osti_1198922,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2NdCu3O7 (SG:47) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198922"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704234'}},0.0180149053205083,3.13221275,520.0,-78.75337907,-6.057952236153846,"{'tags': ['Neodymium barium copper oxide (1/2/3/7)', 'Neodymium dibarium tricopper heptaoxide']}",-78.75337907,-6.057952236153846,-2.155611319615384,"['bandstructure', 'elasticity']",True,"[86960, 81169]",True,2021-05-12 10:56:16.728000,NM,13,8,mp-22719,oxide,Ba2NdCu3O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Nd_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Nd': 1.0, 'Cu': 3.0, 'O': 7.0}",GGA,mp-22719,"['mp-926068', 'mp-925655', 'mp-917559', 'mp-1427130', 'mp-1704234', 'mp-1829984', 'mp-1600543', 'mp-22719']",0.0444215,"{'Ba': 2.0, 'Nd': 1.0, 'Cu': 3.0, 'O': 7.0}",183.4126123839547,[],NM,False,47,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0002421943585155,0.0444215,0,0.0444215,MP,data/source/MP/cleaned/cifs/MP-mp-22719.cif,True,,data/final/MP/graphs/Ba2Cu3Nd0.92Pr0.08O7-MP-mp-22719-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
As2Co0.3Fe1.7Mg1Sr4Ti1O6,3,0.0375,1.0,True,As2Co0.3Fe1.7Mg1Sr4Ti1O6,As2Fe2Mg1Sr4Ti1O6,16.0,Ferrite,True,As12.5Co1.875Fe10.625Mg6.25Sr25Ti6.25O37.5,As-Co-Fe-Mg-Sr-Ti-O,7,Supercon,Fe1.7Co0.3As2Sr4Mg1Ti1O6,MP-mp-1218475,Sr4Mg1Ti1Fe2As2O6,As-Fe-Mg-Sr-Ti-O,As12.5Fe12.5Mg6.25Sr25Ti6.25O37.5,P 4 m m,tetragonal,4.015363,4.015363,16.837343,data/final/MP/cifs/As2Co0.3Fe1.7Mg1Sr4Ti1O6-MP-mp-1218475-synth_doped.cif,data/source/MP/raw/cifs/mp-1218475.cif,mp-1218475,0.0,,2019-01-12 19:38:13.106000,4.772232743847063,,,,0.596506169999997,3.61641349,520.0,-93.06331959,-5.816457474375,{'tags': []},-93.06331959,-5.816457474375,-1.8435971231250008,[],False,[],True,2021-05-12 11:00:42.526000,FM,16,3,mp-1218475,oxide,Sr4MgTiFe2(AsO3)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Mg_pv', 'Ti_pv', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Sr': 4.0, 'Mg': 1.0, 'Ti': 1.0, 'Fe': 2.0, 'As': 2.0, 'O': 6.0}",GGA+U,mp-1218475,"['mp-1218475', 'mp-1332338', 'mp-1770100']",0.1094594,"{'Sr': 4.0, 'Mg': 1.0, 'Ti': 1.0, 'Fe': 2.0, 'As': 2.0, 'O': 6.0}",271.4708387835521,[],FM,True,25,1,"[-0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, 0.1, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0004032086852881,0.1094594,1,0.1094594,MP,data/source/MP/cleaned/cifs/MP-mp-1218475.cif,True,,data/final/MP/graphs/As2Co0.3Fe1.7Mg1Sr4Ti1O6-MP-mp-1218475-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
Fe4P12Yb1,1,0.0,1.0,True,Fe4P12Yb1,Fe4P12Yb1,0.0,Ferrite,True,Fe23.529P70.588Yb5.882,Fe-P-Yb,3,Supercon,Yb1Fe4P12,MP-mp-12956,Yb1Fe4P12,Fe-P-Yb,Fe23.529P70.588Yb5.882,I m -3,cubic,6.738675301493859,6.7386753,6.7386753,data/final/MP/cifs/Fe4P12Yb1-MP-mp-12956.cif,data/source/MP/raw/cifs/mp-12956.cif,mp-12956,0.0,,2011-06-03 21:36:39,5.414621077391598,10.17188/1189288,"@misc{osti_1189288,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Yb(FeP3)4 (SG:204) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189288"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1708166'}},0.0,7.63184653,520.0,-109.85790734,-6.462229843529411,{'tags': ['Ytterbium iron tetraphosphide (1/4/3)']},-109.85790734,-6.462229843529411,-0.5575667752941175,"['xas', 'elasticity', 'bandstructure']",True,[156464],True,2021-05-12 10:56:12.755000,NM,17,8,mp-12956,,Yb(FeP3)4,"{'functional': 'PBE', 'labels': ['Yb_2', 'Fe_pv', 'P'], 'pot_type': 'paw'}","{'Yb': 1.0, 'Fe': 4.0, 'P': 12.0}",GGA,mp-12956,"['mp-990666', 'mp-914845', 'mp-12956', 'mp-1421439', 'mp-1708166', 'mp-1925783', 'mp-992781', 'mp-1605154']",0.0085505,"{'Yb': 1.0, 'Fe': 4.0, 'P': 12.0}",235.56008456326805,[],NM,False,204,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",3.629859454267372e-05,0.0085505,0,0.0085505,MP,data/source/MP/cleaned/cifs/MP-mp-12956.cif,False,,data/final/MP/graphs/Fe4P12Yb1-MP-mp-12956.json,0,True,m-3,2,0,0,0,0,0,0,0,0,1,0,1.0,False
Ce0.1Cu1Pr1.9O4,2,0.0285714285714285,1.0,True,Ce0.1Cu1Pr1.9O4,Cu1Pr2O4,0.0,Cuprate,True,Ce1.429Cu14.286Pr27.143O57.142857142857146,Ce-Cu-Pr-O,4,Supercon,Pr1.9Ce0.1Cu1O4,MP-mp-4181,Pr2Cu1O4,Cu-Pr-O,Cu14.286Pr28.571O57.142857142857146,I 4/m m m,tetragonal,3.995734002478021,3.995734002478021,6.85109716,data/final/MP/cifs/Ce0.1Cu1Pr1.9O4-MP-mp-4181-synth_doped.cif,data/source/MP/raw/cifs/mp-4181.cif,mp-4181,0.0,,2011-05-13 10:21:01,6.821515862307185,10.17188/1207928,"@misc{osti_1207928,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Pr2CuO4 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207928"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-669887'}},0.0,3.15418113,520.0,-51.2919541,-7.327422014285714,"{'tags': ['Dipraseodymium cuprate', 'Dipraseodymium copper oxide', 'Praseodymium cuprate', 'Dipraseodymium copper tetraoxide']}",-51.2919541,-7.327422014285714,-2.9410150171428566,"['xas', 'elasticity', 'bandstructure']",True,"[91071, 261374, 71180, 186589, 185267, 185268, 65925, 65924, 191813, 261373, 202884, 72241]",True,2021-05-12 10:56:20.740000,NM,7,12,mp-4181,oxide,Pr2CuO4,"{'functional': 'PBE', 'labels': ['Pr_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Pr': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-4181,"['mp-669887', 'mp-660138', 'mp-4181', 'mp-1077961', 'mp-1077976', 'mp-1077987', 'mp-1078042', 'mp-1442060', 'mp-1687781', 'mp-1797293', 'mp-1589370', 'mp-688743']",0.0084498,"{'Pr': 2.0, 'Cu': 1.0, 'O': 4.0}",99.64888441679796,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",8.479573102552068e-05,0.0084498,0,0.0084498,MP,data/source/MP/cleaned/cifs/MP-mp-4181.cif,True,,data/final/MP/graphs/Ce0.1Cu1Pr1.9O4-MP-mp-4181-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ga0.793Sb0.207V3,3,0.1034999999999999,2.0,False,Ga1.586Sb0.414V6,Ga2V6,6.9,Other,True,Ga19.825Sb5.175V75,Ga-Sb-V,3,Supercon,V3Ga0.793Sb0.207,MP-mp-22568,V6Ga2,Ga-V,Ga25V75,P m -3 n,cubic,4.789645,4.789645,4.789645,data/final/MP/cifs/Ga0.793Sb0.207V3-MP-mp-22568-synth_doped.cif,data/source/MP/raw/cifs/mp-22568.cif,mp-22568,0.0,,2014-02-22 11:36:40,6.726541666276222,10.17188/1198793,"@misc{osti_1198793,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Ga (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198793"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686867'}},0.0,5.67452231,520.0,-61.95244347,-7.74405543375,{'tags': ['Gallium vanadium (1/3)']},-61.95244347,-7.74405543375,-0.1741018756249994,"['xas', 'elasticity', 'bandstructure']",True,"[635643, 635628, 635619, 635634, 104021, 635646, 635604, 635610, 635617, 635624, 635626, 635605, 635631, 635625, 635636, 635603, 104020, 635616, 635607]",True,2021-05-12 10:56:16.728000,FM,8,9,mp-22568,,V3Ga,"{'functional': 'PBE', 'labels': ['V_pv', 'Ga_d'], 'pot_type': 'paw'}","{'V': 3.0, 'Ga': 1.0}",GGA,mp-22568,"['mp-941343', 'mp-941663', 'mp-934924', 'mp-22568', 'mp-1440749', 'mp-1686867', 'mp-1804076', 'mp-1593784', 'mp-1595713']",0.09063635,"{'V': 6.0, 'Ga': 2.0}",109.87780534443452,[],FM,True,131,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.0, -0.0, -0.0]",0.0016497662965852,0.09063635,2,0.1812727,MP,data/source/MP/cleaned/cifs/MP-mp-22568.cif,True,,data/final/MP/graphs/Ga0.793Sb0.207V3-MP-mp-22568-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
As1Fe1Nd1O0.85,3,0.0584415584415584,2.0,False,As2Fe2Nd2O1.7,As2Fe2Nd2O2,51.45,Ferrite,True,As25.974Fe25.974Nd25.974O22.07792207792208,As-Fe-Nd-O,4,Supercon,Nd1Fe1As1O0.85,MP-mp-622621,Nd2Fe2As2O2,As-Fe-Nd-O,As25Fe25Nd25O25,P 4/n m m,tetragonal,4.074653,4.074653,9.170967,data/final/MP/cifs/As1Fe1Nd1O0.85-MP-mp-622621-synth_doped.cif,data/source/MP/raw/cifs/mp-622621.cif,mp-622621,0.0,,2014-02-16 22:28:25,6.347279619112142,10.17188/1278150,"@misc{osti_1278150,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NdFeAsO (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278150"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-1677677'}},0.2809314202083302,3.74777613,520.0,-52.70842543,-6.58855317875,{'tags': ['Neodymium iron arsenic oxide (1/1/1/1)']},-52.70842543,-6.58855317875,-1.61299541125,"['xas', 'bandstructure']",True,"[163547, 164679, 422001, 163546, 236651, 236650, 602466, 164680, 164676]",True,2021-05-12 10:57:28.836000,FM,8,8,mp-622621,oxide,NdFeAsO,"{'functional': 'PBE', 'labels': ['Nd_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Nd': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-622621,"['mp-622621', 'mp-1079381', 'mp-1173401', 'mp-1438697', 'mp-1677677', 'mp-1772072', 'mp-1926310', 'mp-1592869']",3.83954265,"{'Nd': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",152.26370404041757,[],FM,True,129,1,"[0.0, 0.0, 3.6, 3.6, -0.0, -0.0, -0.0, -0.0]",0.0504328024094411,3.83954265,2,7.6790853,MP,data/source/MP/cleaned/cifs/MP-mp-622621.cif,True,,data/final/MP/graphs/As1Fe1Nd1O0.85-MP-mp-622621-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Fe2Ge2Tb1,1,0.0,1.0,True,Fe2Ge2Tb1,Fe2Ge2Tb1,0.0,Other,True,Fe40Ge40Tb20,Fe-Ge-Tb,3,Supercon,Tb1Fe2Ge2,MP-mp-20264,Tb1Fe2Ge2,Fe-Ge-Tb,Fe40Ge40Tb20,I 4/m m m,tetragonal,3.9531880008427502,3.95318800084275,6.03775159,data/final/MP/cifs/Fe2Ge2Tb1-MP-mp-20264.cif,data/source/MP/raw/cifs/mp-20264.cif,mp-20264,0.0,,2014-02-21 12:07:27,8.257473631090537,10.17188/1195395,"@misc{osti_1195395,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Tb(FeGe)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195395"",
    place = ""United States"",
    year = ""2016"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687589'}},0.0,4.76083481,520.0,-33.08397823,-6.616795646,"{'tags': ['Terbium iron germanide (1/2/2)', 'Iron terbium germanide (2/1/2)']}",-33.08397823,-6.616795646,-0.4527079039999996,"['xas', 'bandstructure']",True,"[84172, 632133, 55803, 53477, 55802]",True,2021-05-12 10:56:57.051000,FM,5,8,mp-20264,,Tb(FeGe)2,"{'functional': 'PBE', 'labels': ['Tb_3', 'Fe_pv', 'Ge_d'], 'pot_type': 'paw'}","{'Tb': 1.0, 'Fe': 2.0, 'Ge': 2.0}",GGA,mp-20264,"['mp-991093', 'mp-993102', 'mp-20264', 'mp-1439690', 'mp-1687589', 'mp-1783875', 'mp-994421', 'mp-1588137']",4.5427472,"{'Tb': 1.0, 'Fe': 2.0, 'Ge': 2.0}",83.63459662674981,[],FM,True,139,1,"[0.0, 2.3, 2.3, 0.0, 0.0]",0.0543166032147399,4.5427472,2,4.5427472,MP,data/source/MP/cleaned/cifs/MP-mp-20264.cif,False,,data/final/MP/graphs/Fe2Ge2Tb1-MP-mp-20264.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Si1Th1,1,0.0,4.0,False,Si4Th4,Si4Th4,2.41,Other,True,Si50Th50,Si-Th,2,Supercon,Si1Th1,MP-mp-21238,Th4Si4,Si-Th,Si50Th50,P n m a,orthorhombic,4.114391,5.905933,7.990882,data/final/MP/cifs/Si1Th1-MP-mp-21238.cif,data/source/MP/raw/cifs/mp-21238.cif,mp-21238,0.0,,2014-02-21 10:06:51,8.898155339370923,10.17188/1196511,"@misc{osti_1196511,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ThSi (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196511"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696337'}},0.0,7.85569251,520.0,-56.90814008,-7.11351751,"{'tags': ['Thorium silicide', 'Thorium silicide (1/1)']}",-56.90814008,-7.11351751,-0.658431375000001,"['xas', 'bandstructure']",True,"[652396, 652392, 26570, 652406]",True,2021-05-12 10:56:59.077000,NM,8,10,mp-21238,,ThSi,"{'functional': 'PBE', 'labels': ['Th', 'Si'], 'pot_type': 'paw'}","{'Th': 1.0, 'Si': 1.0}",GGA,mp-21238,"['mp-914069', 'mp-930749', 'mp-21238', 'mp-1138729', 'mp-1146301', 'mp-1432883', 'mp-1696337', 'mp-1787639', 'mp-977737', 'mp-1589321']",2.4e-05,"{'Th': 4.0, 'Si': 4.0}",194.17297947671315,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0]",4.944045266170164e-07,2.4e-05,0,9.6e-05,MP,data/source/MP/cleaned/cifs/MP-mp-21238.cif,False,,data/final/MP/graphs/Si1Th1-MP-mp-21238.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
B1C1Cu0.1Lu1Ni0.9,2,0.0499999999999999,2.0,False,B2C2Cu0.2Lu2Ni1.8,B2C2Lu2Ni2,3.3,Other,True,B25C25Cu2.5Lu25Ni22.5,B-C-Cu-Lu-Ni,5,Supercon,Lu1Ni0.9Cu0.1B1C1,MP-mp-6188,Lu2Ni2B2C2,B-C-Lu-Ni,B25C25Lu25Ni25,P 4/n m m,tetragonal,3.499459,3.499459,7.54108,data/final/MP/cifs/B1C1Cu0.1Lu1Ni0.9-MP-mp-6188-synth_doped.cif,data/source/MP/raw/cifs/mp-6188.cif,mp-6188,0.0,,2011-05-13 11:39:58,9.22360692471969,10.17188/1277950,"@misc{osti_1277950,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LuNiBC (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277950"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701902'}},0.0,5.56637243,520.0,-56.94584528,-7.11823066,{'tags': []},-56.94584528,-7.11823066,-0.5664157422916656,"['xas', 'bandstructure']",True,"[54041, 75610]",True,2021-05-12 10:57:28.836000,NM,8,8,mp-6188,,LuNiBC,"{'functional': 'PBE', 'labels': ['Lu_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Lu': 1.0, 'Ni': 1.0, 'B': 1.0, 'C': 1.0}",GGA,mp-6188,"['mp-6188', 'mp-1007095', 'mp-1000629', 'mp-1426768', 'mp-1701902', 'mp-1796435', 'mp-1011840', 'mp-1591367']",0.0004347,"{'Lu': 2.0, 'Ni': 2.0, 'B': 2.0, 'C': 2.0}",92.34967413717082,[],NM,False,129,0,"[0, 0, 0, 0, 0, 0, 0, 0]",9.414218383798992e-06,0.0004347,0,0.0008694,MP,data/source/MP/cleaned/cifs/MP-mp-6188.cif,True,,data/final/MP/graphs/B1C1Cu0.1Lu1Ni0.9-MP-mp-6188-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
As1.22Fe2P0.78Sr1,3,0.088,1.0,True,As1.22Fe2P0.78Sr1,As1Fe2P1Sr1,27.35,Ferrite,True,As24.4Fe40P15.6Sr20,As-Fe-P-Sr,4,Supercon,Sr1Fe2As1.22P0.78,MP-mp-1218282,Sr1Fe2As1P1,As-Fe-P-Sr,As20Fe40P20Sr20,I 4 m m,tetragonal,3.881052,3.881052,6.425511370445159,data/final/MP/cifs/As1.22Fe2P0.78Sr1-MP-mp-1218282-synth_doped.cif,data/source/MP/raw/cifs/mp-1218282.cif,mp-1218282,0.0,,2019-01-12 19:28:34.996000,5.791184443906422,,,,0.0250390396666677,5.51024107,520.0,-32.10310889,-6.420621778,{'tags': []},-32.10310889,-6.420621778,-0.6802355249999998,[],False,[],True,2021-05-12 11:00:42.526000,NM,5,2,mp-1218282,,SrFe2AsP,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Fe_pv', 'As', 'P'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Fe': 2.0, 'As': 1.0, 'P': 1.0}",GGA,mp-1218282,"['mp-1218282', 'mp-1880296']",0.0041926,"{'Sr': 1.0, 'Fe': 2.0, 'As': 1.0, 'P': 1.0}",87.5132594801162,[],NM,False,107,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",4.790816871530876e-05,0.0041926,0,0.0041926,MP,data/source/MP/cleaned/cifs/MP-mp-1218282.cif,True,,data/final/MP/graphs/As1.22Fe2P0.78Sr1-MP-mp-1218282-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,0,0,1,0,1.0,False
Ba2Cu1Hg1O4.058,2,0.0071978158351948,0.9858018112370626,True,Ba1.971Cu0.986Hg0.986O4,Ba2Cu1Hg1O4,89.0,Cuprate,True,Ba24.82Cu12.41Hg12.41O50.359890791759746,Ba-Cu-Hg-O,4,Supercon,Hg1Ba2Cu1O4.058,MP-mp-6562,Ba2Cu1Hg1O4,Ba-Cu-Hg-O,Ba25Cu12.5Hg12.5O50,P 4/m m m,tetragonal,3.933714,3.933714,9.827602,data/final/MP/cifs/Ba2Cu1Hg1O4.058-MP-mp-6562-synth_doped.cif,data/source/MP/raw/cifs/mp-6562.cif,mp-6562,0.0,,2011-05-13 18:18:06,6.582036471328142,10.17188/1281336,"@misc{osti_1281336,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2CuHgO4 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281336"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697135'}},0.0234340381250053,2.58068675,520.0,-40.91481298,-5.1143516225,"{'tags': ['Mercury dibarium copper oxide', 'High pressure experimental phase']}",-40.91481298,-5.1143516225,-1.953767533125,"['xas', 'bandstructure']",True,"[75722, 75720, 75724, 75721, 75723]",True,2021-05-12 10:57:32.679000,NM,8,8,mp-6562,oxide,Ba2CuHgO4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Cu_pv', 'Hg', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",GGA,mp-6562,"['mp-6562', 'mp-990899', 'mp-992892', 'mp-1435690', 'mp-1697135', 'mp-1878488', 'mp-994198', 'mp-1592659']",0.0003984,"{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",152.07335344042525,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0, 0, 0]",2.619788352047311e-06,0.0003984,0,0.0003984,MP,data/source/MP/cleaned/cifs/MP-mp-6562.cif,True,,data/final/MP/graphs/Ba2Cu1Hg1O4.058-MP-mp-6562-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Fe0.25Ni0.75U6,3,0.0714285714285714,2.0,False,Fe0.5Ni1.5U12,Fe1Ni1U12,3.0,Heavy_fermion,True,Fe3.571Ni10.714U85.714,Fe-Ni-U,3,Supercon,Fe0.25Ni0.75U6,MP-mp-1216984,U12Fe1Ni1,Fe-Ni-U,Fe7.143Ni7.143U85.714,I 4 2 2,tetragonal,5.197895,7.65391354,7.65391387876362,data/final/MP/cifs/Fe0.25Ni0.75U6-MP-mp-1216984-synth_doped.cif,data/source/MP/raw/cifs/mp-1216984.cif,mp-1216984,0.0,,2019-01-12 18:23:53.277000,18.31235284887019,,,,0.0319031538392842,13.9960501,520.0,-149.87652878,-10.705466341428572,{'tags': []},-149.87652878,-10.705466341428572,-0.0092473950000006,[],False,[],True,2021-05-12 11:00:40.103000,NM,14,2,mp-1216984,,U12FeNi,"{'functional': 'PBE', 'labels': ['U', 'Fe_pv', 'Ni_pv'], 'pot_type': 'paw'}","{'U': 12.0, 'Fe': 1.0, 'Ni': 1.0}",GGA,mp-1216984,"['mp-1216984', 'mp-1861703']",0.0042886,"{'U': 12.0, 'Fe': 1.0, 'Ni': 1.0}",269.39581041071995,[],NM,False,97,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, 0.0]",1.5919327006094174e-05,0.0042886,0,0.0042886,MP,data/source/MP/cleaned/cifs/MP-mp-1216984.cif,True,,data/final/MP/graphs/Fe0.25Ni0.75U6-MP-mp-1216984-synth_doped.json,0,True,422,0,0,0,0,4,0,0,0,0,1,0,1.0,False
Cu1Pr2O4,1,0.0,1.0,True,Cu1Pr2O4,Cu1Pr2O4,0.0,Cuprate,True,Cu14.286Pr28.571O57.142857142857146,Cu-Pr-O,3,Supercon,Pr2Cu1O4,MP-mp-4181,Pr2Cu1O4,Cu-Pr-O,Cu14.286Pr28.571O57.142857142857146,I 4/m m m,tetragonal,3.995734002478021,3.995734002478021,6.85109716,data/final/MP/cifs/Cu1Pr2O4-MP-mp-4181.cif,data/source/MP/raw/cifs/mp-4181.cif,mp-4181,0.0,,2011-05-13 10:21:01,6.821515862307185,10.17188/1207928,"@misc{osti_1207928,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Pr2CuO4 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207928"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-669887'}},0.0,3.15418113,520.0,-51.2919541,-7.327422014285714,"{'tags': ['Dipraseodymium cuprate', 'Dipraseodymium copper oxide', 'Praseodymium cuprate', 'Dipraseodymium copper tetraoxide']}",-51.2919541,-7.327422014285714,-2.9410150171428566,"['xas', 'elasticity', 'bandstructure']",True,"[91071, 261374, 71180, 186589, 185267, 185268, 65925, 65924, 191813, 261373, 202884, 72241]",True,2021-05-12 10:56:20.740000,NM,7,12,mp-4181,oxide,Pr2CuO4,"{'functional': 'PBE', 'labels': ['Pr_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Pr': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-4181,"['mp-669887', 'mp-660138', 'mp-4181', 'mp-1077961', 'mp-1077976', 'mp-1077987', 'mp-1078042', 'mp-1442060', 'mp-1687781', 'mp-1797293', 'mp-1589370', 'mp-688743']",0.0084498,"{'Pr': 2.0, 'Cu': 1.0, 'O': 4.0}",99.64888441679796,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",8.479573102552068e-05,0.0084498,0,0.0084498,MP,data/source/MP/cleaned/cifs/MP-mp-4181.cif,False,,data/final/MP/graphs/Cu1Pr2O4-MP-mp-4181.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Mo0.21Si1V2.79,3,0.1049999999999999,2.0,False,Mo0.42Si2V5.58,Si2V6,5.59,Other,True,Mo5.25Si25V69.75,Mo-Si-V,3,Supercon,V2.79Mo0.21Si1,MP-mp-2567,V6Si2,Si-V,Si25V75,P m -3 n,cubic,4.702381,4.702381,4.702381,data/final/MP/cifs/Mo0.21Si1V2.79-MP-mp-2567-synth_doped.cif,data/source/MP/raw/cifs/mp-2567.cif,mp-2567,0.0,,2011-05-13 19:15:43,5.778142190030859,10.17188/1200874,"@misc{osti_1200874,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Si (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1200874"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668672'}},0.0,7.30599425,520.0,-69.05773321,-8.63221665125,{'tags': ['Vanadium silicide (3/1)']},-69.05773321,-8.63221665125,-0.4452085937499994,"['xas', 'elasticity', 'bandstructure']",True,"[652491, 87328, 652522, 652502, 652510, 652520, 600518, 186003, 652507, 652513, 652497, 601150, 652514, 652487, 22412, 652509, 652529, 652532, 652499, 652539, 652537, 652533, 652512, 652538, 652490, 652493, 652494, 652511, 652519, 87329, 652526, 652500]",True,2021-05-12 10:56:18.721000,FM,8,13,mp-2567,,V3Si,"{'functional': 'PBE', 'labels': ['V_pv', 'Si'], 'pot_type': 'paw'}","{'V': 3.0, 'Si': 1.0}",GGA,mp-2567,"['mp-920081', 'mp-906309', 'mp-919083', 'mp-2567', 'mp-1078474', 'mp-1078852', 'mp-1138781', 'mp-1145907', 'mp-1440678', 'mp-1668672', 'mp-1795955', 'mp-1593554', 'mp-1596575']",0.8382519,"{'V': 6.0, 'Si': 2.0}",103.98086881866836,[],FM,True,131,1,"[0.2, 0.3, 0.3, 0.2, 0.3, 0.3, 0.0, 0.0]",0.0161231947669493,0.8382519,6,1.6765038,MP,data/source/MP/cleaned/cifs/MP-mp-2567.cif,True,,data/final/MP/graphs/Mo0.21Si1V2.79-MP-mp-2567-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Fe0.5Ni0.5Zr2,1,0.0,2.0,False,Fe1Ni1Zr4,Fe1Ni1Zr4,1.85,Other,True,Fe16.667Ni16.667Zr66.667,Fe-Ni-Zr,3,Supercon,Fe0.5Ni0.5Zr2,MP-mp-1215366,Zr4Fe1Ni1,Fe-Ni-Zr,Fe16.667Ni16.667Zr66.667,I 4 2 2,tetragonal,5.277062429600079,5.27706243,5.27706243,data/final/MP/cifs/Fe0.5Ni0.5Zr2-MP-mp-1215366.cif,data/source/MP/raw/cifs/mp-1215366.cif,mp-1215366,0.0,,2019-01-12 17:04:02.444000,7.137405118353338,,,{'GGA': {'task_id': 'mp-1735927'}},0.0198735593333339,4.811196,520.0,-49.72189863,-8.286983105,{'tags': []},-49.72189863,-8.286983105,-0.21349183,['bandstructure'],True,[],True,2021-05-12 10:58:39.488000,FM,6,5,mp-1215366,,Zr4FeNi,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Fe_pv', 'Ni_pv'], 'pot_type': 'paw'}","{'Zr': 4.0, 'Fe': 1.0, 'Ni': 1.0}",GGA,mp-1215366,"['mp-1215366', 'mp-1445478', 'mp-1735927', 'mp-1803005', 'mp-1627881']",0.2630035,"{'Zr': 4.0, 'Fe': 1.0, 'Ni': 1.0}",111.54187521523264,[],FM,True,97,1,"[0.0, 0.0, 0.0, 0.0, 0.3, 0.0]",0.0023578902496708,0.2630035,1,0.2630035,MP,data/source/MP/cleaned/cifs/MP-mp-1215366.cif,False,,data/final/MP/graphs/Fe0.5Ni0.5Zr2-MP-mp-1215366.json,0,True,422,0,0,0,0,4,0,0,0,0,1,0,1.0,False
As1Co0.15Fe0.85Pr1O1,3,0.075,2.0,False,As2Co0.3Fe1.7Pr2O2,As2Fe2Pr2O2,7.485,Ferrite,True,As25Co3.75Fe21.25Pr25O25,As-Co-Fe-Pr-O,5,Supercon,Pr1Fe0.85Co0.15As1O1,MP-mp-22491,Pr2Fe2As2O2,As-Fe-Pr-O,As25Fe25Pr25O25,P 4/n m m,tetragonal,4.094889,4.094889,9.258722,data/final/MP/cifs/As1Co0.15Fe0.85Pr1O1-MP-mp-22491-synth_doped.cif,data/source/MP/raw/cifs/mp-22491.cif,mp-22491,0.0,,2014-02-25 19:17:30,6.153806906111091,,,{'GGA+U': {'task_id': 'mp-1695715'}},0.3808778432291664,4.12348168,520.0,-51.7633941,-6.4704242625,{'tags': ['Praseodymium iron arsenic oxide (1/1/1/1)']},-51.7633941,-6.4704242625,-1.491677511249999,"['xas', 'bandstructure']",True,"[162830, 162833, 246832, 90316, 422000, 236649, 236648, 602491]",True,2021-05-12 10:57:10.838000,FM,8,8,mp-22491,oxide,PrFeAsO,"{'functional': 'PBE', 'labels': ['Pr_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Pr': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-22491,"['mp-510622', 'mp-1079608', 'mp-1079857', 'mp-22491', 'mp-1476145', 'mp-1695715', 'mp-1778524', 'mp-1596397']",3.7947681,"{'Pr': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",155.25132378854377,[],FM,True,129,1,"[0.0, 0.0, 3.5, 3.5, 0.0, 0.0, 0.0, 0.0]",0.0488854846116297,3.7947681,2,7.5895362,MP,data/source/MP/cleaned/cifs/MP-mp-22491.cif,True,,data/final/MP/graphs/As1Co0.15Fe0.85Pr1O1-MP-mp-22491-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Gd0.013La0.987Sn3,2,0.0065,1.0,True,Gd0.013La0.987Sn3,La1Sn3,5.94,Other,True,Gd0.325La24.675Sn75,Gd-La-Sn,3,Supercon,La0.987Gd0.013Sn3,MP-mp-633,La1Sn3,La-Sn,La25Sn75,P m -3 m,cubic,4.820061,4.820061,4.820061,data/final/MP/cifs/Gd0.013La0.987Sn3-MP-mp-633-synth_doped.cif,data/source/MP/raw/cifs/mp-633.cif,mp-633,0.0,,2011-05-13 04:30:54,7.340536659909055,10.17188/1279358,"@misc{osti_1279358,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaSn3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1279358"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688008'}},0.0,8.68748013,520.0,-19.26482408,-4.81620602,"{'tags': ['Lanthanum stannide (1/3)', 'Lanthanum tin (1/3)']}",-19.26482408,-4.81620602,-0.5750253525,"['xas', 'bandstructure']",True,"[641991, 104721, 641986, 261870, 104720, 151359, 642000, 641998, 191074]",True,2021-05-12 10:57:30.779000,NM,4,12,mp-633,,LaSn3,"{'functional': 'PBE', 'labels': ['La', 'Sn_d'], 'pot_type': 'paw'}","{'La': 1.0, 'Sn': 3.0}",GGA,mp-633,"['mp-991111', 'mp-993073', 'mp-633', 'mp-1066557', 'mp-1066573', 'mp-1066594', 'mp-1442023', 'mp-1688008', 'mp-1787436', 'mp-994393', 'mp-1590336', 'mp-1066601']",0.0055557,"{'La': 1.0, 'Sn': 3.0}",111.98441958300587,[],NM,False,221,0,"[0, 0, 0, 0]",4.961136576577034e-05,0.0055557,0,0.0055557,MP,data/source/MP/cleaned/cifs/MP-mp-633.cif,True,,data/final/MP/graphs/Gd0.013La0.987Sn3-MP-mp-633-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
B1.896C0.104Mg1,3,0.0693333333333333,1.0,True,B1.896C0.104Mg1,B2Mg1,35.0,Other,True,B63.2C3.467Mg33.333,B-C-Mg,3,Supercon,Mg1B1.896C0.104,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B1.896C0.104Mg1-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B1.896C0.104Mg1-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Fe1S0.04Se0.96,2,0.04,2.0,False,Fe2S0.08Se1.92,Fe2Se2,9.58,Ferrite,True,Fe50S2Se48,Fe-S-Se,3,Supercon,Fe1Se0.96S0.04,MP-mp-20311,Fe2Se2,Fe-Se,Fe50Se50,P 4/n m m,tetragonal,3.688905,3.688905,5.854194,data/final/MP/cifs/Fe1S0.04Se0.96-MP-mp-20311-synth_doped.cif,data/source/MP/raw/cifs/mp-20311.cif,mp-20311,0.0,,2013-10-20 07:09:24,5.619828229873189,10.17188/1195438,"@misc{osti_1195438,
    author = ""Persson, Kristin"",
    title = ""Materials Data on FeSe (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195438"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668877'}},0.0,3.48880228,520.0,-25.01949237,-6.2548730925,"{'tags': ['Iron selenide - NN AFM', 'Iron selenide - orthorhombic, LT', 'Iron selenide', 'Iron sulfide', 'Iron selenide (1/1) - nonmagnetic', 'Iron selenide - tetragonal', 'Iron selenide - alpha LT', 'Iron selenide - LT', 'High pressure experimental phase', 'Iron selenide - alpha']}",-25.01949237,-6.2548730925,-0.5079131286718743,"['xas', 'elasticity', 'bandstructure']",True,"[196301, 196298, 196299, 196297, 290701, 165958, 185464, 163561, 169257, 163560, 977900, 169311, 169303, 26889, 166440, 162901, 169283, 165957, 169271, 977903, 169259, 977901, 185465, 165959, 169306, 169267, 163557, 169287, 169297, 169289, 163556, 169299, 163562, 166441, 182544, 163559, 169269, 169263, 169265, 169315, 169255, 166439, 169293, 169313, 163555, 169291, 169301, 165960, 169253, 169295, 169970, 163558, 169285, 169261, 169309]",True,2021-05-12 10:56:14.760000,NM,4,55,mp-20311,,FeSe,"{'functional': 'PBE', 'labels': ['Fe_pv', 'Se'], 'pot_type': 'paw'}","{'Fe': 1.0, 'Se': 1.0}",GGA,mp-20311,"['mp-684656', 'mp-20311', 'mp-1063646', 'mp-1063662', 'mp-1063681', 'mp-1063669', 'mp-1063680', 'mp-1063695', 'mp-1063686', 'mp-1063699', 'mp-1063715', 'mp-1063717', 'mp-1063876', 'mp-1063734', 'mp-1063891', 'mp-1063735', 'mp-1063910', 'mp-1063918', 'mp-1063922', 'mp-1063931', 'mp-1063774', 'mp-1063781', 'mp-1064091', 'mp-1064111', 'mp-1063801', 'mp-1064112', 'mp-1064180', 'mp-1064138', 'mp-1064153', 'mp-1065102', 'mp-1065123', 'mp-1065075', 'mp-1065161', 'mp-1065131', 'mp-1065030', 'mp-1065055', 'mp-1065085', 'mp-1065094', 'mp-1440814', 'mp-1668877', 'mp-1799618', 'mp-1593782', 'mp-1592730', 'mp-1065081', 'mp-1065148', 'mp-1063928', 'mp-1063726', 'mp-1063683', 'mp-1063709', 'mp-1063911', 'mp-1063795', 'mp-1065121', 'mp-1063725', 'mp-1064139', 'mp-1064165']",3.455e-05,"{'Fe': 2.0, 'Se': 2.0}",79.66398961559156,[],NM,False,129,0,"[0, 0, 0, 0]",8.673931638803586e-07,3.455e-05,0,6.91e-05,MP,data/source/MP/cleaned/cifs/MP-mp-20311.cif,True,,data/final/MP/graphs/Fe1S0.04Se0.96-MP-mp-20311-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ce0.001La0.999Pt1Si1,2,0.0006666666666666,2.0,False,Ce0.002La1.998Pt2Si2,La2Pt2Si2,1.765,Other,True,Ce0.033La33.3Pt33.333Si33.333,Ce-La-Pt-Si,4,Supercon,La0.9989Ce0.0011Pt1Si1,MP-mp-1206485,La2Si2Pt2,La-Pt-Si,La33.333Pt33.333Si33.333,I 41 m d,tetragonal,4.277808001286174,4.277808001286175,7.94541446,data/final/MP/cifs/Ce0.001La0.999Pt1Si1-MP-mp-1206485-synth_doped.cif,data/source/MP/raw/cifs/mp-1206485.cif,mp-1206485,0.0,,2019-01-12 09:47:13.211000,8.943745313538361,,,{'GGA': {'task_id': 'mp-1734531'}},0.0,7.90579938,520.0,-39.77896993,-6.629828321666667,{'tags': ['LaPtSi']},-39.77896993,-6.629828321666667,-1.1287520433333331,['bandstructure'],True,[],True,2021-05-12 10:58:37.524000,NM,6,5,mp-1206485,,LaSiPt,"{'functional': 'PBE', 'labels': ['La', 'Si', 'Pt'], 'pot_type': 'paw'}","{'La': 1.0, 'Si': 1.0, 'Pt': 1.0}",GGA,mp-1206485,"['mp-1206485', 'mp-1387492', 'mp-1734531', 'mp-1788111', 'mp-1628393']",1.825e-05,"{'La': 2.0, 'Si': 2.0, 'Pt': 2.0}",134.4491846861766,[],NM,False,109,0,"[0, 0, 0, 0, 0, 0]",2.714780315343388e-07,1.825e-05,0,3.65e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1206485.cif,True,,data/final/MP/graphs/Ce0.001La0.999Pt1Si1-MP-mp-1206485-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,0,0,1,0,1.0,False
As2Fe1.8Ru0.2Sr1,3,0.0799999999999999,1.0,True,As2Fe1.8Ru0.2Sr1,As2Fe2Sr1,0.0,Ferrite,True,As40Fe36Ru4Sr20,As-Fe-Ru-Sr,4,Supercon,Sr1Fe1.8Ru0.2As2,MP-mp-4488,Sr1Fe2As2,As-Fe-Sr,As40Fe40Sr20,I 4/m m m,tetragonal,3.9729799997357778,3.9729799997357778,6.45523327,data/final/MP/cifs/As2Fe1.8Ru0.2Sr1-MP-mp-4488-synth_doped.cif,data/source/MP/raw/cifs/mp-4488.cif,mp-4488,0.0,,2011-05-13 03:37:13,6.319998834487784,10.17188/1208187,"@misc{osti_1208187,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr(FeAs)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208187"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672865'}},0.0,5.13397273,520.0,-30.61898897,-6.123797794,"{'tags': ['Strontium diiron arsenide - HT', 'Strontium diiron arsenide', 'Strontium diiron diarsenide', 'Iron strontium arsenide (2/1/2)', 'Strontium diiron arsenide - LT']}",-30.61898897,-6.123797794,-0.5342483613333335,"['xas', 'elasticity', 'bandstructure']",True,"[182330, 181993, 610527, 163209, 163208, 163869]",True,2021-05-12 10:56:20.740000,NM,5,8,mp-4488,,Sr(FeAs)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Fe': 2.0, 'As': 2.0}",GGA,mp-4488,"['mp-906356', 'mp-920135', 'mp-919110', 'mp-4488', 'mp-1439153', 'mp-1672865', 'mp-1873948', 'mp-1592272']",0.0029206,"{'Sr': 1.0, 'Fe': 2.0, 'As': 2.0}",91.7377588211838,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",3.183640016422098e-05,0.0029206,0,0.0029206,MP,data/source/MP/cleaned/cifs/MP-mp-4488.cif,True,,data/final/MP/graphs/As2Fe1.8Ru0.2Sr1-MP-mp-4488-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As1.816Ba1Ni2P0.184,3,0.0735999999999999,1.0,True,As1.816Ba1Ni2P0.184,As2Ba1Ni2,3.27,Ferrite,True,As36.32Ba20Ni40P3.68,As-Ba-Ni-P,4,Supercon,Ba1Ni2As1.816P0.184,MP-mp-568280,Ba1Ni2As2,As-Ba-Ni,As40Ba20Ni40,I 4/m m m,tetragonal,4.156554001148825,4.156554001148825,6.57789079,data/final/MP/cifs/As1.816Ba1Ni2P0.184-MP-mp-568280-synth_doped.cif,data/source/MP/raw/cifs/mp-568280.cif,mp-568280,0.0,,2014-02-16 06:02:25,6.607461026403792,10.17188/1274340,"@misc{osti_1274340,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba(NiAs)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1274340"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698065'}},0.0,5.18272169,520.0,-26.07345637,-5.214691274,"{'tags': ['Barium nickel arsenide (1/2/2)', 'Barium dinickel diarsenide']}",-26.07345637,-5.214691274,-0.6551950740000002,"['xas', 'elasticity', 'bandstructure']",True,"[185463, 609856, 164197]",True,2021-05-12 10:56:22.739000,NM,5,10,mp-568280,,Ba(NiAs)2,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ni_pv', 'As'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Ni': 2.0, 'As': 2.0}",GGA,mp-568280,"['mp-568280', 'mp-1069503', 'mp-1069542', 'mp-1069572', 'mp-1441346', 'mp-1698065', 'mp-1795849', 'mp-1923070', 'mp-1595137', 'mp-1069566']",0.0042893,"{'Ba': 1.0, 'Ni': 2.0, 'As': 2.0}",101.67032396892152,[],NM,False,139,0,"[0, 0, 0, 0, 0]",4.218831840558656e-05,0.0042893,0,0.0042893,MP,data/source/MP/cleaned/cifs/MP-mp-568280.cif,True,,data/final/MP/graphs/As1.816Ba1Ni2P0.184-MP-mp-568280-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B2C1Fe0.06Ni1.94Y1,2,0.02,1.0,True,B2C1Fe0.06Ni1.94Y1,B2C1Ni2Y1,10.2,Other,True,B33.333C16.667Fe1Ni32.333Y16.667,B-C-Fe-Ni-Y,5,Supercon,Y1Ni1.94Fe0.06B2C1,MP-mp-6576,Y1Ni2B2C1,B-C-Ni-Y,B33.333C16.667Ni33.333Y16.667,I 4/m m m,tetragonal,3.548790000501972,3.548790000501972,5.76144136,data/final/MP/cifs/B2C1Fe0.06Ni1.94Y1-MP-mp-6576-synth_doped.cif,data/source/MP/raw/cifs/mp-6576.cif,mp-6576,0.0,,2011-05-13 05:21:43,6.099730998852292,10.17188/1281366,"@misc{osti_1281366,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281366"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688230'}},0.0,6.81083016,520.0,-43.677878,-7.279646333333333,{'tags': []},-43.677878,-7.279646333333333,-0.5109282141666659,"['xas', 'bandstructure']",True,"[75816, 89142, 83231, 79574, 41549]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6576,,YNi2B2C,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6576,"['mp-6576', 'mp-1007054', 'mp-1000583', 'mp-1439516', 'mp-1688230', 'mp-1794280', 'mp-1011792', 'mp-1597064']",0.0006603,"{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.3152437079014,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",1.010943177297096e-05,0.0006603,0,0.0006603,MP,data/source/MP/cleaned/cifs/MP-mp-6576.cif,True,,data/final/MP/graphs/B2C1Fe0.06Ni1.94Y1-MP-mp-6576-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Hg0.5In0.5,1,0.0,2.0,False,Hg1In1,Hg1In1,3.81,Other,True,Hg50In50,Hg-In,2,Supercon,Hg0.5In0.5,MP-mp-20132,In1Hg1,Hg-In,Hg50In50,R -3 m,trigonal,3.7622435904512335,3.762243590451233,5.00097792,data/final/MP/cifs/Hg0.5In0.5-MP-mp-20132.cif,data/source/MP/raw/cifs/mp-20132.cif,mp-20132,0.0,,2014-02-21 07:26:41,9.485034218796924,10.17188/1195277,"@misc{osti_1195277,
    author = ""Persson, Kristin"",
    title = ""Materials Data on InHg (SG:166) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195277"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686541'}},0.0048777974999998,4.48885088,520.0,-3.0456085,-1.52280425,{'tags': ['Mercury indium (1/1)']},-3.0456085,-1.52280425,0.0048777974999998,"['xas', 'bandstructure']",True,"[104299, 104300, 639037]",True,2021-05-12 10:56:57.051000,NM,2,6,mp-20132,,InHg,"{'functional': 'PBE', 'labels': ['In_d', 'Hg'], 'pot_type': 'paw'}","{'In': 1.0, 'Hg': 1.0}",GGA,mp-20132,"['mp-20132', 'mp-1141398', 'mp-1440251', 'mp-1686541', 'mp-1790679', 'mp-1588232']",0.0006267,"{'In': 1.0, 'Hg': 1.0}",55.21828322772298,[],NM,False,166,0,"[0, 0]",1.1349501711515688e-05,0.0006267,0,0.0006267,MP,data/source/MP/cleaned/cifs/MP-mp-20132.cif,False,,data/final/MP/graphs/Hg0.5In0.5-MP-mp-20132.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
F2Sb2Sr2Ti2O1,1,0.0,1.0,True,F2Sb2Sr2Ti2O1,F2Sb2Sr2Ti2O1,0.0,Oxide,True,F22.222Sb22.222Sr22.222Ti22.222O11.11111111111111,F-Sb-Sr-Ti-O,5,Supercon,Sr2F2Ti2Sb2O1,MP-mp-1079717,Sr2Ti2Sb2O1F2,F-Sb-Sr-Ti-O,F22.222Sb22.222Sr22.222Ti22.222O11.11111111111111,I 4/m m m,tetragonal,4.112903999862938,4.112903999862938,11.06611313,data/final/MP/cifs/F2Sb2Sr2Ti2O1-MP-mp-1079717.cif,data/source/MP/raw/cifs/mp-1079717.cif,mp-1079717,0.0,,2018-04-16 02:44:05,5.226619161620083,,,{'GGA': {'task_id': 'mp-1688171'}},0.0,5.35912985,520.0,-56.24419773,-6.249355303333334,{'tags': []},-56.24419773,-6.249355303333334,-2.4489228188888896,['bandstructure'],True,[167014],True,2021-05-12 10:58:16.596000,NM,9,5,mp-1079717,oxide,Sr2Ti2Sb2OF2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ti_pv', 'Sb', 'O', 'F'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ti': 2.0, 'Sb': 2.0, 'O': 1.0, 'F': 2.0}",GGA,mp-1079717,"['mp-1079717', 'mp-1300279', 'mp-1688171', 'mp-1833860', 'mp-1602156']",0.0412606,"{'Sr': 2.0, 'Ti': 2.0, 'Sb': 2.0, 'O': 1.0, 'F': 2.0}",180.6139241287456,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0002284463958082,0.0412606,0,0.0412606,MP,data/source/MP/cleaned/cifs/MP-mp-1079717.cif,False,,data/final/MP/graphs/F2Sb2Sr2Ti2O1-MP-mp-1079717.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Cu0.82Ge0.18,3,0.1399999999999999,8.0,False,Cu6.56Ge1.44,Cu6Ge2,0.13,Other,True,Cu82Ge18,Cu-Ge,2,Supercon,Cu0.82Ge0.18,MP-mp-1184021,Cu6Ge2,Cu-Ge,Cu75Ge25,P 63/m m c,hexagonal,4.213635,5.291476003465905,5.29147545,data/final/MP/cifs/Cu0.82Ge0.18-MP-mp-1184021-synth_doped.cif,data/source/MP/raw/cifs/mp-1184021.cif,mp-1184021,0.0,,2019-01-11 12:28:15.987000,8.557610547331103,,,{'GGA': {'task_id': 'mp-1754560'}},0.003112765,7.74811247,520.0,-33.8620493,-4.2327561625,{'tags': []},-33.8620493,-4.2327561625,-0.0025941962500004,['bandstructure'],True,[],True,2021-05-12 10:58:27.755000,NM,8,5,mp-1184021,,Cu3Ge,"{'functional': 'PBE', 'labels': ['Cu_pv', 'Ge_d'], 'pot_type': 'paw'}","{'Cu': 3.0, 'Ge': 1.0}",GGA,mp-1184021,"['mp-1184021', 'mp-1388052', 'mp-1754560', 'mp-1921698', 'mp-1621911']",0.00074355,"{'Cu': 6.0, 'Ge': 2.0}",102.17417629799968,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.4554558244372302e-05,0.00074355,0,0.0014871,MP,data/source/MP/cleaned/cifs/MP-mp-1184021.cif,True,,data/final/MP/graphs/Cu0.82Ge0.18-MP-mp-1184021-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
B2Dy0.2Lu0.8Ru1,3,0.0999999999999999,4.0,False,B8Dy0.8Lu3.2Ru4,B8Lu4Ru4,5.07,Other,True,B50Dy5Lu20Ru25,B-Dy-Lu-Ru,4,Supercon,Lu0.8Dy0.2Ru1B2,MP-mp-29239,Lu4B8Ru4,B-Lu-Ru,B50Lu25Ru25,P n m a,orthorhombic,5.262881,5.829858,6.288542,data/final/MP/cifs/B2Dy0.2Lu0.8Ru1-MP-mp-29239-synth_doped.cif,data/source/MP/raw/cifs/mp-29239.cif,mp-29239,0.0,,2014-02-24 06:45:28,10.246997128776938,10.17188/1203618,"@misc{osti_1203618,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LuB2Ru (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1203618"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677301'}},0.0,6.02142224,520.0,-119.30016105,-7.456260065625,"{'tags': ['Lutetium ruthenium(III) boride', 'Lutetium ruthenium boride (1/1/2)']}",-119.30016105,-7.456260065625,-0.6677291364583331,"['xas', 'bandstructure']",True,"[614715, 100774]",True,2021-05-12 10:57:03.017000,NM,16,8,mp-29239,,LuB2Ru,"{'functional': 'PBE', 'labels': ['Lu_3', 'B', 'Ru_pv'], 'pot_type': 'paw'}","{'Lu': 1.0, 'B': 2.0, 'Ru': 1.0}",GGA,mp-29239,"['mp-909473', 'mp-925177', 'mp-924466', 'mp-29239', 'mp-1381674', 'mp-1677301', 'mp-1784701', 'mp-1603819']",4.565e-05,"{'Lu': 4.0, 'B': 8.0, 'Ru': 4.0}",192.9440954509509,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",9.4638812124945e-07,4.565e-05,0,0.0001826,MP,data/source/MP/cleaned/cifs/MP-mp-29239.cif,True,,data/final/MP/graphs/B2Dy0.2Lu0.8Ru1-MP-mp-29239-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ir0.8Re0.2,3,0.1,8.0,False,Ir6.4Re1.6,Ir6Re2,0.66,Other,True,Ir80Re20,Ir-Re,2,Supercon,Ir0.8Re0.2,MP-mp-867792,Re2Ir6,Ir-Re,Ir75Re25,P 63/m m c,hexagonal,4.398325,5.539354000417853,5.53935462,data/final/MP/cifs/Ir0.8Re0.2-MP-mp-867792-synth_doped.cif,data/source/MP/raw/cifs/mp-867792.cif,mp-867792,0.0,,2014-10-19 22:58:25,21.67636943705842,10.17188/1312161,"@misc{osti_1312161,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ReIr3 (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1312161"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1750841'}},0.0,9.71710215,520.0,-79.13783465,-9.89222933125,{'tags': []},-79.13783465,-9.89222933125,-0.1522747200000012,"['xas', 'elasticity', 'bandstructure']",True,[],True,2021-05-12 10:56:33.121000,NM,8,8,mp-867792,,ReIr3,"{'functional': 'PBE', 'labels': ['Re_pv', 'Ir'], 'pot_type': 'paw'}","{'Re': 1.0, 'Ir': 3.0}",GGA,mp-867792,"['mp-867792', 'mp-1055385', 'mp-1055429', 'mp-1393279', 'mp-1750841', 'mp-1805345', 'mp-1618753', 'mp-1055432']",7.65e-06,"{'Re': 2.0, 'Ir': 6.0}",116.87893721747226,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.3090468106782886e-07,7.65e-06,0,1.53e-05,MP,data/source/MP/cleaned/cifs/MP-mp-867792.cif,True,,data/final/MP/graphs/Ir0.8Re0.2-MP-mp-867792-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Cu4Pr0.1Y0.9O8,2,0.0133333333333333,1.0,True,Ba2Cu4Pr0.1Y0.9O8,Ba2Cu4Y1O8,72.025,Cuprate,True,Ba13.333Cu26.667Pr0.667Y6O53.333333333333336,Ba-Cu-Pr-Y-O,5,Supercon,Y0.9Pr0.1Ba2Cu4O8,MP-mp-6790,Ba2Y1Cu4O8,Ba-Cu-Y-O,Ba13.333Cu26.667Y6.667O53.333333333333336,C m m m,orthorhombic,3.889922,3.899603999537882,13.88942687,data/final/MP/cifs/Ba2Cu4Pr0.1Y0.9O8-MP-mp-6790-synth_doped.cif,data/source/MP/raw/cifs/mp-6790.cif,mp-6790,0.0,,2011-05-16 03:21:24,5.936250568336678,10.17188/1283441,"@misc{osti_1283441,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Y(CuO2)4 (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1283441"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686864'}},0.0,3.31391536,520.0,-91.58381472,-6.105587648,"{'tags': ['Yttrium barium copper oxide (1/2/4/8)', 'High pressure experimental phase']}",-91.58381472,-6.105587648,-2.0529924817777783,"['xas', 'bandstructure']",True,"[72261, 85273, 74251, 400273, 85277, 85275, 400280, 67632, 85272, 67631, 83920, 66613, 85279, 400277, 75689, 74259, 85278, 85280, 66603, 94265, 400276, 88873, 71417, 75712, 97052, 66605, 72258, 85281, 85274, 400279, 66604, 69698]",True,2021-05-12 10:57:34.594000,NM,15,10,mp-6790,oxide,Ba2Y(CuO2)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-6790,"['mp-1000664', 'mp-6790', 'mp-1007136', 'mp-1237713', 'mp-1440937', 'mp-1686864', 'mp-1834179', 'mp-1011883', 'mp-1590064', 'mp-1590433']",0.0004643,"{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",208.60454115924333,[],NM,False,65,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.225742533790601e-06,0.0004643,0,0.0004643,MP,data/source/MP/cleaned/cifs/MP-mp-6790.cif,True,,data/final/MP/graphs/Ba2Cu4Pr0.1Y0.9O8-MP-mp-6790-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ba2Cu3Er1O7,1,0.0,1.0,True,Ba2Cu3Er1O7,Ba2Cu3Er1O7,92.03333333,Cuprate,True,Ba15.385Cu23.077Er7.692O53.84615384615385,Ba-Cu-Er-O,4,Supercon,Er1Ba2Cu3O7,MP-mp-622110,Ba2Er1Cu3O7,Ba-Cu-Er-O,Ba15.385Cu23.077Er7.692O53.84615384615385,P m m m,orthorhombic,3.834762,3.933125,11.788769,data/final/MP/cifs/Ba2Cu3Er1O7-MP-mp-622110.cif,data/source/MP/raw/cifs/mp-622110.cif,mp-622110,0.0,,2014-02-15 20:42:48,6.953388209207566,10.17188/1278094,"@misc{osti_1278094,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2ErCu3O7 (SG:47) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278094"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1676776'}},0.0334336014102625,3.20253361,520.0,-79.04238944,-6.080183803076922,"{'tags': ['Erbium barium copper oxide (1/2/3/7)', 'Erbium dibarium tricopper heptaoxide']}",-79.04238944,-6.080183803076922,-2.1932601480769227,['bandstructure'],True,"[63405, 81176]",True,2021-05-12 10:58:51.532000,NM,13,8,mp-622110,oxide,Ba2ErCu3O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Er_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Er': 1.0, 'Cu': 3.0, 'O': 7.0}",GGA,mp-622110,"['mp-932741', 'mp-622110', 'mp-931664', 'mp-916329', 'mp-1380960', 'mp-1676776', 'mp-1835850', 'mp-1598909']",0.0002229,"{'Ba': 2.0, 'Er': 1.0, 'Cu': 3.0, 'O': 7.0}",177.80526717534096,[],NM,False,47,0,"[0.0, 0.0, 0.0, 0.0, 0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",1.2536186556284031e-06,0.0002229,0,0.0002229,MP,data/source/MP/cleaned/cifs/MP-mp-622110.cif,False,,data/final/MP/graphs/Ba2Cu3Er1O7-MP-mp-622110.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
B6Th1,1,0.0,1.0,True,B6Th1,B6Th1,0.37,Other,True,B85.714Th14.286,B-Th,2,Supercon,B6Th1,MP-mp-1756,Th1B6,B-Th,B85.714Th14.286,P m -3 m,cubic,4.110774,4.110774,4.110774,data/final/MP/cifs/B6Th1-MP-mp-1756.cif,data/source/MP/raw/cifs/mp-1756.cif,mp-1756,0.0,,2011-05-12 20:19:02,7.097320717139876,10.17188/1192569,"@misc{osti_1192569,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ThB6 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1192569"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668370'}},0.0,8.67908026,520.0,-50.91133247,-7.273047495714286,"{'tags': ['Thorium hexaboride', 'Thorium octahedro-hexaboride', 'Thorium boride (1/6)']}",-50.91133247,-7.273047495714286,-0.4887319421428567,"['xas', 'elasticity', 'bandstructure']",True,"[615572, 615576, 615568, 24703, 615559, 615582, 615564, 615584, 81546]",True,2021-05-12 10:56:14.760000,NM,7,8,mp-1756,,ThB6,"{'functional': 'PBE', 'labels': ['Th', 'B'], 'pot_type': 'paw'}","{'Th': 1.0, 'B': 6.0}",GGA,mp-1756,"['mp-909068', 'mp-924578', 'mp-923940', 'mp-1756', 'mp-1440060', 'mp-1668370', 'mp-1926877', 'mp-1587599']",0.0022221,"{'Th': 1.0, 'B': 6.0}",69.46576184327077,[],NM,False,221,0,"[0, 0, 0, 0, 0, 0, 0]",3.19884204971871e-05,0.0022221,0,0.0022221,MP,data/source/MP/cleaned/cifs/MP-mp-1756.cif,False,,data/final/MP/graphs/B6Th1-MP-mp-1756.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Nd0.9Ni1Th0.1O3,2,0.0399999999999999,4.0,False,Nd3.6Ni4Th0.4O12,Nd4Ni4O12,0.0,Oxide,True,Nd18Ni20Th2O60,Nd-Ni-Th-O,4,Supercon,Nd0.9Th0.1Ni1O3,MP-mp-22106,Nd4Ni4O12,Nd-Ni-O,Nd20Ni20O60,P n m a,orthorhombic,5.431762,5.495849,7.709429,data/final/MP/cifs/Nd0.9Ni1Th0.1O3-MP-mp-22106-synth_doped.cif,data/source/MP/raw/cifs/mp-22106.cif,mp-22106,0.0,,2014-02-19 13:18:08,7.242194237367626,,,{'GGA+U': {'task_id': 'mp-1701351'}},0.0,3.99854667,520.0,-131.66600273,-6.5833001365,"{'tags': ['Neodymium nickel(III) oxide', 'Dineodymium niccolate', 'Neodymium niccolate', 'Neodymium nickel oxide', 'Neodymium niccolate(III)']}",-131.66600273,-6.5833001365,-2.425267555500001,"['xas', 'bandstructure']",True,"[155746, 67725, 164825, 67724, 416213, 78319, 164562, 155747, 67723, 69788, 155748, 67722, 24875, 416212]",True,2021-05-12 10:57:01.079000,FM,20,11,mp-22106,oxide,NdNiO3,"{'functional': 'PBE', 'labels': ['Nd_3', 'Ni_pv', 'O'], 'pot_type': 'paw'}","{'Nd': 1.0, 'Ni': 1.0, 'O': 3.0}",GGA+U,mp-22106,"['mp-919926', 'mp-918860', 'mp-905914', 'mp-602303', 'mp-25591', 'mp-1189695', 'mp-22106', 'mp-1416651', 'mp-1701351', 'mp-1930748', 'mp-1599871']",1.00005245,"{'Nd': 4.0, 'Ni': 4.0, 'O': 12.0}",230.14298278419733,[],FM,True,62,1,"[0.0, 0.0, 0.0, 0.0, 1.4, 1.4, 1.4, 1.4, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0173814111193255,1.00005245,4,4.0002098,MP,data/source/MP/cleaned/cifs/MP-mp-22106.cif,True,,data/final/MP/graphs/Nd0.9Ni1Th0.1O3-MP-mp-22106-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Pd1Sn4,1,0.0,2.0,False,Pd2Sn8,Pd2Sn8,0.0,Other,True,Pd20Sn80,Pd-Sn,2,Supercon,Pd1Sn4,MP-mp-2128,Sn8Pd2,Pd-Sn,Pd20Sn80,C c c a,orthorhombic,6.529884,6.561647995693374,6.68663363,data/final/MP/cifs/Pd1Sn4-MP-mp-2128.cif,data/source/MP/raw/cifs/mp-2128.cif,mp-2128,0.0,,2011-05-15 18:28:07,7.732657088109309,10.17188/1196591,"@misc{osti_1196591,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sn4Pd (SG:68) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196591"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698774'}},0.0,7.58025192,520.0,-44.80478088,-4.480478088,"{'tags': ['Palladium tin (4/16)', 'Palladium stannide (1/4)']}",-44.80478088,-4.480478088,-0.2368442420000001,"['xas', 'elasticity', 'bandstructure']",True,"[648920, 413280, 151195]",True,2021-05-12 10:56:16.728000,NM,10,12,mp-2128,,Sn4Pd,"{'functional': 'PBE', 'labels': ['Sn_d', 'Pd'], 'pot_type': 'paw'}","{'Sn': 4.0, 'Pd': 1.0}",GGA,mp-2128,"['mp-919669', 'mp-905557', 'mp-918650', 'mp-2128', 'mp-11645', 'mp-569011', 'mp-1078569', 'mp-1116044', 'mp-1437099', 'mp-1698774', 'mp-1880961', 'mp-1601720']",8.95e-06,"{'Sn': 8.0, 'Pd': 2.0}",249.64379691325885,[],NM,False,68,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",7.170216212590105e-08,8.95e-06,0,1.79e-05,MP,data/source/MP/cleaned/cifs/MP-mp-2128.cif,False,,data/final/MP/graphs/Pd1Sn4-MP-mp-2128.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Os2Si2Y1,1,0.0,1.0,True,Os2Si2Y1,Os2Si2Y1,1.1,Other,True,Os40Si40Y20,Os-Si-Y,3,Supercon,Y1Os2Si2,MP-mp-567749,Y1Si2Os2,Os-Si-Y,Os40Si40Y20,I 4/m m m,tetragonal,4.192488001513817,4.192488001513817,5.66332607,data/final/MP/cifs/Os2Si2Y1-MP-mp-567749.cif,data/source/MP/raw/cifs/mp-567749.cif,mp-567749,0.0,,2014-02-16 11:27:45,10.28898430500351,10.17188/1274026,"@misc{osti_1274026,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Y(SiOs)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1274026"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701137'}},0.0,7.04735825,520.0,-43.38722017,-8.677444034,{'tags': ['Osmium yttrium silicide (2/1/2)']},-43.38722017,-8.677444034,-0.7230777013333338,"['xas', 'elasticity', 'bandstructure']",True,[647804],True,2021-05-12 10:56:22.739000,NM,5,10,mp-567749,,Y(SiOs)2,"{'functional': 'PBE', 'labels': ['Y_sv', 'Si', 'Os_pv'], 'pot_type': 'paw'}","{'Y': 1.0, 'Si': 2.0, 'Os': 2.0}",GGA,mp-567749,"['mp-1001987', 'mp-1008357', 'mp-567749', 'mp-1125273', 'mp-1132794', 'mp-1434547', 'mp-1701137', 'mp-1783086', 'mp-1012649', 'mp-1592407']",0.0092407,"{'Y': 1.0, 'Si': 2.0, 'Os': 2.0}",84.81638658332139,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",0.0001089494656898,0.0092407,0,0.0092407,MP,data/source/MP/cleaned/cifs/MP-mp-567749.cif,False,,data/final/MP/graphs/Os2Si2Y1-MP-mp-567749.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B2C1Mn0.02Ni1.98Y1,2,0.0066666666666666,1.0,True,B2C1Mn0.02Ni1.98Y1,B2C1Ni2Y1,15.48,Other,True,B33.333C16.667Mn0.333Ni33Y16.667,B-C-Mn-Ni-Y,5,Supercon,Y1Ni1.98Mn0.02B2C1,MP-mp-6576,Y1Ni2B2C1,B-C-Ni-Y,B33.333C16.667Ni33.333Y16.667,I 4/m m m,tetragonal,3.548790000501972,3.548790000501972,5.76144136,data/final/MP/cifs/B2C1Mn0.02Ni1.98Y1-MP-mp-6576-synth_doped.cif,data/source/MP/raw/cifs/mp-6576.cif,mp-6576,0.0,,2011-05-13 05:21:43,6.099730998852292,10.17188/1281366,"@misc{osti_1281366,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281366"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688230'}},0.0,6.81083016,520.0,-43.677878,-7.279646333333333,{'tags': []},-43.677878,-7.279646333333333,-0.5109282141666659,"['xas', 'bandstructure']",True,"[75816, 89142, 83231, 79574, 41549]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6576,,YNi2B2C,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6576,"['mp-6576', 'mp-1007054', 'mp-1000583', 'mp-1439516', 'mp-1688230', 'mp-1794280', 'mp-1011792', 'mp-1597064']",0.0006603,"{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.3152437079014,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",1.010943177297096e-05,0.0006603,0,0.0006603,MP,data/source/MP/cleaned/cifs/MP-mp-6576.cif,True,,data/final/MP/graphs/B2C1Mn0.02Ni1.98Y1-MP-mp-6576-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Bi1.2K0.8O3,3,0.0799999999999999,1.0,True,Bi1.2K0.8O3,Bi1K1O3,9.45,Oxide,True,Bi24K16O60,Bi-K-O,3,Supercon,K0.8Bi1.2O3,MP-mp-982040,K1Bi1O3,Bi-K-O,Bi20K20O60,P m -3 m,cubic,4.284204,4.284204,4.284204,data/final/MP/cifs/Bi1.2K0.8O3-MP-mp-982040-synth_doped.cif,data/source/MP/raw/cifs/mp-982040.cif,mp-982040,0.0,,2015-10-12 11:25:13,6.252348761231978,10.17188/1316390,"@misc{osti_1316390,
    author = ""Persson, Kristin"",
    title = ""Materials Data on KBiO3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1316390"",
    place = ""United States"",
    year = ""2016"",
    month = ""9"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1717462'}},0.0928686834999998,1.80216133,520.0,-25.20286901,-5.040573802,{'tags': []},-25.20286901,-5.040573802,-1.4839105476,"['xas', 'elasticity']",False,[],True,2021-05-12 10:56:37.246000,NM,5,9,mp-982040,oxide,KBiO3,"{'functional': 'PBE', 'labels': ['K_sv', 'Bi', 'O'], 'pot_type': 'paw'}","{'K': 1.0, 'Bi': 1.0, 'O': 3.0}",GGA,mp-982040,"['mp-982222', 'mp-1006156', 'mp-982040', 'mp-1006117', 'mp-1431172', 'mp-1717462', 'mp-1798749', 'mp-1011221', 'mp-1585048']",0.0005425,"{'K': 1.0, 'Bi': 1.0, 'O': 3.0}",78.63401066432932,[],NM,False,221,0,"[0, 0, 0, 0, 0]",6.899050365315956e-06,0.0005425,0,0.0005425,MP,data/source/MP/cleaned/cifs/MP-mp-982040.cif,True,,data/final/MP/graphs/Bi1.2K0.8O3-MP-mp-982040-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Nb1P1S1,1,0.0,2.0,False,Nb2P2S2,Nb2P2S2,12.5,Other,True,Nb33.333P33.333S33.333,Nb-P-S,3,Supercon,Nb1P1S1,MP-mp-27471,Nb2P2S2,Nb-P-S,Nb33.333P33.333S33.333,I m m m,orthorhombic,3.452957998992023,4.732533998057849,6.70970841,data/final/MP/cifs/Nb1P1S1-MP-mp-27471.cif,data/source/MP/raw/cifs/mp-27471.cif,mp-27471,0.0,,2014-02-19 20:16:39,5.250193426767171,10.17188/1201691,"@misc{osti_1201691,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbPS (SG:71) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201691"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695552'}},0.0625578009444414,7.64289146,520.0,-44.08863787,-7.348106311666666,{'tags': ['Niobium phosphide sulfide']},-44.08863787,-7.348106311666666,-0.9654205071527772,"['xas', 'elasticity', 'bandstructure']",True,[16075],True,2021-05-12 10:56:18.721000,NM,6,8,mp-27471,,NbPS,"{'functional': 'PBE', 'labels': ['Nb_pv', 'P', 'S'], 'pot_type': 'paw'}","{'Nb': 1.0, 'P': 1.0, 'S': 1.0}",GGA,mp-27471,"['mp-937307', 'mp-916607', 'mp-931868', 'mp-27471', 'mp-1434801', 'mp-1695552', 'mp-1796407', 'mp-1591052']",3.05e-06,"{'Nb': 2.0, 'P': 2.0, 'S': 2.0}",98.64512770796556,[],NM,False,71,0,"[0, 0, 0, 0, 0, 0]",6.183782353710135e-08,3.05e-06,0,6.1e-06,MP,data/source/MP/cleaned/cifs/MP-mp-27471.cif,False,,data/final/MP/graphs/Nb1P1S1-MP-mp-27471.json,0,True,mmm,0,0,0,7,0,0,0,0,0,1,0,1.0,False
Cu1Rh1.7Se4Sn0.3,3,0.0857142857142857,2.0,False,Cu2Rh3.4Se8Sn0.6,Cu2Rh4Se8,1.26,Other,True,Cu14.286Rh24.286Se57.143Sn4.286,Cu-Rh-Se-Sn,4,Supercon,Cu1Rh1.7Sn0.3Se4,MP-mp-15614,Cu2Rh4Se8,Cu-Rh-Se,Cu14.286Rh28.571Se57.143,F d -3 m,cubic,7.355548180000001,7.35554818,7.35554818,data/final/MP/cifs/Cu1Rh1.7Se4Sn0.3-MP-mp-15614-synth_doped.cif,data/source/MP/raw/cifs/mp-15614.cif,mp-15614,0.0,,2011-06-05 07:24:52,6.906389184589765,10.17188/1191272,"@misc{osti_1191272,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Cu(RhSe2)2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191272"",
    place = ""United States"",
    year = ""2015"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696606'}},0.0,4.3275914,520.0,-70.96322011,-5.068801436428571,"{'tags': ['Copper rhodium selenide (1/2/4)', 'Copper dirhodium tetraselenide']}",-70.96322011,-5.068801436428571,-0.6511631049107142,"['xas', 'bandstructure']",True,"[41903, 628775, 628777, 602898]",True,2021-05-12 10:56:53.126000,NM,14,8,mp-15614,,Cu(RhSe2)2,"{'functional': 'PBE', 'labels': ['Cu_pv', 'Rh_pv', 'Se'], 'pot_type': 'paw'}","{'Cu': 1.0, 'Rh': 2.0, 'Se': 4.0}",GGA,mp-15614,"['mp-920967', 'mp-942426', 'mp-942820', 'mp-15614', 'mp-1422873', 'mp-1696606', 'mp-1860746', 'mp-1604721']",0.00066735,"{'Cu': 2.0, 'Rh': 4.0, 'Se': 8.0}",281.40391576118253,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.743004362216169e-06,0.00066735,0,0.0013347,MP,data/source/MP/cleaned/cifs/MP-mp-15614.cif,True,,data/final/MP/graphs/Cu1Rh1.7Se4Sn0.3-MP-mp-15614-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ba0.074Cu1La1.926O4,2,0.0211428571428571,1.0,True,Ba0.074Cu1La1.926O4,Cu1La2O4,0.0,Cuprate,True,Ba1.057Cu14.286La27.514O57.142857142857146,Ba-Cu-La-O,4,Supercon,La1.926Ba0.074Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ba0.074Cu1La1.926O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ba0.074Cu1La1.926O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Bi0.25Pd0.75,1,0.0,16.0,False,Bi4Pd12,Bi4Pd12,0.0,Other,True,Bi25Pd75,Bi-Pd,2,Supercon,Bi0.25Pd0.75,MP-mp-30463,Bi4Pd12,Bi-Pd,Bi25Pd75,P m m a,orthorhombic,5.092227,5.855404,9.583114,data/final/MP/cifs/Bi0.25Pd0.75-MP-mp-30463.cif,data/source/MP/raw/cifs/mp-30463.cif,mp-30463,0.0,,2014-02-20 17:24:34,12.279181734382089,10.17188/1204870,"@misc{osti_1204870,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BiPd3 (SG:51) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1204870"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1670699'}},0.0,6.14112984,520.0,-81.90291015,-5.118931884375,{'tags': ['Bismuth palladium (1/3)']},-81.90291015,-5.118931884375,-0.2615119493749995,"['xas', 'bandstructure']",True,[58839],True,2021-05-12 10:57:04.957000,NM,16,8,mp-30463,,BiPd3,"{'functional': 'PBE', 'labels': ['Bi', 'Pd'], 'pot_type': 'paw'}","{'Bi': 1.0, 'Pd': 3.0}",GGA,mp-30463,"['mp-934581', 'mp-941105', 'mp-941419', 'mp-30463', 'mp-1428868', 'mp-1670699', 'mp-1874889', 'mp-1599003']",4.075e-06,"{'Bi': 4.0, 'Pd': 12.0}",285.74015426462006,[],NM,False,51,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.7044835164835784e-08,4.075e-06,0,1.63e-05,MP,data/source/MP/cleaned/cifs/MP-mp-30463.cif,False,,data/final/MP/graphs/Bi0.25Pd0.75-MP-mp-30463.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Fe1Sn2,1,0.0,2.0,False,Fe2Sn4,Fe2Sn4,0.0,Other,True,Fe33.333Sn66.667,Fe-Sn,2,Supercon,Fe1Sn2,MP-mp-22752,Fe2Sn4,Fe-Sn,Fe33.333Sn66.667,I 4/m c m,tetragonal,5.330486004788038,5.380414150410074,5.38041415,data/final/MP/cifs/Fe1Sn2-MP-mp-22752.cif,data/source/MP/raw/cifs/mp-22752.cif,mp-22752,0.0,,2014-02-21 16:07:17,8.36399547953507,10.17188/1198948,"@misc{osti_1198948,
    author = ""Persson, Kristin"",
    title = ""Materials Data on FeSn2 (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198948"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686437'}},0.0139972366666656,8.90502482,520.0,-32.90524615,-5.484207691666668,"{'tags': ['Iron stannide (1/2)', 'Iron tin (1/2)', 'Iron tin (1:2)']}",-32.90524615,-5.484207691666668,0.0121763616666659,"['xas', 'elasticity', 'bandstructure']",True,"[102800, 633758, 633760, 24570, 247483, 633753, 409909, 633761, 103636, 604017]",True,2021-05-12 10:56:16.728000,FM,6,10,mp-22752,,FeSn2,"{'functional': 'PBE', 'labels': ['Fe_pv', 'Sn_d'], 'pot_type': 'paw'}","{'Fe': 1.0, 'Sn': 2.0}",GGA,mp-22752,"['mp-906534', 'mp-921268', 'mp-920245', 'mp-22752', 'mp-1077439', 'mp-1077761', 'mp-1440033', 'mp-1686437', 'mp-1803439', 'mp-1589775']",1.54439055,"{'Fe': 2.0, 'Sn': 4.0}",116.44625838404173,[],FM,True,140,1,"[1.8, 1.8, 0.0, 0.0, 0.0, 0.0]",0.0265253786842437,1.54439055,2,3.0887811,MP,data/source/MP/cleaned/cifs/MP-mp-22752.cif,False,,data/final/MP/graphs/Fe1Sn2-MP-mp-22752.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Nb1Sb2,1,0.0,2.0,False,Nb2Sb4,Nb2Sb4,0.0,Other,True,Nb33.333Sb66.667,Nb-Sb,2,Supercon,Nb1Sb2,MP-mp-1969,Nb2Sb4,Nb-Sb,Nb33.333Sb66.667,C 1 2/m 1,monoclinic,3.6753619966072617,5.493770750000001,7.586840001027883,data/final/MP/cifs/Nb1Sb2-MP-mp-1969.cif,data/source/MP/raw/cifs/mp-1969.cif,mp-1969,0.0,,2011-05-13 00:27:15,8.046466072752281,10.17188/1194902,"@misc{osti_1194902,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbSb2 (SG:12) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1194902"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702710'}},0.0,7.87657757,520.0,-38.34154613,-6.390257688333333,{'tags': ['Niobium antimonide (1/2)']},-38.34154613,-6.390257688333333,-0.3984885149999992,"['xas', 'elasticity', 'bandstructure']",True,"[645350, 57430, 190180, 77752, 18144]",True,2021-05-12 10:56:14.760000,NM,6,13,mp-1969,,NbSb2,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Sb'], 'pot_type': 'paw'}","{'Nb': 1.0, 'Sb': 2.0}",GGA,mp-1969,"['mp-925269', 'mp-909607', 'mp-924729', 'mp-1969', 'mp-1072804', 'mp-1072826', 'mp-1072891', 'mp-1077030', 'mp-1441599', 'mp-1702710', 'mp-1779861', 'mp-1594066', 'mp-1072854']",0.001067,"{'Nb': 2.0, 'Sb': 4.0}",138.85577642999536,[],NM,False,12,0,"[0, 0, 0, 0, 0, 0]",1.5368463990951532e-05,0.001067,0,0.002134,MP,data/source/MP/cleaned/cifs/MP-mp-1969.cif,False,,data/final/MP/graphs/Nb1Sb2-MP-mp-1969.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
Fe1Se0.8,3,0.111111111111111,2.0,False,Fe2Se1.6,Fe2Se2,8.65,Ferrite,True,Fe55.556Se44.444,Fe-Se,2,Supercon,Fe1Se0.8,MP-mp-20311,Fe2Se2,Fe-Se,Fe50Se50,P 4/n m m,tetragonal,3.688905,3.688905,5.854194,data/final/MP/cifs/Fe1Se0.8-MP-mp-20311-synth_doped.cif,data/source/MP/raw/cifs/mp-20311.cif,mp-20311,0.0,,2013-10-20 07:09:24,5.619828229873189,10.17188/1195438,"@misc{osti_1195438,
    author = ""Persson, Kristin"",
    title = ""Materials Data on FeSe (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195438"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668877'}},0.0,3.48880228,520.0,-25.01949237,-6.2548730925,"{'tags': ['Iron selenide - NN AFM', 'Iron selenide - orthorhombic, LT', 'Iron selenide', 'Iron sulfide', 'Iron selenide (1/1) - nonmagnetic', 'Iron selenide - tetragonal', 'Iron selenide - alpha LT', 'Iron selenide - LT', 'High pressure experimental phase', 'Iron selenide - alpha']}",-25.01949237,-6.2548730925,-0.5079131286718743,"['xas', 'elasticity', 'bandstructure']",True,"[196301, 196298, 196299, 196297, 290701, 165958, 185464, 163561, 169257, 163560, 977900, 169311, 169303, 26889, 166440, 162901, 169283, 165957, 169271, 977903, 169259, 977901, 185465, 165959, 169306, 169267, 163557, 169287, 169297, 169289, 163556, 169299, 163562, 166441, 182544, 163559, 169269, 169263, 169265, 169315, 169255, 166439, 169293, 169313, 163555, 169291, 169301, 165960, 169253, 169295, 169970, 163558, 169285, 169261, 169309]",True,2021-05-12 10:56:14.760000,NM,4,55,mp-20311,,FeSe,"{'functional': 'PBE', 'labels': ['Fe_pv', 'Se'], 'pot_type': 'paw'}","{'Fe': 1.0, 'Se': 1.0}",GGA,mp-20311,"['mp-684656', 'mp-20311', 'mp-1063646', 'mp-1063662', 'mp-1063681', 'mp-1063669', 'mp-1063680', 'mp-1063695', 'mp-1063686', 'mp-1063699', 'mp-1063715', 'mp-1063717', 'mp-1063876', 'mp-1063734', 'mp-1063891', 'mp-1063735', 'mp-1063910', 'mp-1063918', 'mp-1063922', 'mp-1063931', 'mp-1063774', 'mp-1063781', 'mp-1064091', 'mp-1064111', 'mp-1063801', 'mp-1064112', 'mp-1064180', 'mp-1064138', 'mp-1064153', 'mp-1065102', 'mp-1065123', 'mp-1065075', 'mp-1065161', 'mp-1065131', 'mp-1065030', 'mp-1065055', 'mp-1065085', 'mp-1065094', 'mp-1440814', 'mp-1668877', 'mp-1799618', 'mp-1593782', 'mp-1592730', 'mp-1065081', 'mp-1065148', 'mp-1063928', 'mp-1063726', 'mp-1063683', 'mp-1063709', 'mp-1063911', 'mp-1063795', 'mp-1065121', 'mp-1063725', 'mp-1064139', 'mp-1064165']",3.455e-05,"{'Fe': 2.0, 'Se': 2.0}",79.66398961559156,[],NM,False,129,0,"[0, 0, 0, 0]",8.673931638803586e-07,3.455e-05,0,6.91e-05,MP,data/source/MP/cleaned/cifs/MP-mp-20311.cif,True,,data/final/MP/graphs/Fe1Se0.8-MP-mp-20311-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
C1Mg1Mn0.05Ni2.95,2,0.0199999999999999,1.0,True,C1Mg1Mn0.05Ni2.95,C1Mg1Ni3,0.0,Other,True,C20Mg20Mn1Ni59,C-Mg-Mn-Ni,4,Supercon,Mg1C1Ni2.95Mn0.05,MP-mp-10700,Mg1Ni3C1,C-Mg-Ni,C20Mg20Ni60,P m -3 m,cubic,3.810209,3.810209,3.810209,data/final/MP/cifs/C1Mg1Mn0.05Ni2.95-MP-mp-10700-synth_doped.cif,data/source/MP/raw/cifs/mp-10700.cif,mp-10700,0.0,,2011-05-28 10:04:44,6.376007671789427,10.17188/1187303,"@misc{osti_1187303,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MgNi3C (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187303"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678621'}},0.0,6.64260176,520.0,-28.85099542,-5.770199084,{'tags': ['Magnesium nickel carbide (1/3/1)']},-28.85099542,-5.770199084,-0.1367049259999994,"['xas', 'elasticity', 'bandstructure']",True,[77152],True,2021-05-12 10:56:10.715000,NM,5,8,mp-10700,,MgNi3C,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Ni_pv', 'C'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",GGA,mp-10700,"['mp-927245', 'mp-927653', 'mp-911184', 'mp-10700', 'mp-1438083', 'mp-1678621', 'mp-1791467', 'mp-1591421']",0.0387875,"{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",55.31544309398296,[],NM,False,221,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",0.0007012056277683,0.0387875,0,0.0387875,MP,data/source/MP/cleaned/cifs/MP-mp-10700.cif,True,,data/final/MP/graphs/C1Mg1Mn0.05Ni2.95-MP-mp-10700-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
La5Sn3,1,0.0,2.0,False,La10Sn6,La10Sn6,0.0,Other,True,La62.5Sn37.5,La-Sn,2,Supercon,La5Sn3,MP-mp-510494,La10Sn6,La-Sn,La62.5Sn37.5,I 4/m c m,tetragonal,6.363798001851287,9.620737549436804,9.62073755,data/final/MP/cifs/La5Sn3-MP-mp-510494.cif,data/source/MP/raw/cifs/mp-510494.cif,mp-510494,0.0,,2014-12-22 16:21:42,6.651458083649938,10.17188/1262976,"@misc{osti_1262976,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La5Sn3 (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1262976"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1708271'}},0.0,8.0874303,520.0,-84.69169469,-5.293230918125,"{'tags': ['Lanthanum stannide (5/3)', 'Lanthanum tin (5/3)']}",-84.69169469,-5.293230918125,-0.7046370318750004,"['xas', 'bandstructure']",True,"[642005, 108890, 641990]",True,2021-05-12 10:57:10.838000,NM,16,8,mp-510494,,La5Sn3,"{'functional': 'PBE', 'labels': ['La', 'Sn_d'], 'pot_type': 'paw'}","{'La': 5.0, 'Sn': 3.0}",GGA,mp-510494,"['mp-977840', 'mp-914345', 'mp-1430736', 'mp-1708271', 'mp-1878346', 'mp-978166', 'mp-1607139', 'mp-510494']",0.554703,"{'La': 10.0, 'Sn': 6.0}",524.5940223464692,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.002114789633015,0.554703,0,1.109406,MP,data/source/MP/cleaned/cifs/MP-mp-510494.cif,False,,data/final/MP/graphs/La5Sn3-MP-mp-510494.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
C1Si1,1,0.0,10.0,False,C10Si10,C10Si10,1.075,Other,True,C50Si50,C-Si,2,Supercon,C1Si1,MP-mp-568656,Si10C10,C-Si,C50Si50,P 3 m 1,trigonal,3.0946539964071347,3.09465488,25.3091,data/final/MP/cifs/C1Si1-MP-mp-568656.cif,data/source/MP/raw/cifs/mp-568656.cif,mp-568656,2.0410999999999984,,2013-10-02 02:11:25,3.17190824147168,10.17188/1274629,"@misc{osti_1274629,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SiC (SG:156) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1274629"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1705440'}},0.0,8.06396307,520.0,-150.61535921,-7.5307679605,{'tags': ['Silicon carbide']},-150.61535921,-7.5307679605,-0.2047206004999992,"['piezo', 'xas', 'bandstructure', 'diel', 'elasticity']",True,[38150],True,2021-05-12 10:56:22.739000,NM,20,12,mp-568656,,SiC,"{'functional': 'PBE', 'labels': ['Si', 'C'], 'pot_type': 'paw'}","{'Si': 1.0, 'C': 1.0}",GGA,mp-568656,"['mp-671296', 'mp-661935', 'mp-568656', 'mp-1125087', 'mp-1133357', 'mp-1140368', 'mp-1258918', 'mp-1430062', 'mp-1705440', 'mp-1833029', 'mp-1603884', 'mp-692857']",0.0018051399999999,"{'Si': 10.0, 'C': 10.0}",209.9093083831296,[],NM,False,156,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",8.599618634849825e-05,0.0018051399999999,0,0.0180514,MP,data/source/MP/cleaned/cifs/MP-mp-568656.cif,False,,data/final/MP/graphs/C1Si1-MP-mp-568656.json,0,True,3m,0,0,0,0,0,0,5,1,0,0,0,1.0,False
Bi2Ca1Cu2Sr2O8.248,2,0.0151801329136061,1.9399728419010671,False,Bi3.88Ca1.94Cu3.88Sr3.88O16,Bi4Ca2Cu4Sr4O16,86.0,Cuprate,True,Bi13.116Ca6.558Cu13.116Sr13.116O54.092339979013644,Bi-Ca-Cu-Sr-O,5,Supercon,Bi2Sr2Ca1Cu2O8.248,MP-mp-1218930,Sr4Ca2Cu4Bi4O16,Bi-Ca-Cu-Sr-O,Bi13.333Ca6.667Cu13.333Sr13.333O53.333333333333336,C c c 2,orthorhombic,5.417115,5.472898000129128,16.11398919,data/final/MP/cifs/Bi2Ca1Cu2Sr2O8.248-MP-mp-1218930-synth_doped.cif,data/source/MP/raw/cifs/mp-1218930.cif,mp-1218930,0.0,,2019-01-12 20:01:06.544000,6.266668983881059,,,,0.039252223722225,4.51768334,520.0,-173.15021002,-5.771673667333333,{'tags': []},-173.15021002,-5.771673667333333,-2.074956548222222,[],False,[],True,2021-05-12 11:00:42.526000,NM,30,3,mp-1218930,oxide,Sr2CaCu2(BiO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",GGA,mp-1218930,"['mp-1218930', 'mp-1359698', 'mp-1817714']",0.00011165,"{'Sr': 4.0, 'Ca': 2.0, 'Cu': 4.0, 'Bi': 4.0, 'O': 16.0}",470.7976286073367,[],NM,False,37,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.743014544498498e-07,0.00011165,0,0.0002233,MP,data/source/MP/cleaned/cifs/MP-mp-1218930.cif,True,,data/final/MP/graphs/Bi2Ca1Cu2Sr2O8.248-MP-mp-1218930-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Au0.24Nb0.76,2,0.02,8.0,False,Au1.92Nb6.08,Au2Nb6,10.78,Other,True,Au24Nb76,Au-Nb,2,Supercon,Au0.24Nb0.76,MP-mp-2752,Nb6Au2,Au-Nb,Au25Nb75,P m -3 n,cubic,5.256336,5.256336,5.256336,data/final/MP/cifs/Au0.24Nb0.76-MP-mp-2752-synth_doped.cif,data/source/MP/raw/cifs/mp-2752.cif,mp-2752,0.0,,2011-05-14 04:00:34,10.878019698243486,10.17188/1201733,"@misc{osti_1201733,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Au (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201733"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677627'}},0.0265571000000033,5.43391329,520.0,-67.6805768,-8.4600721,{'tags': ['Gold niobium (1/3)']},-67.6805768,-8.4600721,-0.0656229350000003,"['xas', 'elasticity', 'bandstructure']",True,"[612199, 58557, 612192, 612186, 612203, 612188, 612198, 612185]",True,2021-05-12 10:56:18.721000,FM,8,8,mp-2752,,Nb3Au,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Au'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Au': 1.0}",GGA,mp-2752,"['mp-941043', 'mp-934500', 'mp-940884', 'mp-2752', 'mp-1437534', 'mp-1677627', 'mp-1787383', 'mp-1591584']",0.84123765,"{'Nb': 6.0, 'Au': 2.0}",145.22766553647008,[],FM,True,223,1,"[0.2, 0.2, 0.2, 0.2, 0.2, 0.2, 0.0, 0.0]",0.0115850881013954,0.84123765,6,1.6824753,MP,data/source/MP/cleaned/cifs/MP-mp-2752.cif,True,,data/final/MP/graphs/Au0.24Nb0.76-MP-mp-2752-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Cd1,1,0.0,2.0,False,Cd2,Cd2,0.52414,Other,True,Cd100,Cd,1,Supercon,Cd1,MP-mp-94,Cd2,Cd,Cd100,P 63/m m c,hexagonal,3.0078460004625827,3.00784596,5.941963,data/final/MP/cifs/Cd1-MP-mp-94.cif,data/source/MP/raw/cifs/mp-94.cif,mp-94,0.0,,2011-05-12 19:29:25,8.018924852597033,10.17188/1313191,"@misc{osti_1313191,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Cd (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1313191"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668776'}},0.01360791,2.46427192,520.0,-1.8185637,-0.90928185,"{'tags': ['Cadmium - nanocrystalline', 'Cadmium']}",-1.8185637,-0.90928185,0.01360791,"['surfaces', 'eos', 'bandstructure', 'xas', 'elasticity']",True,"[52264, 181733, 619641, 98179, 426933, 619639, 64702, 52793, 619642, 53770]",True,2021-05-12 10:56:35.166000,NM,2,13,mp-94,,Cd,"{'functional': 'PBE', 'labels': ['Cd'], 'pot_type': 'paw'}",{'Cd': 1.0},GGA,mp-94,"['mp-94', 'mp-923212', 'mp-907908', 'mp-922429', 'mp-1059667', 'mp-1059606', 'mp-1059622', 'mp-1440672', 'mp-1668776', 'mp-1792425', 'mp-1588695', 'mp-1587965', 'mp-1059656']",0.0001325,{'Cd': 2.0},46.55558206287951,[],NM,False,194,0,"[0, 0]",5.692120864090631e-06,0.0001325,0,0.000265,MP,data/source/MP/cleaned/cifs/MP-mp-94.cif,False,,data/final/MP/graphs/Cd1-MP-mp-94.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Cu1La1.99Sr0.01O4,2,0.0028571428571428,1.0,True,Cu1La1.99Sr0.01O4,Cu1La2O4,0.0,Cuprate,True,Cu14.286La28.429Sr0.143O57.142857142857146,Cu-La-Sr-O,4,Supercon,La1.99Sr0.01Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La1.99Sr0.01O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La1.99Sr0.01O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Si3Zr4,3,0.1428571428571428,1.0,True,Si3Zr4,Si4Zr4,0.0,Other,True,Si42.857Zr57.143,Si-Zr,2,Supercon,Si3Zr4,MP-mp-893,Zr4Si4,Si-Zr,Si50Zr50,P n m a,orthorhombic,3.803331,5.328118,7.030146,data/final/MP/cifs/Si3Zr4-MP-mp-893-synth_doped.cif,data/source/MP/raw/cifs/mp-893.cif,mp-893,0.0,,2011-05-13 11:07:54,5.5626509889834965,10.17188/1312835,"@misc{osti_1312835,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrSi (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1312835"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698212'}},0.0,6.90800899,520.0,-63.35876587,-7.91984573375,"{'tags': ['Zirconium silicide', 'Zirconium silicide (1/1)']}",-63.35876587,-7.91984573375,-0.8978384087500002,"['xas', 'elasticity', 'bandstructure']",True,"[652609, 16771, 652613, 43245]",True,2021-05-12 10:56:33.121000,NM,8,10,mp-893,,ZrSi,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Si'], 'pot_type': 'paw'}","{'Zr': 1.0, 'Si': 1.0}",GGA,mp-893,"['mp-912244', 'mp-928807', 'mp-928271', 'mp-893', 'mp-1125250', 'mp-1138328', 'mp-1431730', 'mp-1698212', 'mp-1780493', 'mp-1588280']",0.0008038,"{'Zr': 4.0, 'Si': 4.0}",142.46307104930645,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0]",2.256865569665573e-05,0.0008038,0,0.0032152,MP,data/source/MP/cleaned/cifs/MP-mp-893.cif,True,,data/final/MP/graphs/Si3Zr4-MP-mp-893-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Pb1Pd2Tm1,1,0.0,1.0,True,Pb1Pd2Tm1,Pb1Pd2Tm1,2.1,Other,True,Pb25Pd50Tm25,Pb-Pd-Tm,3,Supercon,Pd2Tm1Pb1,MP-mp-1206954,Tm1Pd2Pb1,Pb-Pd-Tm,Pb25Pd50Tm25,F m -3 m,cubic,4.84385399,4.84385399,4.84385399,data/final/MP/cifs/Pb1Pd2Tm1-MP-mp-1206954.cif,data/source/MP/raw/cifs/mp-1206954.cif,mp-1206954,0.0,,2019-01-12 10:09:40.454000,12.169906572121224,,,{'GGA': {'task_id': 'mp-1766741'}},0.0165175987499974,6.012102,520.0,-21.39239518,-5.348098795,"{'tags': ['b.c.c. atom arrangement', 'Cu2MnAl', 'TmPd2Pb']}",-21.39239518,-5.348098795,-0.7110372666666667,['bandstructure'],True,[],True,2021-05-12 10:58:39.488000,NM,4,5,mp-1206954,,TmPd2Pb,"{'functional': 'PBE', 'labels': ['Tm_3', 'Pd', 'Pb_d'], 'pot_type': 'paw'}","{'Tm': 1.0, 'Pd': 2.0, 'Pb': 1.0}",GGA,mp-1206954,"['mp-1206954', 'mp-1432269', 'mp-1766741', 'mp-1783221', 'mp-1617872']",0.0010731,"{'Tm': 1.0, 'Pd': 2.0, 'Pb': 1.0}",80.36336837336982,[],NM,False,225,0,"[0, 0, 0, 0]",1.3353098827495082e-05,0.0010731,0,0.0010731,MP,data/source/MP/cleaned/cifs/MP-mp-1206954.cif,False,,data/final/MP/graphs/Pb1Pd2Tm1-MP-mp-1206954.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
C1Mn0.02Mo0.98,2,0.02,1.0,True,C1Mn0.02Mo0.98,C1Mo1,0.0,Other,True,C50Mn1Mo49,C-Mn-Mo,3,Supercon,C1Mn0.02Mo0.98,MP-mp-2305,Mo1C1,C-Mo,C50Mo50,P -6 m 2,hexagonal,2.835086,2.92410600478411,2.92410507,data/final/MP/cifs/C1Mn0.02Mo0.98-MP-mp-2305-synth_doped.cif,data/source/MP/raw/cifs/mp-2305.cif,mp-2305,0.0,,2011-05-12 17:49:42,8.538697979393088,10.17188/1199194,"@misc{osti_1199194,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MoC (SG:187) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199194"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668222'}},0.0010243049999996,8.62658168,520.0,-20.24014809,-10.120074045,{'tags': ['Molybdenum carbide (1/1)']},-20.24014809,-10.120074045,-0.0838621800000005,"['xas', 'elasticity', 'bandstructure']",True,"[77156, 618300]",True,2021-05-12 10:56:16.728000,NM,2,9,mp-2305,,MoC,"{'functional': 'PBE', 'labels': ['Mo_pv', 'C'], 'pot_type': 'paw'}","{'Mo': 1.0, 'C': 1.0}",GGA,mp-2305,"['mp-927633', 'mp-927239', 'mp-911174', 'mp-2305', 'mp-1116092', 'mp-1440368', 'mp-1668222', 'mp-1791400', 'mp-1638434']",0.0001977,"{'Mo': 1.0, 'C': 1.0}",20.99340614335182,[],NM,False,187,0,"[0, 0]",9.417242664197564e-06,0.0001977,0,0.0001977,MP,data/source/MP/cleaned/cifs/MP-mp-2305.cif,True,,data/final/MP/graphs/C1Mn0.02Mo0.98-MP-mp-2305-synth_doped.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
As2Ba0.5Co0.2Fe1.8K0.5,3,0.0799999999999999,2.0,False,As4Ba1Co0.4Fe3.6K1,As4Ba1Fe4K1,19.95,Ferrite,True,As40Ba10Co4Fe36K10,As-Ba-Co-Fe-K,5,Supercon,Ba0.5K0.5Fe1.8Co0.2As2,MP-mp-1223517,K1Ba1Fe4As4,As-Ba-Fe-K,As40Ba10Fe40K10,C m m m,orthorhombic,5.479027,5.480024002658328,7.13170472,data/final/MP/cifs/As2Ba0.5Co0.2Fe1.8K0.5-MP-mp-1223517-synth_doped.cif,data/source/MP/raw/cifs/mp-1223517.cif,mp-1223517,0.0,,2019-01-12 23:54:03.876000,5.87534599912672,,,{'GGA': {'task_id': 'mp-1743010'}},0.0132513644999994,4.21185628,520.0,-59.66633886,-5.966633886,{'tags': []},-59.66633886,-5.966633886,-0.4120461663000007,[],False,[],True,2021-05-12 11:00:52.054000,FM,10,4,mp-1223517,,KBa(FeAs)4,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",GGA,mp-1223517,"['mp-1223517', 'mp-1396881', 'mp-1743010', 'mp-1827585']",0.9947188,"{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",197.6961518155852,[],FM,True,65,1,"[0.0, 0.0, 0.3, 0.3, 0.3, 0.3, 0.0, 0.0, 0.0, 0.0]",0.0050315536790412,0.9947188,4,0.9947188,MP,data/source/MP/cleaned/cifs/MP-mp-1223517.cif,True,,data/final/MP/graphs/As2Ba0.5Co0.2Fe1.8K0.5-MP-mp-1223517-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ga0.78Sn0.22V3,3,0.1099999999999999,2.0,False,Ga1.56Sn0.44V6,Ga2V6,6.9,Other,True,Ga19.5Sn5.5V75,Ga-Sn-V,3,Supercon,V3Ga0.78Sn0.22,MP-mp-22568,V6Ga2,Ga-V,Ga25V75,P m -3 n,cubic,4.789645,4.789645,4.789645,data/final/MP/cifs/Ga0.78Sn0.22V3-MP-mp-22568-synth_doped.cif,data/source/MP/raw/cifs/mp-22568.cif,mp-22568,0.0,,2014-02-22 11:36:40,6.726541666276222,10.17188/1198793,"@misc{osti_1198793,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Ga (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198793"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686867'}},0.0,5.67452231,520.0,-61.95244347,-7.74405543375,{'tags': ['Gallium vanadium (1/3)']},-61.95244347,-7.74405543375,-0.1741018756249994,"['xas', 'elasticity', 'bandstructure']",True,"[635643, 635628, 635619, 635634, 104021, 635646, 635604, 635610, 635617, 635624, 635626, 635605, 635631, 635625, 635636, 635603, 104020, 635616, 635607]",True,2021-05-12 10:56:16.728000,FM,8,9,mp-22568,,V3Ga,"{'functional': 'PBE', 'labels': ['V_pv', 'Ga_d'], 'pot_type': 'paw'}","{'V': 3.0, 'Ga': 1.0}",GGA,mp-22568,"['mp-941343', 'mp-941663', 'mp-934924', 'mp-22568', 'mp-1440749', 'mp-1686867', 'mp-1804076', 'mp-1593784', 'mp-1595713']",0.09063635,"{'V': 6.0, 'Ga': 2.0}",109.87780534443452,[],FM,True,131,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.0, -0.0, -0.0]",0.0016497662965852,0.09063635,2,0.1812727,MP,data/source/MP/cleaned/cifs/MP-mp-22568.cif,True,,data/final/MP/graphs/Ga0.78Sn0.22V3-MP-mp-22568-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Cu1Tl2O6.164,2,0.0133546138562261,1.9469469500324463,False,Ba3.894Cu1.947Tl3.894O12,Ba4Cu2Tl4O12,0.0,Cuprate,True,Ba17.915Cu8.957Tl17.915O55.21318523826585,Ba-Cu-Tl-O,4,Supercon,Tl2Ba2Cu1O6.164,MP-mp-6027,Ba4Tl4Cu2O12,Ba-Cu-Tl-O,Ba18.182Cu9.091Tl18.182O54.54545454545455,C m c a,orthorhombic,5.504110002693673,5.585743,12.28312762,data/final/MP/cifs/Ba2Cu1Tl2O6.164-MP-mp-6027-synth_doped.cif,data/source/MP/raw/cifs/mp-6027.cif,mp-6027,0.0,,2011-05-19 00:05:23,7.606665315628389,10.17188/1277350,"@misc{osti_1277350,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Tl2CuO6 (SG:64) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277350"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1673478'}},0.0059215576010052,4.10961464,520.0,-115.75418737,-5.261553971363636,"{'tags': ['Dithallium dibarium cuprate', 'Dithallium(III) dibarium copper oxide']}",-115.75418737,-5.261553971363636,-1.7862630028787878,"['xas', 'bandstructure']",True,"[202723, 202724, 202722]",True,2021-05-12 10:57:28.836000,NM,22,8,mp-6027,oxide,Ba2Tl2CuO6,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Tl_d', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Tl': 2.0, 'Cu': 1.0, 'O': 6.0}",GGA,mp-6027,"['mp-925246', 'mp-909581', 'mp-924678', 'mp-6027', 'mp-1504634', 'mp-1673478', 'mp-1837163', 'mp-1605186']",2.9e-05,"{'Ba': 4.0, 'Tl': 4.0, 'Cu': 2.0, 'O': 12.0}",368.0385386017736,[],NM,False,64,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.5759219189476614e-07,2.9e-05,0,5.8e-05,MP,data/source/MP/cleaned/cifs/MP-mp-6027.cif,True,,data/final/MP/graphs/Ba2Cu1Tl2O6.164-MP-mp-6027-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ba0.03Cu1La1.97O4,2,0.0085714285714285,1.0,True,Ba0.03Cu1La1.97O4,Cu1La2O4,0.0,Cuprate,True,Ba0.429Cu14.286La28.143O57.142857142857146,Ba-Cu-La-O,4,Supercon,La1.97Ba0.03Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ba0.03Cu1La1.97O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ba0.03Cu1La1.97O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Re1Si2,1,0.0,1.0,True,Re1Si2,Re1Si2,0.0,Other,True,Re33.333Si66.667,Re-Si,2,Supercon,Re1Si2,MP-mp-12605,Re1Si2,Re-Si,Re33.333Si66.667,I 4/m m m,tetragonal,3.1959199996341328,3.1959199996341328,4.53587122,data/final/MP/cifs/Re1Si2-MP-mp-12605.cif,data/source/MP/raw/cifs/mp-12605.cif,mp-12605,0.0,,2011-05-27 18:30:29,10.0194755667805,10.17188/1189007,"@misc{osti_1189007,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ReSi2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189007"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687664'}},0.198291910416664,11.23549658,520.0,-23.88107819,-7.960359396666667,"{'tags': ['Rhenium silicide (1/2)', 'Rhenium silicon (1/2)']}",-23.88107819,-7.960359396666667,-0.1479743216666662,"['xas', 'elasticity', 'bandstructure']",True,"[38274, 650100, 108721, 650107, 650113]",True,2021-05-12 10:56:12.755000,NM,3,9,mp-12605,,ReSi2,"{'functional': 'PBE', 'labels': ['Re_pv', 'Si'], 'pot_type': 'paw'}","{'Re': 1.0, 'Si': 2.0}",GGA,mp-12605,"['mp-1007041', 'mp-1000576', 'mp-12605', 'mp-1143543', 'mp-1442353', 'mp-1687664', 'mp-1793562', 'mp-1011766', 'mp-1586181']",0.0010797,"{'Re': 1.0, 'Si': 2.0}",40.16958125221525,[],NM,False,139,0,"[0, 0, 0]",2.6878547556192345e-05,0.0010797,0,0.0010797,MP,data/source/MP/cleaned/cifs/MP-mp-12605.cif,False,,data/final/MP/graphs/Re1Si2-MP-mp-12605.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B2Mg0.95Mn0.05,2,0.0333333333333333,1.0,True,B2Mg0.95Mn0.05,B2Mg1,30.0,Other,True,B66.667Mg31.667Mn1.667,B-Mg-Mn,3,Supercon,Mg0.95Mn0.05B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B2Mg0.95Mn0.05-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B2Mg0.95Mn0.05-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Al1Nb2.85W0.15,3,0.0749999999999999,2.0,False,Al2Nb5.7W0.3,Al2Nb6,15.2,Other,True,Al25Nb71.25W3.75,Al-Nb-W,3,Supercon,Nb2.85W0.15Al1,MP-mp-796,Nb6Al2,Al-Nb,Al25Nb75,P m -3 n,cubic,5.215254,5.215254,5.215254,data/final/MP/cifs/Al1Nb2.85W0.15-MP-mp-796-synth_doped.cif,data/source/MP/raw/cifs/mp-796.cif,mp-796,0.0,,2011-05-13 16:07:37,7.157298025966356,,,{'GGA': {'task_id': 'mp-1686893'}},0.0460773865000003,5.52947534,520.0,-69.48918494,-8.6861481175,"{'tags': ['Aluminium niobium (1/3)', 'Niobium aluminide (3/1)', 'Aluminum niobium (1/3)']}",-69.48918494,-8.6861481175,-0.1737753800000003,"['bandstructure', 'elasticity']",True,"[608675, 608654, 608688, 608668, 608669, 608685, 608676, 608683, 58014, 608657, 107856, 608655, 608666, 608691, 608656, 608665, 608673, 608653, 608661]",True,2021-05-12 10:56:31.128000,NM,8,10,mp-796,,Nb3Al,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Al': 1.0}",GGA,mp-796,"['mp-911586', 'mp-927906', 'mp-796', 'mp-927472', 'mp-1260512', 'mp-1440919', 'mp-1686893', 'mp-1927652', 'mp-1591599', 'mp-1587739']",0.16323955,"{'Nb': 6.0, 'Al': 2.0}",141.8490379078192,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0023015954483396,0.16323955,0,0.3264791,MP,data/source/MP/cleaned/cifs/MP-mp-796.cif,True,,data/final/MP/graphs/Al1Nb2.85W0.15-MP-mp-796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Tc2Zr1,1,0.0,4.0,False,Tc8Zr4,Tc8Zr4,7.6,Other,True,Tc66.667Zr33.333,Tc-Zr,2,Supercon,Tc2Zr1,MP-mp-1095545,Zr4Tc8,Tc-Zr,Tc66.667Zr33.333,P 63/m m c,hexagonal,5.221583999374097,5.22158366,8.789225,data/final/MP/cifs/Tc2Zr1-MP-mp-1095545.cif,data/source/MP/raw/cifs/mp-1095545.cif,mp-1095545,0.0,,2018-04-28 07:15:48,9.192721448454892,,,{'GGA': {'task_id': 'mp-1703747'}},0.0,6.66988197,520.0,-120.85440381,-10.0712003175,"{'tags': ['MgZn2', 'ZrTc2', 'Friauf-Laves phase, Frank-Kasper phase', 'Technetium zirconium (2/1)', 'Zirconium technetium (1/2)']}",-120.85440381,-10.0712003175,-0.3148868341666653,['bandstructure'],True,"[423221, 653041]",True,2021-05-12 10:58:18.470000,NM,12,6,mp-1095545,,ZrTc2,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Tc_pv'], 'pot_type': 'paw'}","{'Zr': 1.0, 'Tc': 2.0}",GGA,mp-1095545,"['mp-1095545', 'mp-1103636', 'mp-1417842', 'mp-1703747', 'mp-1790027', 'mp-1597470']",0.0018238,"{'Zr': 4.0, 'Tc': 8.0}",207.532307179952,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.5152117273356904e-05,0.0018238,0,0.0072952,MP,data/source/MP/cleaned/cifs/MP-mp-1095545.cif,False,,data/final/MP/graphs/Tc2Zr1-MP-mp-1095545.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Fe2Ge2Ho1,1,0.0,1.0,True,Fe2Ge2Ho1,Fe2Ge2Ho1,0.0,Other,True,Fe40Ge40Ho20,Fe-Ge-Ho,3,Supercon,Ho1Fe2Ge2,MP-mp-3065,Ho1Fe2Ge2,Fe-Ge-Ho,Fe40Ge40Ho20,I 4/m m m,tetragonal,3.930296002638007,3.930296002638008,6.040363710000001,data/final/MP/cifs/Fe2Ge2Ho1-MP-mp-3065.cif,data/source/MP/raw/cifs/mp-3065.cif,mp-3065,0.0,,2011-05-13 12:49:14,8.456604516164752,10.17188/1205024,"@misc{osti_1205024,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ho(FeGe)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1205024"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1007178'}},0.0,4.70664959,520.0,-32.98758108,-6.597516216,{'tags': ['Holmium iron germanide (1/2/2)']},-32.98758108,-6.597516216,-0.44381992,"['xas', 'bandstructure']",True,"[88110, 632045, 88109, 164212, 84174]",True,2021-05-12 10:57:04.957000,FM,5,7,mp-3065,,Ho(FeGe)2,"{'functional': 'PBE', 'labels': ['Ho_3', 'Fe_pv', 'Ge_d'], 'pot_type': 'paw'}","{'Ho': 1.0, 'Fe': 2.0, 'Ge': 2.0}",GGA,mp-3065,"['mp-1000719', 'mp-1007178', 'mp-3065', 'mp-1439556', 'mp-1801590', 'mp-1011915', 'mp-1588828']",4.5473812,"{'Ho': 1.0, 'Fe': 2.0, 'Ge': 2.0}",82.84435700308352,[],FM,True,139,1,"[0.0, 2.3, 2.3, 0.0, 0.0]",0.0548906571853861,4.5473812,2,4.5473812,MP,data/source/MP/cleaned/cifs/MP-mp-3065.cif,False,,data/final/MP/graphs/Fe2Ge2Ho1-MP-mp-3065.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
C1.3La1,3,0.0695652173913043,8.0,False,C10.4La8,C12La8,8.3,Other,True,C56.522La43.478,C-La,2,Supercon,C1.3La1,MP-mp-1184,La8C12,C-La,C60La40,I -4 3 d,cubic,7.637375841693086,7.63737584,7.63737584,data/final/MP/cifs/C1.3La1-MP-mp-1184-synth_doped.cif,data/source/MP/raw/cifs/mp-1184.cif,mp-1184,0.0,,2011-05-15 20:02:16,6.078703935325423,10.17188/1188425,"@misc{osti_1188425,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La2C3 (SG:220) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188425"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1705323'}},0.0,8.62068433,520.0,-153.54505024,-7.677252512,"{'tags': ['Dilanthanum tricarbide', 'Lanthanum carbide (2/3)', 'High pressure experimental phase']}",-153.54505024,-7.677252512,-0.1667812499999982,"['xas', 'bandstructure']",True,"[601151, 618149, 602770, 153809, 26588, 618154, 618165, 74660, 153808]",True,2021-05-12 10:56:51.169000,NM,20,8,mp-1184,,La2C3,"{'functional': 'PBE', 'labels': ['La', 'C'], 'pot_type': 'paw'}","{'La': 2.0, 'C': 3.0}",GGA,mp-1184,"['mp-908695', 'mp-1184', 'mp-922935', 'mp-923731', 'mp-1430354', 'mp-1705323', 'mp-1841098', 'mp-1597811']",0.000412725,"{'La': 8.0, 'C': 12.0}",342.93404268099584,[],NM,False,220,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.814045252240241e-06,0.000412725,0,0.0016509,MP,data/source/MP/cleaned/cifs/MP-mp-1184.cif,True,,data/final/MP/graphs/C1.3La1-MP-mp-1184-synth_doped.json,0,True,-43m,5,0,0,0,0,0,0,0,0,1,0,1.0,False
C1Hf0.4Nb0.6,3,0.0999999999999999,2.0,False,C2Hf0.8Nb1.2,C2Hf1Nb1,5.6,Other,True,C50Hf20Nb30,C-Hf-Nb,3,Supercon,C1Hf0.4Nb0.6,MP-mp-1224334,Hf1Nb1C2,C-Hf-Nb,C50Hf25Nb25,R -3 m,trigonal,3.2283724814233605,3.228372481423361,5.61495687,data/final/MP/cifs/C1Hf0.4Nb0.6-MP-mp-1224334-synth_doped.cif,data/source/MP/raw/cifs/mp-1224334.cif,mp-1224334,0.0,,2019-01-13 00:35:56.434000,10.261089831989311,,,{'GGA': {'task_id': 'mp-1767424'}},0.0,6.85563077,520.0,-41.42178362,-10.355445905,{'tags': []},-41.42178362,-10.355445905,-0.7274320824999982,['bandstructure'],True,[],True,2021-05-12 10:58:45.495000,NM,4,5,mp-1224334,,HfNbC2,"{'functional': 'PBE', 'labels': ['Hf_pv', 'Nb_pv', 'C'], 'pot_type': 'paw'}","{'Hf': 1.0, 'Nb': 1.0, 'C': 2.0}",GGA,mp-1224334,"['mp-1224334', 'mp-1414286', 'mp-1767424', 'mp-1793357', 'mp-1609501']",0.0053282,"{'Hf': 1.0, 'Nb': 1.0, 'C': 2.0}",47.80708216089565,[],NM,False,166,0,"[0, 0, 0, 0]",0.0001114521062395,0.0053282,0,0.0053282,MP,data/source/MP/cleaned/cifs/MP-mp-1224334.cif,True,,data/final/MP/graphs/C1Hf0.4Nb0.6-MP-mp-1224334-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
C2La0.8Ni1Y0.2,3,0.0999999999999999,1.0,True,C2La0.8Ni1Y0.2,C2La1Ni1,1.26,Other,True,C50La20Ni25Y5,C-La-Ni-Y,4,Supercon,La0.8Y0.2Ni1C2,MP-mp-1018048,La1Ni1C2,C-La-Ni,C50La25Ni25,A m m 2,orthorhombic,3.82731293,3.82731293,3.977635,data/final/MP/cifs/C2La0.8Ni1Y0.2-MP-mp-1018048-synth_doped.cif,data/source/MP/raw/cifs/mp-1018048.cif,mp-1018048,0.0,,2017-04-06 23:27:44,6.5955568384756855,10.17188/1350127,"@article{osti_1350127,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaNiC2 (SG:38) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1350127"",
    place = ""United States"",
    year = ""2017"",
    month = ""4""
}
",{'GGA': {'task_id': 'mp-1697101'}},0.0,8.87914765,520.0,-30.18892584,-7.54723146,"{'tags': ['LaNiC2', 'Lanthanum nickel carbide (1/1/2)', 'CeNiC2']}",-30.18892584,-7.54723146,-0.2548051637499995,"['bandstructure', 'elasticity']",True,[618179],True,2021-05-12 10:56:08.727000,NM,4,12,mp-1018048,,LaNiC2,"{'functional': 'PBE', 'labels': ['La', 'Ni_pv', 'C'], 'pot_type': 'paw'}","{'La': 1.0, 'Ni': 1.0, 'C': 2.0}",GGA,mp-1018048,"['mp-1018048', 'mp-1018270', 'mp-1018463', 'mp-1067001', 'mp-1067047', 'mp-1067181', 'mp-1115476', 'mp-1412950', 'mp-1697101', 'mp-1783297', 'mp-1594865', 'mp-1067093']",0.005804,"{'La': 1.0, 'Ni': 1.0, 'C': 2.0}",55.79651958097468,[],NM,False,38,0,"[0.0, -0.0, 0.0, 0.0]",0.0001040208250189,0.005804,0,0.005804,MP,data/source/MP/cleaned/cifs/MP-mp-1018048.cif,True,,data/final/MP/graphs/C2La0.8Ni1Y0.2-MP-mp-1018048-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Nb1Sr0.75O3,3,0.0842105263157895,4.0,False,Nb4Sr3O12,Nb4Sr4O12,0.0,Oxide,True,Nb21.053Sr15.789O63.15789473684211,Nb-Sr-O,3,Supercon,Sr0.75Nb1O3,MP-mp-10339,Sr4Nb4O12,Nb-Sr-O,Nb20Sr20O60,P n m a,orthorhombic,5.751654,5.754906,8.19662,data/final/MP/cifs/Nb1Sr0.75O3-MP-mp-10339-synth_doped.cif,data/source/MP/raw/cifs/mp-10339.cif,mp-10339,0.0,,2011-06-06 13:05:19,5.594692481399679,10.17188/1186970,"@misc{osti_1186970,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SrNbO3 (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1186970"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1669855'}},0.0077974329285694,5.63978103,520.0,-161.91542396,-8.095771198,{'tags': ['Strontium niobate(IV)']},-161.91542396,-8.095771198,-3.1810348963333333,"['xas', 'bandstructure']",True,[88723],True,2021-05-12 10:56:51.169000,NM,20,8,mp-10339,oxide,SrNbO3,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Nb_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Nb': 1.0, 'O': 3.0}",GGA,mp-10339,"['mp-926391', 'mp-926905', 'mp-910622', 'mp-10339', 'mp-32243', 'mp-1433474', 'mp-1669855', 'mp-1608498']",0.001437925,"{'Sr': 4.0, 'Nb': 4.0, 'O': 12.0}",271.30999176806966,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.1199735264143395e-05,0.001437925,0,0.0057517,MP,data/source/MP/cleaned/cifs/MP-mp-10339.cif,True,,data/final/MP/graphs/Nb1Sr0.75O3-MP-mp-10339-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
N0.98Pr1,2,0.0101010101010101,1.0,True,N0.98Pr1,N1Pr1,0.0,Heavy_fermion,True,N49.495Pr50.505,N-Pr,2,Supercon,N0.98Pr1,MP-mp-343,Pr1N1,N-Pr,N50Pr50,F m -3 m,cubic,3.69189219,3.69189219,3.69189219,data/final/MP/cifs/N0.98Pr1-MP-mp-343-synth_doped.cif,data/source/MP/raw/cifs/mp-343.cif,mp-343,0.4124999999999996,,2011-05-12 17:44:27,7.229507537404175,10.17188/1206763,"@misc{osti_1206763,
    author = ""Persson, Kristin"",
    title = ""Materials Data on PrN (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1206763"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686759'}},0.0,3.79085564,520.0,-15.6841585,-7.84207925,"{'tags': ['Praseodymium nitride - NaCl-type', 'Praseodymium nitride - NP', 'Praseodymium nitride', 'High pressure experimental phase', 'Praseodymium thorium nitride (1/1/2)']}",-15.6841585,-7.84207925,-1.463882215,"['xas', 'elasticity', 'bandstructure']",True,"[644630, 181482, 644633, 181481, 169199, 168641, 169214, 644631, 644626, 644628, 181480, 644624, 644627, 45161, 644632]",True,2021-05-12 10:56:20.740000,NM,2,9,mp-343,,PrN,"{'functional': 'PBE', 'labels': ['Pr_3', 'N'], 'pot_type': 'paw'}","{'Pr': 1.0, 'N': 1.0}",GGA,mp-343,"['mp-910811', 'mp-926467', 'mp-927043', 'mp-343', 'mp-1440742', 'mp-1686759', 'mp-1795038', 'mp-1594872', 'mp-1596863']",0.0001199,"{'Pr': 1.0, 'N': 1.0}",35.582137347672045,[],NM,False,225,0,"[0, 0]",3.3696682925047625e-06,0.0001199,0,0.0001199,MP,data/source/MP/cleaned/cifs/MP-mp-343.cif,True,,data/final/MP/graphs/N0.98Pr1-MP-mp-343-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Mo1Ni1P2,1,0.0,2.0,False,Mo2Ni2P4,Mo2Ni2P4,0.0,Ferrite,True,Mo25Ni25P50,Mo-Ni-P,3,Supercon,Mo1Ni1P2,MP-mp-10208,Ni2Mo2P4,Mo-Ni-P,Mo25Ni25P50,P 63/m m c,hexagonal,3.3469220028038,3.34692159,11.192004,data/final/MP/cifs/Mo1Ni1P2-MP-mp-10208.cif,data/source/MP/raw/cifs/mp-10208.cif,mp-10208,0.0,,2011-05-29 06:56:58,6.624753081646241,10.17188/1186816,"@misc{osti_1186816,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NiMoP2 (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1186816"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699039'}},0.0,9.48756103,520.0,-59.50862426,-7.4385780325,"{'tags': ['Molybdenum(IV) nickel diphosphide', 'Molybdenum nickel phosphide (1/1/2)']}",-59.50862426,-7.4385780325,-0.5754818516666669,"['xas', 'elasticity', 'bandstructure']",True,"[644023, 76283]",True,2021-05-12 10:56:08.727000,NM,8,9,mp-10208,,NiMoP2,"{'functional': 'PBE', 'labels': ['Ni_pv', 'Mo_pv', 'P'], 'pot_type': 'paw'}","{'Ni': 1.0, 'Mo': 1.0, 'P': 2.0}",GGA,mp-10208,"['mp-926235', 'mp-926766', 'mp-910438', 'mp-10208', 'mp-1079547', 'mp-1416125', 'mp-1699039', 'mp-1804873', 'mp-1588815']",0.00077265,"{'Ni': 2.0, 'Mo': 2.0, 'P': 4.0}",108.5749403638015,[],NM,False,194,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",1.4232565956952602e-05,0.00077265,0,0.0015453,MP,data/source/MP/cleaned/cifs/MP-mp-10208.cif,False,,data/final/MP/graphs/Mo1Ni1P2-MP-mp-10208.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
B5Mo1.7V0.3,3,0.0857142857142857,1.0,True,B5Mo1.7V0.3,B5Mo2,5.5,Other,True,B71.429Mo24.286V4.286,B-Mo-V,3,Supercon,B5Mo1.7V0.3,MP-mp-7229,B5Mo2,B-Mo,B71.429Mo28.571,R -3 m,trigonal,3.086062143206312,3.086062143206312,7.38317517,data/final/MP/cifs/B5Mo1.7V0.3-MP-mp-7229-synth_doped.cif,data/source/MP/raw/cifs/mp-7229.cif,mp-7229,0.0,,2011-05-27 17:15:57,6.910597742884047,10.17188/1287525,"@misc{osti_1287525,
    author = ""Persson, Kristin"",
    title = ""Materials Data on B5Mo2 (SG:166) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1287525"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678538'}},0.4354736101190504,10.26159619,520.0,-54.63026953,-7.804324218571429,"{'tags': ['Molybdenum boride (2/5)', 'Molybdenum boride (1/2.5) - epsilon']}",-54.63026953,-7.804324218571429,0.0654250548809522,['bandstructure'],True,"[157530, 614795, 614810, 24282]",True,2021-05-12 10:58:55.498000,NM,7,11,mp-7229,,B5Mo2,"{'functional': 'PBE', 'labels': ['B', 'Mo_pv'], 'pot_type': 'paw'}","{'B': 5.0, 'Mo': 2.0}",GGA,mp-7229,"['mp-1001204', 'mp-7229', 'mp-1007569', 'mp-1077992', 'mp-1078025', 'mp-1078031', 'mp-1441558', 'mp-1678538', 'mp-1793658', 'mp-1012321', 'mp-1593525']",0.0189101,"{'B': 5.0, 'Mo': 2.0}",59.09541989544843,[],NM,False,166,0,"[0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0]",0.0003199926497426,0.0189101,0,0.0189101,MP,data/source/MP/cleaned/cifs/MP-mp-7229.cif,True,,data/final/MP/graphs/B5Mo1.7V0.3-MP-mp-7229-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ir0.7Nb3Rh0.3,3,0.15,2.0,False,Ir1.4Nb6Rh0.6,Ir2Nb6,0.0,Other,True,Ir17.5Nb75Rh7.5,Ir-Nb-Rh,3,Supercon,Nb3Rh0.3Ir0.7,MP-mp-1458,Nb6Ir2,Ir-Nb,Ir25Nb75,P m -3 n,cubic,5.183769,5.183769,5.183769,data/final/MP/cifs/Ir0.7Nb3Rh0.3-MP-mp-1458-synth_doped.cif,data/source/MP/raw/cifs/mp-1458.cif,mp-1458,0.0,,2011-05-14 00:52:36,11.228046236687836,10.17188/1190735,"@misc{osti_1190735,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Ir (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1190735"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698594'}},0.0,6.13208274,520.0,-81.50600203,-10.18825025375,{'tags': ['Iridium niobium (1/3)']},-81.50600203,-10.18825025375,-0.4026638687500004,"['xas', 'elasticity', 'bandstructure']",True,"[640840, 640833, 104512, 640832]",True,2021-05-12 10:56:12.755000,NM,8,8,mp-1458,,Nb3Ir,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Ir'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Ir': 1.0}",GGA,mp-1458,"['mp-929024', 'mp-912590', 'mp-929391', 'mp-1458', 'mp-1426323', 'mp-1698594', 'mp-1784808', 'mp-1591057']",0.00018035,"{'Nb': 6.0, 'Ir': 2.0}",139.29544675164993,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",2.5894600894104784e-06,0.00018035,0,0.0003607,MP,data/source/MP/cleaned/cifs/MP-mp-1458.cif,True,,data/final/MP/graphs/Ir0.7Nb3Rh0.3-MP-mp-1458-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Cu1Hg1O4.18,2,0.02200488997555,0.9569844497607656,True,Ba1.914Cu0.957Hg0.957O4,Ba2Cu1Hg1O4,95.16,Cuprate,True,Ba24.45Cu12.225Hg12.225O51.1002444987775,Ba-Cu-Hg-O,4,Supercon,Hg1Ba2Cu1O4.18,MP-mp-6562,Ba2Cu1Hg1O4,Ba-Cu-Hg-O,Ba25Cu12.5Hg12.5O50,P 4/m m m,tetragonal,3.933714,3.933714,9.827602,data/final/MP/cifs/Ba2Cu1Hg1O4.18-MP-mp-6562-synth_doped.cif,data/source/MP/raw/cifs/mp-6562.cif,mp-6562,0.0,,2011-05-13 18:18:06,6.582036471328142,10.17188/1281336,"@misc{osti_1281336,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2CuHgO4 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281336"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697135'}},0.0234340381250053,2.58068675,520.0,-40.91481298,-5.1143516225,"{'tags': ['Mercury dibarium copper oxide', 'High pressure experimental phase']}",-40.91481298,-5.1143516225,-1.953767533125,"['xas', 'bandstructure']",True,"[75722, 75720, 75724, 75721, 75723]",True,2021-05-12 10:57:32.679000,NM,8,8,mp-6562,oxide,Ba2CuHgO4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Cu_pv', 'Hg', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",GGA,mp-6562,"['mp-6562', 'mp-990899', 'mp-992892', 'mp-1435690', 'mp-1697135', 'mp-1878488', 'mp-994198', 'mp-1592659']",0.0003984,"{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",152.07335344042525,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0, 0, 0]",2.619788352047311e-06,0.0003984,0,0.0003984,MP,data/source/MP/cleaned/cifs/MP-mp-6562.cif,True,,data/final/MP/graphs/Ba2Cu1Hg1O4.18-MP-mp-6562-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B2C1Er0.9Ni2Tb0.1,2,0.0333333333333333,1.0,True,B2C1Er0.9Ni2Tb0.1,B2C1Er1Ni2,8.52,Other,True,B33.333C16.667Er15Ni33.333Tb1.667,B-C-Er-Ni-Tb,5,Supercon,Er0.9Tb0.1Ni2B2C1,MP-mp-6098,Er1Ni2B2C1,B-C-Er-Ni,B33.333C16.667Er16.667Ni33.333,I 4/m m m,tetragonal,3.5122880026935177,3.5122880026935173,5.77805085,data/final/MP/cifs/B2C1Er0.9Ni2Tb0.1-MP-mp-6098-synth_doped.cif,data/source/MP/raw/cifs/mp-6098.cif,mp-6098,0.0,,2011-05-13 04:24:02,8.212015229638553,10.17188/1277667,"@misc{osti_1277667,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ErNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277667"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700042'}},0.0,6.72687579,520.0,-41.84324782,-6.973874636666667,{'tags': []},-41.84324782,-6.973874636666667,-0.5216152347222227,"['xas', 'elasticity', 'bandstructure']",True,"[246431, 79576, 56651]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-6098,,ErNi2B2C,"{'functional': 'PBE', 'labels': ['Er_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Er': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6098,"['mp-1006980', 'mp-1000513', 'mp-6098', 'mp-1441533', 'mp-1700042', 'mp-1793903', 'mp-1011723', 'mp-1589040']",0.0020747,"{'Er': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",64.35860973581151,[],NM,False,139,0,"[0.0, -0.0, -0.0, 0.0, 0.0, 0.0]",3.2236557136900987e-05,0.0020747,0,0.0020747,MP,data/source/MP/cleaned/cifs/MP-mp-6098.cif,True,,data/final/MP/graphs/B2C1Er0.9Ni2Tb0.1-MP-mp-6098-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
La1Pd2Sb2,1,0.0,2.0,False,La2Pd4Sb4,La2Pd4Sb4,1.3,Other,True,La20Pd40Sb40,La-Pd-Sb,3,Supercon,La1Pd2Sb2,MP-mp-1079540,La2Sb4Pd4,La-Pd-Sb,La20Pd40Sb40,P 4/n m m,tetragonal,4.701017,4.701017,10.560176,data/final/MP/cifs/La1Pd2Sb2-MP-mp-1079540.cif,data/source/MP/raw/cifs/mp-1079540.cif,mp-1079540,0.0,,2018-04-15 10:59:41,8.471005899268546,,,{'GGA': {'task_id': 'mp-1702774'}},0.0,7.96618839,520.0,-56.05990079,-5.605990079,{'tags': ['Lanthanum palladium antimonide (1/2/2)']},-56.05990079,-5.605990079,-0.9720354380000004,['bandstructure'],True,"[189724, 604351]",True,2021-05-12 10:58:16.596000,NM,10,6,mp-1079540,,La(SbPd)2,"{'functional': 'PBE', 'labels': ['La', 'Sb', 'Pd'], 'pot_type': 'paw'}","{'La': 1.0, 'Sb': 2.0, 'Pd': 2.0}",GGA,mp-1079540,"['mp-1079540', 'mp-1080563', 'mp-1427922', 'mp-1702774', 'mp-1775969', 'mp-1599461']",0.0006996,"{'La': 2.0, 'Sb': 4.0, 'Pd': 4.0}",233.37525193279868,[],NM,False,129,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.995494331176577e-06,0.0006996,0,0.0013992,MP,data/source/MP/cleaned/cifs/MP-mp-1079540.cif,False,,data/final/MP/graphs/La1Pd2Sb2-MP-mp-1079540.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
As1,1,0.0,2.0,False,As2,As2,1.825,Other,True,As100,As,1,Supercon,As1,MP-mp-11,As2,As,As100,R -3 m,trigonal,3.827885672298773,3.827885672298773,4.17230859,data/final/MP/cifs/As1-MP-mp-11.cif,data/source/MP/raw/cifs/mp-11.cif,mp-11,0.0,,2011-05-12 17:08:53,5.540734383642445,10.17188/1187509,"@misc{osti_1187509,
    author = ""Persson, Kristin"",
    title = ""Materials Data on As (SG:166) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187509"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686630'}},0.0,4.99751282,520.0,-9.31823681,-4.659118405,"{'tags': ['High pressure experimental phase', 'Arsenic - A7', 'Arsenic - alpha', 'Arsenic']}",-9.31823681,-4.659118405,0.0,"['surfaces', 'eos', 'bandstructure', 'xas', 'elasticity']",True,"[162837, 162835, 609831, 16518, 53794, 426924, 16516, 158473, 16517]",True,2021-05-12 10:56:10.715000,NM,2,17,mp-11,,As,"{'functional': 'PBE', 'labels': ['As'], 'pot_type': 'paw'}",{'As': 1.0},GGA,mp-11,"['mp-918187', 'mp-919198', 'mp-904416', 'mp-632377', 'mp-12', 'mp-11', 'mp-568499', 'mp-1059178', 'mp-1059230', 'mp-1059138', 'mp-1141967', 'mp-1440656', 'mp-1686630', 'mp-1782703', 'mp-1591797', 'mp-1590389', 'mp-1059192']",0.0007335,{'As': 2.0},44.90749244340856,[],NM,False,166,0,"[0, 0]",3.266715463680546e-05,0.0007335,0,0.001467,MP,data/source/MP/cleaned/cifs/MP-mp-11.cif,False,,data/final/MP/graphs/As1-MP-mp-11.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ca0.1Ti1Y0.9O3,2,0.0399999999999999,4.0,False,Ca0.4Ti4Y3.6O12,Ti4Y4O12,0.0,Oxide,True,Ca2Ti20Y18O60,Ca-Ti-Y-O,4,Supercon,Y0.9Ca0.1Ti1O3,MP-mp-4355,Y4Ti4O12,Ti-Y-O,Ti20Y20O60,P n m a,orthorhombic,5.347706,5.717622,7.702009,data/final/MP/cifs/Ca0.1Ti1Y0.9O3-MP-mp-4355-synth_doped.cif,data/source/MP/raw/cifs/mp-4355.cif,mp-4355,0.0,,2011-05-16 11:12:56,5.211419462472947,10.17188/1208093,"@misc{osti_1208093,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YTiO3 (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208093"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1670821'}},0.0579532927500032,6.73720069,520.0,-180.80548351,-9.0402741755,"{'tags': ['Yttrium (titanate)', 'Yttrium titanate', 'Yttrium titanate(III)', 'Yttrium titanium(III) oxide']}",-180.80548351,-9.0402741755,-3.6113049465,"['xas', 'elasticity', 'bandstructure']",True,"[8150, 84610, 20903, 84609, 174118, 84608]",True,2021-05-12 10:56:20.740000,FM,20,9,mp-4355,oxide,YTiO3,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ti_pv', 'O'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ti': 1.0, 'O': 3.0}",GGA,mp-4355,"['mp-920697', 'mp-907171', 'mp-921718', 'mvc-14477', 'mp-4355', 'mp-1427899', 'mp-1670821', 'mp-1774915', 'mp-1604350']",1.001980175,"{'Y': 4.0, 'Ti': 4.0, 'O': 12.0}",235.49787086691995,[],FM,True,2,1,"[0.0, 0.0, 0.0, 0.0, 0.8, 0.8, 0.9, 0.8, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0170189254163783,1.001980175,4,4.0079207,MP,data/source/MP/cleaned/cifs/MP-mp-4355.cif,True,,data/final/MP/graphs/Ca0.1Ti1Y0.9O3-MP-mp-4355-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Cs0.19W1O3,3,0.0631540297411419,3.0,False,Cs0.57W3O9,Cs1W3O9,6.7,Oxide,True,Cs4.535W23.866O71.59904534606207,Cs-W-O,3,Supercon,Cs0.19W1O3,MP-mp-753119,Cs1W3O9,Cs-W-O,Cs7.692W23.077O69.23076923076923,P 6/m m m,hexagonal,3.887459,7.544746001131922,7.54474626,data/final/MP/cifs/Cs0.19W1O3-MP-mp-753119-synth_doped.cif,data/source/MP/raw/cifs/mp-753119.cif,mp-753119,0.0,,2014-02-13 20:26:51,7.178173970651413,,,{'GGA+U': {'task_id': 'mp-1729896'}},0.0,3.52433864,520.0,-94.0038219,-7.231063223076924,{'tags': []},-94.0038219,-7.231063223076924,-2.24610700561008,['bandstructure'],True,[],True,2021-05-12 10:58:57.544000,FM,13,8,mp-753119,oxide,Cs(WO3)3,"{'functional': 'PBE', 'labels': ['Cs_sv', 'W_pv', 'O'], 'pot_type': 'paw'}","{'Cs': 1.0, 'W': 3.0, 'O': 9.0}",GGA+U,mp-753119,"['mp-763713', 'mp-880554', 'mp-894582', 'mp-753119', 'mp-1400201', 'mp-1729896', 'mp-1882816', 'mp-895340']",0.8712151,"{'Cs': 1.0, 'W': 3.0, 'O': 9.0}",191.6398049642021,[],FM,True,65,1,"[0.0, 0.3, 0.4, 0.4, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0045461072148489,0.8712151,3,0.8712151,MP,data/source/MP/cleaned/cifs/MP-mp-753119.cif,True,,data/final/MP/graphs/Cs0.19W1O3-MP-mp-753119-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Cu3Eu0.8Y0.2O7,3,0.0307692307692307,1.0,True,Ba2Cu3Eu0.8Y0.2O7,Ba2Cu3Eu1O7,93.8,Cuprate,True,Ba15.385Cu23.077Eu6.154Y1.538O53.84615384615385,Ba-Cu-Eu-Y-O,5,Supercon,Y0.2Eu0.8Ba2Cu3O7,MP-mp-622211,Ba2Eu1Cu3O7,Ba-Cu-Eu-O,Ba15.385Cu23.077Eu7.692O53.84615384615385,P m m m,orthorhombic,3.854321,3.947999,11.78208,data/final/MP/cifs/Ba2Cu3Eu0.8Y0.2O7-MP-mp-622211-synth_doped.cif,data/source/MP/raw/cifs/mp-622211.cif,mp-622211,0.0,,2014-02-17 13:05:51,6.754290331341112,10.17188/1278111,"@misc{osti_1278111,
    author = ""Persson, Kristin"",
    title = ""Materials Data on EuBa2Cu3O7 (SG:47) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278111"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701920'}},0.0286564909615325,3.06088418,520.0,-82.7196169,-6.363047453846154,{'tags': ['Europium dibarium tricopper heptaoxide']},-82.7196169,-6.363047453846154,-2.0357911323076925,['bandstructure'],True,[81171],True,2021-05-12 10:58:51.532000,FM,13,5,mp-622211,oxide,Ba2EuCu3O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Eu', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Eu': 1.0, 'Cu': 3.0, 'O': 7.0}",GGA,mp-622211,"['mp-622211', 'mp-1430326', 'mp-1701920', 'mp-1786348', 'mp-1586127']",6.0235113,"{'Ba': 2.0, 'Eu': 1.0, 'Cu': 3.0, 'O': 7.0}",179.28620830368226,[],FM,True,47,1,"[0.0, 0.0, 6.4, -0.0, 0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0335971816069484,6.0235113,1,6.0235113,MP,data/source/MP/cleaned/cifs/MP-mp-622211.cif,True,,data/final/MP/graphs/Ba2Cu3Eu0.8Y0.2O7-MP-mp-622211-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Cu0.81Ge0.19,3,0.12,8.0,False,Cu6.48Ge1.52,Cu6Ge2,0.24,Other,True,Cu81Ge19,Cu-Ge,2,Supercon,Cu0.81Ge0.19,MP-mp-1184021,Cu6Ge2,Cu-Ge,Cu75Ge25,P 63/m m c,hexagonal,4.213635,5.291476003465905,5.29147545,data/final/MP/cifs/Cu0.81Ge0.19-MP-mp-1184021-synth_doped.cif,data/source/MP/raw/cifs/mp-1184021.cif,mp-1184021,0.0,,2019-01-11 12:28:15.987000,8.557610547331103,,,{'GGA': {'task_id': 'mp-1754560'}},0.003112765,7.74811247,520.0,-33.8620493,-4.2327561625,{'tags': []},-33.8620493,-4.2327561625,-0.0025941962500004,['bandstructure'],True,[],True,2021-05-12 10:58:27.755000,NM,8,5,mp-1184021,,Cu3Ge,"{'functional': 'PBE', 'labels': ['Cu_pv', 'Ge_d'], 'pot_type': 'paw'}","{'Cu': 3.0, 'Ge': 1.0}",GGA,mp-1184021,"['mp-1184021', 'mp-1388052', 'mp-1754560', 'mp-1921698', 'mp-1621911']",0.00074355,"{'Cu': 6.0, 'Ge': 2.0}",102.17417629799968,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.4554558244372302e-05,0.00074355,0,0.0014871,MP,data/source/MP/cleaned/cifs/MP-mp-1184021.cif,True,,data/final/MP/graphs/Cu0.81Ge0.19-MP-mp-1184021-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Os4Zr11,1,0.0,2.0,False,Os8Zr22,Os8Zr22,0.0,Other,True,Os26.667Zr73.333,Os-Zr,2,Supercon,Os4Zr11,MP-mp-1193087,Zr22Os8,Os-Zr,Os26.667Zr73.333,F m -3 m,cubic,9.56806692,9.56806692,9.56806692,data/final/MP/cifs/Os4Zr11-MP-mp-1193087.cif,data/source/MP/raw/cifs/mp-1193087.cif,mp-1193087,0.0,,2019-01-11 22:58:21.165000,9.460510883873647,,,{'GGA': {'task_id': 'mp-1719814'}},0.0,4.97446675,520.0,-286.65447237,-9.555149079,"{'tags': ['Osmium zirconium (4/11)', 'Zirconium osmium (11/4)', 'Zr11Os4', 'Sc11Ir4']}",-286.65447237,-9.555149079,-0.2928709489999998,['bandstructure'],True,"[647875, 647874]",True,2021-05-12 10:58:35.561000,NM,30,6,mp-1193087,,Zr11Os4,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Os_pv'], 'pot_type': 'paw'}","{'Zr': 11.0, 'Os': 4.0}",GGA,mp-1193087,"['mp-1193087', 'mp-1193920', 'mp-1399453', 'mp-1719814', 'mp-1889475', 'mp-1637386']",0.00425705,"{'Zr': 22.0, 'Os': 8.0}",619.3806225577414,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, 0.0, 0.0, -0.0, 0.0]",1.3746151703682462e-05,0.00425705,0,0.0085141,MP,data/source/MP/cleaned/cifs/MP-mp-1193087.cif,False,,data/final/MP/graphs/Os4Zr11-MP-mp-1193087.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
B2C1Nd1Ni2,1,0.0,1.0,True,B2C1Nd1Ni2,B2C1Nd1Ni2,0.0,Other,True,B33.333C16.667Nd16.667Ni33.333,B-C-Nd-Ni,4,Supercon,Nd1Ni2B2C1,MP-mp-6102,Nd1Ni2B2C1,B-C-Nd-Ni,B33.333C16.667Nd16.667Ni33.333,I 4/m m m,tetragonal,3.695151996993788,3.695151996993788,5.64304678,data/final/MP/cifs/B2C1Nd1Ni2-MP-mp-6102.cif,data/source/MP/raw/cifs/mp-6102.cif,mp-6102,0.0,,2011-05-13 05:36:41,7.1791748794062,10.17188/1277671,"@misc{osti_1277671,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NdNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277671"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696623'}},0.0,6.65788471,520.0,-41.63099751,-6.938499585,{'tags': []},-41.63099751,-6.938499585,-0.4528361163888886,"['xas', 'elasticity', 'bandstructure']",True,"[56647, 79569]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-6102,,NdNi2B2C,"{'functional': 'PBE', 'labels': ['Nd_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Nd': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6102,"['mp-1007406', 'mp-1000968', 'mp-6102', 'mp-1438383', 'mp-1696623', 'mp-1784040', 'mp-1012168', 'mp-1595626']",0.0063847,"{'Nd': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",68.29381702615225,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",9.34886974842109e-05,0.0063847,0,0.0063847,MP,data/source/MP/cleaned/cifs/MP-mp-6102.cif,False,,data/final/MP/graphs/B2C1Nd1Ni2-MP-mp-6102.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ca1.92Cl2Cu1Na0.08O2,2,0.0228571428571428,1.0,True,Ca1.92Cl2Cu1Na0.08O2,Ca2Cl2Cu1O2,0.0,Cuprate,True,Ca27.429Cl28.571Cu14.286Na1.143O28.571428571428573,Ca-Cl-Cu-Na-O,5,Supercon,Ca1.92Na0.08Cu1Cl2O2,MP-mp-23143,Ca2Cu1Cl2O2,Ca-Cl-Cu-O,Ca28.571Cl28.571Cu14.286O28.571428571428573,I 4/m m m,tetragonal,3.88024600076171,3.880246000761709,8.12907187,data/final/MP/cifs/Ca1.92Cl2Cu1Na0.08O2-MP-mp-23143-synth_doped.cif,data/source/MP/raw/cifs/mp-23143.cif,mp-23143,0.0,,2014-02-21 09:50:06,3.554337150605878,10.17188/1199263,"@misc{osti_1199263,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ca2Cu(ClO)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199263"",
    place = ""United States"",
    year = ""2016"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700223'}},0.0191527683333321,4.19679796,520.0,-35.95348475,-5.136212107142858,"{'tags': ['Dicalcium copper dioxide dichloride', 'Dicalcium dichlorodioxocuprate']}",-35.95348475,-5.136212107142858,-2.407440427142858,"['xas', 'elasticity', 'bandstructure']",True,"[1027, 83117, 41581]",True,2021-05-12 10:56:16.728000,NM,7,8,mp-23143,oxide,Ca2Cu(ClO)2,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Cu_pv', 'Cl', 'O'], 'pot_type': 'paw'}","{'Ca': 2.0, 'Cu': 1.0, 'Cl': 2.0, 'O': 2.0}",GGA,mp-23143,"['mp-992231', 'mp-990553', 'mp-23143', 'mp-1436301', 'mp-1700223', 'mp-1803462', 'mp-993865', 'mp-1592909']",0.0134962,"{'Ca': 2.0, 'Cu': 1.0, 'Cl': 2.0, 'O': 2.0}",115.21141865211318,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001171429026557,0.0134962,0,0.0134962,MP,data/source/MP/cleaned/cifs/MP-mp-23143.cif,True,,data/final/MP/graphs/Ca1.92Cl2Cu1Na0.08O2-MP-mp-23143-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Bi1F0.5La0.95S2Y0.05O0.5,2,0.02,2.0,False,Bi2F1La1.9S4Y0.1O1,Bi2F1La2S4O1,2.5,Oxide,True,Bi20F10La19S40Y1O10,Bi-F-La-S-Y-O,6,Supercon,La0.95Y0.05F0.5Bi1S2O0.5,MP-mp-1223274,La2Bi2S4O1F1,Bi-F-La-S-O,Bi20F10La20S40O10,P -4 m 2,tetragonal,4.109577,4.109577,13.150136,data/final/MP/cifs/Bi1F0.5La0.95S2Y0.05O0.5-MP-mp-1223274-synth_doped.cif,data/source/MP/raw/cifs/mp-1223274.cif,mp-1223274,0.0,,2019-01-12 23:41:28.903000,6.422922901673022,,,{'GGA': {'task_id': 'mp-1744170'}},0.0471324534999961,7.2695309,520.0,-59.26664004,-5.926664004,{'tags': []},-59.26664004,-5.926664004,-2.137031777,[],False,[],True,2021-05-12 11:00:52.054000,NM,10,4,mp-1223274,oxide,La2Bi2S4OF,"{'functional': 'PBE', 'labels': ['La', 'Bi', 'S', 'O', 'F'], 'pot_type': 'paw'}","{'La': 2.0, 'Bi': 2.0, 'S': 4.0, 'O': 1.0, 'F': 1.0}",GGA,mp-1223274,"['mp-1223274', 'mp-1388342', 'mp-1744170', 'mp-1861685']",0.0001151,"{'La': 2.0, 'Bi': 2.0, 'S': 4.0, 'O': 1.0, 'F': 1.0}",222.0876908666605,[],NM,False,115,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.182637522630872e-07,0.0001151,0,0.0001151,MP,data/source/MP/cleaned/cifs/MP-mp-1223274.cif,True,,data/final/MP/graphs/Bi1F0.5La0.95S2Y0.05O0.5-MP-mp-1223274-synth_doped.json,0,True,-42m,0,0,0,0,6,0,0,1,0,0,0,1.0,False
Co1La0.85Sr1.15O4,2,0.0428571428571428,1.0,True,Co1La0.85Sr1.15O4,Co1La1Sr1O4,0.0,Oxide,True,Co14.286La12.143Sr16.429O57.142857142857146,Co-La-Sr-O,4,Supercon,La0.85Sr1.15Co1O4,MP-mp-1274783,Sr2La2Co2O8,Co-La-Sr-O,Co14.286La14.286Sr14.286O57.142857142857146,I 4 m m,tetragonal,3.852036030794024,3.8600340037132814,6.94756368,data/final/MP/cifs/Co1La0.85Sr1.15O4-MP-mp-1274783-synth_doped.cif,data/source/MP/raw/cifs/mp-1274783.cif,mp-1274783,1.3403,,2020-04-24 07:30:05.603000,6.106618071253213,,,,0.0,4.72378166,520.0,-97.02944627,-6.930674733571428,{'tags': []},-97.02944627,-6.930674733571428,-2.767865823095238,[],False,[],True,2021-05-12 11:01:17.921000,AFM,14,6,mp-1274783,oxide,SrLaCoO4,"{'functional': 'PBE', 'labels': ['Sr_sv', 'La', 'Co', 'O'], 'pot_type': 'paw'}","{'Sr': 1.0, 'La': 1.0, 'Co': 1.0, 'O': 4.0}",GGA+U,mp-1274783,"['mp-1274783', 'mp-1286058', 'mp-1277199', 'mp-1283017', 'mp-1286562', 'mp-1274449']",3e-07,"{'Sr': 2.0, 'La': 2.0, 'Co': 2.0, 'O': 8.0}",190.05144036510364,[],AFM,True,5,1,"[0.0, 0.0, 0.0, 0.0, -2.9, 2.9, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",3.157040003734532e-09,3e-07,2,6e-07,MP,data/source/MP/cleaned/cifs/MP-mp-1274783.cif,True,,data/final/MP/graphs/Co1La0.85Sr1.15O4-MP-mp-1274783-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,0,0,1,0,1.0,False
Cd0.2Mg0.08,3,0.0952380952380952,20.0,False,Cd4Mg1.6,Cd4Mg2,0.0,Other,True,Cd71.429Mg28.571,Cd-Mg,2,Supercon,Cd0.2Mg0.08,MP-mp-1094763,Mg2Cd4,Cd-Mg,Cd66.667Mg33.333,C m c m,orthorhombic,3.219060000516088,5.094181,8.19989128,data/final/MP/cifs/Cd0.2Mg0.08-MP-mp-1094763-synth_doped.cif,data/source/MP/raw/cifs/mp-1094763.cif,mp-1094763,0.0,,2018-05-03 13:39:13,6.275092666234693,,,,0.0,3.40886871,520.0,-7.43452126,-1.2390868766666667,{'tags': []},-7.43452126,-1.2390868766666667,-0.0904003533333333,[],False,[],True,2021-05-12 10:59:22.504000,NM,6,3,mp-1094763,,MgCd2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Cd'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Cd': 2.0}",GGA,mp-1094763,"['mp-1094763', 'mp-1409315', 'mp-1779497']",0.0001546,"{'Mg': 2.0, 'Cd': 4.0}",131.84988271833308,[],NM,False,63,0,"[0, 0, 0, 0, 0, 0]",2.34509120239822e-06,0.0001546,0,0.0003092,MP,data/source/MP/cleaned/cifs/MP-mp-1094763.cif,True,,data/final/MP/graphs/Cd0.2Mg0.08-MP-mp-1094763-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Al3U1,1,0.0,1.0,True,Al3U1,Al3U1,0.0,Heavy_fermion,True,Al75U25,Al-U,2,Supercon,Al3U1,MP-mp-1723,U1Al3,Al-U,Al75U25,P m -3 m,cubic,4.259557,4.259557,4.259557,data/final/MP/cifs/Al3U1-MP-mp-1723.cif,data/source/MP/raw/cifs/mp-1723.cif,mp-1723,0.0,,2011-05-12 19:18:51,6.853468701550174,10.17188/1192401,"@misc{osti_1192401,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UAl3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1192401"",
    place = ""United States"",
    year = ""2016"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686623'}},0.0228804468749999,8.50587906,520.0,-23.03375706,-5.758439265,"{'tags': ['Uranium aluminium (1/3)', 'Aluminum uranium (3/1)', 'Aluminium uranium (3/1)']}",-23.03375706,-5.758439265,-0.1264048899999998,"['xas', 'elasticity', 'bandstructure']",True,"[609573, 58196, 150479, 609585, 609574, 240130, 609581, 609582, 240128, 609601, 609597, 658006]",True,2021-05-12 10:56:14.760000,FM,4,10,mp-1723,,UAl3,"{'functional': 'PBE', 'labels': ['U', 'Al'], 'pot_type': 'paw'}","{'U': 1.0, 'Al': 3.0}",GGA,mp-1723,"['mp-993075', 'mp-991102', 'mp-1723', 'mp-1258698', 'mp-1440939', 'mp-1686623', 'mp-1801268', 'mp-994397', 'mp-1588409', 'mp-1591216']",2.445328,"{'U': 1.0, 'Al': 3.0}",77.28466034757528,[],FM,True,221,1,"[2.0, 0.0, 0.0, 0.0]",0.0316405349910646,2.445328,1,2.445328,MP,data/source/MP/cleaned/cifs/MP-mp-1723.cif,False,,data/final/MP/graphs/Al3U1-MP-mp-1723.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Cu2Gd1Ir0.1Ru0.9Sr2O8,2,0.0142857142857142,2.0,False,Cu4Gd2Ir0.2Ru1.8Sr4O16,Cu4Gd2Ru2Sr4O16,22.0,Cuprate,True,Cu14.286Gd7.143Ir0.714Ru6.429Sr14.286O57.142857142857146,Cu-Gd-Ir-Ru-Sr-O,6,Supercon,Ru0.9Ir0.1Sr2Gd1Cu2O8,MP-mp-1194240,Sr4Gd2Cu4Ru2O16,Cu-Gd-Ru-Sr-O,Cu14.286Gd7.143Ru7.143Sr14.286O57.142857142857146,P 4/m b m,tetragonal,5.472451,5.472451,11.740702,data/final/MP/cifs/Cu2Gd1Ir0.1Ru0.9Sr2O8-MP-mp-1194240-synth_doped.cif,data/source/MP/raw/cifs/mp-1194240.cif,mp-1194240,0.0,,2019-01-11 23:51:58.932000,6.504561898971391,,,{'GGA': {'task_id': 'mp-1765260'}},0.0213449239285443,3.93502801,520.0,-201.55352223,-7.198340079642857,"{'tags': ['Sr2Cu2GdRuO8 orth', 'Sr2Cu2GdRuO8', 'Ruthenium distrontium gadolinium dicopper octaoxide']}",-201.55352223,-7.198340079642857,-2.268654352380952,['bandstructure'],True,[245741],True,2021-05-12 10:58:35.561000,FiM,28,6,mp-1194240,oxide,Sr2GdCu2RuO8,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Gd', 'Cu_pv', 'Ru_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Gd': 1.0, 'Cu': 2.0, 'Ru': 1.0, 'O': 8.0}",GGA,mp-1194240,"['mp-1194240', 'mp-1396976', 'mp-1659973', 'mp-1765260', 'mp-1841948', 'mp-1638264']",4.23696715,"{'Sr': 4.0, 'Gd': 2.0, 'Cu': 4.0, 'Ru': 2.0, 'O': 16.0}",351.6072554818909,[],FiM,True,127,2,"[-0.0, -0.0, -0.0, -0.0, 6.9, 6.9, 0.0, 0.0, 0.0, 0.0, -1.8, -1.8, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0241005672319991,4.23696715,4,8.4739343,MP,data/source/MP/cleaned/cifs/MP-mp-1194240.cif,True,,data/final/MP/graphs/Cu2Gd1Ir0.1Ru0.9Sr2O8-MP-mp-1194240-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ca2Cu1O3,1,0.0,1.0,True,Ca2Cu1O3,Ca2Cu1O3,0.0,Cuprate,True,Ca33.333Cu16.667O50,Ca-Cu-O,3,Supercon,Ca2Cu1O3,MP-mp-5869,Ca2Cu1O3,Ca-Cu-O,Ca33.333Cu16.667O50,I m m m,orthorhombic,3.289809999595383,3.832225999847117,6.59456324,data/final/MP/cifs/Ca2Cu1O3-MP-mp-5869.cif,data/source/MP/raw/cifs/mp-5869.cif,mp-5869,0.0,,2011-05-13 06:04:34,4.144747112705039,10.17188/1277155,"@misc{osti_1277155,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ca2CuO3 (SG:71) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277155"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677461'}},0.0021960694444436,4.41828767,520.0,-36.06207886,-6.010346476666666,"{'tags': ['Dicalcium copper oxide', 'Calcium cuprate']}",-36.06207886,-6.010346476666666,-2.5281315691666664,"['xas', 'elasticity', 'bandstructure']",True,"[68885, 16216, 80666, 202995]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-5869,oxide,Ca2CuO3,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ca': 2.0, 'Cu': 1.0, 'O': 3.0}",GGA,mp-5869,"['mp-1000635', 'mp-1007099', 'mp-5869', 'mp-1437675', 'mp-1677461', 'mp-1801352', 'mp-1011842', 'mp-1592921']",0.0005351,"{'Ca': 2.0, 'Cu': 1.0, 'O': 3.0}",76.80219384175658,[],NM,False,71,0,"[0, 0, 0, 0, 0, 0]",6.967248892688162e-06,0.0005351,0,0.0005351,MP,data/source/MP/cleaned/cifs/MP-mp-5869.cif,False,,data/final/MP/graphs/Ca2Cu1O3-MP-mp-5869.json,0,True,mmm,0,0,0,7,0,0,0,0,0,1,0,1.0,False
Pb1Pd2Y1,1,0.0,1.0,True,Pb1Pd2Y1,Pb1Pd2Y1,3.215,Other,True,Pb25Pd50Y25,Pb-Pd-Y,3,Supercon,Y1Pd2Pb1,MP-mp-22712,Y1Pd2Pb1,Pb-Pd-Y,Pb25Pd50Y25,F m -3 m,cubic,4.88702851,4.88702851,4.88702851,data/final/MP/cifs/Pb1Pd2Y1-MP-mp-22712.cif,data/source/MP/raw/cifs/mp-22712.cif,mp-22712,0.0,,2014-02-21 08:20:59,10.24002588757282,10.17188/1198916,"@misc{osti_1198916,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YPd2Pb (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198916"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702399'}},0.005850745,6.05473424,520.0,-23.34044176,-5.83511044,{'tags': ['Lead palladium yttrium (1/2/1)']},-23.34044176,-5.83511044,-0.7003899891666672,"['xas', 'elasticity', 'bandstructure']",True,"[105596, 105597]",True,2021-05-12 10:56:16.728000,NM,4,8,mp-22712,,YPd2Pb,"{'functional': 'PBE', 'labels': ['Y_sv', 'Pd', 'Pb_d'], 'pot_type': 'paw'}","{'Y': 1.0, 'Pd': 2.0, 'Pb': 1.0}",GGA,mp-22712,"['mp-993484', 'mp-991536', 'mp-22712', 'mp-1412906', 'mp-1702399', 'mp-1877683', 'mp-994796', 'mp-1592119']",6.29e-05,"{'Y': 1.0, 'Pd': 2.0, 'Pb': 1.0}",82.53147755559652,[],NM,False,225,0,"[0, 0, 0, 0]",7.621334533557578e-07,6.29e-05,0,6.29e-05,MP,data/source/MP/cleaned/cifs/MP-mp-22712.cif,False,,data/final/MP/graphs/Pb1Pd2Y1-MP-mp-22712.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
La3S4,3,0.1428571428571428,0.25,False,La0.75S1,La1S1,6.725714286,Other,True,La42.857S57.143,La-S,2,Supercon,La3S4,MP-mp-2350,La1S1,La-S,La50S50,F m -3 m,cubic,4.15456347,4.154563469999999,4.154563469999999,data/final/MP/cifs/La3S4-MP-mp-2350-synth_doped.cif,data/source/MP/raw/cifs/mp-2350.cif,mp-2350,0.0,,2011-05-12 18:07:45,5.5989811780073975,10.17188/1199554,"@misc{osti_1199554,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaS (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199554"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686899'}},0.0,8.82358756,520.0,-13.39867394,-6.69933697,"{'tags': ['Lanthanum(II) sulfide', 'Lanthanum sulfide (1/1)']}",-13.39867394,-6.69933697,-2.4146084840625006,"['xas', 'elasticity', 'bandstructure']",True,"[183942, 641799, 641817, 641824, 641816, 641811, 44710, 641810, 641813, 641832, 29394, 641804]",True,2021-05-12 10:56:16.728000,NM,2,17,mp-2350,,LaS,"{'functional': 'PBE', 'labels': ['La', 'S'], 'pot_type': 'paw'}","{'La': 1.0, 'S': 1.0}",GGA,mp-2350,"['mp-1006936', 'mp-1000459', 'mp-2350', 'mp-1057053', 'mp-1057068', 'mp-1057100', 'mp-1060780', 'mp-1060801', 'mp-1060828', 'mp-1440995', 'mp-1686899', 'mp-1790898', 'mp-1011656', 'mp-1592039', 'mp-1596319', 'mp-1060829', 'mp-1057101']",0.0009325,"{'La': 1.0, 'S': 1.0}",50.7062152280713,[],NM,False,225,0,"[0, 0]",1.839025050096348e-05,0.0009325,0,0.0009325,MP,data/source/MP/cleaned/cifs/MP-mp-2350.cif,True,,data/final/MP/graphs/La3S4-MP-mp-2350-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ba2Cu3La0.1Pr0.9O7,2,0.0153846153846153,1.0,True,Ba2Cu3La0.1Pr0.9O7,Ba2Cu3Pr1O7,0.0,Cuprate,True,Ba15.385Cu23.077La0.769Pr6.923O53.84615384615385,Ba-Cu-La-Pr-O,5,Supercon,La0.1Pr0.9Ba2Cu3O7,MP-mp-20936,Ba2Pr1Cu3O7,Ba-Cu-Pr-O,Ba15.385Cu23.077Pr7.692O53.84615384615385,P m m m,orthorhombic,3.903923,3.95568,11.916432,data/final/MP/cifs/Ba2Cu3La0.1Pr0.9O7-MP-mp-20936-synth_doped.cif,data/source/MP/raw/cifs/mp-20936.cif,mp-20936,0.0,,2014-02-22 14:41:55,6.480717836004672,10.17188/1196129,"@misc{osti_1196129,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2PrCu3O7 (SG:47) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196129"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698257'}},0.0256000172756332,3.18514576,520.0,-78.62827906,-6.048329158461538,"{'tags': ['Dibarium praseodymium tricopper heptaoxide', 'Praseodymium dibarium dicopper copper(III) oxide', 'Praseodymium dibarium tricopper heptaoxide', 'Praseodymium dibarium copper(III) dicopper oxide']}",-78.62827906,-6.048329158461538,-2.145007016153845,"['xas', 'bandstructure']",True,"[41452, 94377, 81168, 173910, 89221]",True,2021-05-12 10:56:57.051000,NM,13,8,mp-20936,oxide,Ba2PrCu3O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Pr_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Pr': 1.0, 'Cu': 3.0, 'O': 7.0}",GGA,mp-20936,"['mp-988090', 'mp-987725', 'mp-20936', 'mp-1417367', 'mp-1698257', 'mp-1833655', 'mp-988324', 'mp-1602318']",0.0007234,"{'Ba': 2.0, 'Pr': 1.0, 'Cu': 3.0, 'O': 7.0}",184.02152853403555,[],NM,False,47,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.931061793491212e-06,0.0007234,0,0.0007234,MP,data/source/MP/cleaned/cifs/MP-mp-20936.cif,True,,data/final/MP/graphs/Ba2Cu3La0.1Pr0.9O7-MP-mp-20936-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Bi3Mo1,1,0.0,4.0,False,Bi12Mo4,Bi12Mo4,3.7,Other,True,Bi75Mo25,Bi-Mo,2,Supercon,Bi3Mo1,MP-mp-1189810,Bi12Mo4,Bi-Mo,Bi75Mo25,P 1 21/m 1,monoclinic,4.915258,7.372469999999999,12.31316946,data/final/MP/cifs/Bi3Mo1-MP-mp-1189810.cif,data/source/MP/raw/cifs/mp-1189810.cif,mp-1189810,0.0,,2019-01-11 20:28:34.231000,10.900963043587163,,,{'GGA': {'task_id': 'mp-1677040'}},0.3387419712499993,6.67162147,520.0,-84.6431123,-5.29019451875,{'tags': ['Bismuth oxide molybdate (12/14/4)']},-84.6431123,-5.29019451875,0.3387419712499993,['bandstructure'],True,[260538],True,2021-05-12 10:58:33.577000,NM,16,5,mp-1189810,,Bi3Mo,"{'functional': 'PBE', 'labels': ['Bi', 'Mo_pv'], 'pot_type': 'paw'}","{'Bi': 3.0, 'Mo': 1.0}",GGA,mp-1189810,"['mp-1189810', 'mp-1381055', 'mp-1677040', 'mp-1814532', 'mp-1605793']",0.000979025,"{'Bi': 12.0, 'Mo': 4.0}",440.46474364183626,[],NM,False,11,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0, 0.0, 0.0]",8.890836455197366e-06,0.000979025,0,0.0039161,MP,data/source/MP/cleaned/cifs/MP-mp-1189810.cif,False,,data/final/MP/graphs/Bi3Mo1-MP-mp-1189810.json,0,True,2/m,0,0,3,0,0,0,0,1,0,0,0,1.0,False
Ba0.9K0.1Sb2Ti2O1,2,0.0333333333333333,1.0,True,Ba0.9K0.1Sb2Ti2O1,Ba1Sb2Ti2O1,5.13,Oxide,True,Ba15K1.667Sb33.333Ti33.333O16.666666666666668,Ba-K-Sb-Ti-O,5,Supercon,Ba0.9K0.1Ti2Sb2O1,MP-mp-1070806,Ba1Ti2Sb2O1,Ba-Sb-Ti-O,Ba16.667Sb33.333Ti33.333O16.666666666666668,P 4/m m m,tetragonal,4.113474,4.113474,8.312382,data/final/MP/cifs/Ba0.9K0.1Sb2Ti2O1-MP-mp-1070806-synth_doped.cif,data/source/MP/raw/cifs/mp-1070806.cif,mp-1070806,0.0,,2018-03-22 04:02:04,5.8154485533321445,,,{'GGA': {'task_id': 'mp-1702174'}},0.0,5.89751533,520.0,-39.14932631,-6.524887718333333,{'tags': []},-39.14932631,-6.524887718333333,-1.5507346602777776,['bandstructure'],True,"[430061, 237789, 430060]",True,2021-05-12 10:58:14.654000,NM,6,16,mp-1070806,oxide,BaTi2Sb2O,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ti_pv', 'Sb', 'O'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Ti': 2.0, 'Sb': 2.0, 'O': 1.0}",GGA,mp-1070806,"['mp-1071055', 'mp-1071068', 'mp-1071083', 'mp-1071088', 'mp-1070806', 'mp-1071124', 'mp-1070846', 'mp-1070900', 'mp-1071137', 'mp-1423542', 'mp-1702174', 'mp-1785425', 'mp-1588663', 'mp-1070899', 'mp-1071129', 'mp-1071119']",0.001055,"{'Ba': 1.0, 'Ti': 2.0, 'Sb': 2.0, 'O': 1.0}",140.65105900950408,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0]",7.500832254158225e-06,0.001055,0,0.001055,MP,data/source/MP/cleaned/cifs/MP-mp-1070806.cif,True,,data/final/MP/graphs/Ba0.9K0.1Sb2Ti2O1-MP-mp-1070806-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ba2Cu1Hg1O4.05,2,0.0062111801242235,0.9877885802469136,True,Ba1.975Cu0.988Hg0.988O4,Ba2Cu1Hg1O4,73.5,Cuprate,True,Ba24.845Cu12.422Hg12.422O50.31055900621117,Ba-Cu-Hg-O,4,Supercon,Hg1Ba2Cu1O4.05,MP-mp-6562,Ba2Cu1Hg1O4,Ba-Cu-Hg-O,Ba25Cu12.5Hg12.5O50,P 4/m m m,tetragonal,3.933714,3.933714,9.827602,data/final/MP/cifs/Ba2Cu1Hg1O4.05-MP-mp-6562-synth_doped.cif,data/source/MP/raw/cifs/mp-6562.cif,mp-6562,0.0,,2011-05-13 18:18:06,6.582036471328142,10.17188/1281336,"@misc{osti_1281336,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2CuHgO4 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281336"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697135'}},0.0234340381250053,2.58068675,520.0,-40.91481298,-5.1143516225,"{'tags': ['Mercury dibarium copper oxide', 'High pressure experimental phase']}",-40.91481298,-5.1143516225,-1.953767533125,"['xas', 'bandstructure']",True,"[75722, 75720, 75724, 75721, 75723]",True,2021-05-12 10:57:32.679000,NM,8,8,mp-6562,oxide,Ba2CuHgO4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Cu_pv', 'Hg', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",GGA,mp-6562,"['mp-6562', 'mp-990899', 'mp-992892', 'mp-1435690', 'mp-1697135', 'mp-1878488', 'mp-994198', 'mp-1592659']",0.0003984,"{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",152.07335344042525,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0, 0, 0]",2.619788352047311e-06,0.0003984,0,0.0003984,MP,data/source/MP/cleaned/cifs/MP-mp-6562.cif,True,,data/final/MP/graphs/Ba2Cu1Hg1O4.05-MP-mp-6562-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
C0.848Ta1,3,0.0822510822510822,1.0,True,C0.848Ta1,C1Ta1,2.04,Other,True,C45.887Ta54.113,C-Ta,2,Supercon,C0.848Ta1,MP-mp-1086,Ta1C1,C-Ta,C50Ta50,F m -3 m,cubic,3.16930633,3.1693063299999995,3.1693063299999995,data/final/MP/cifs/C0.848Ta1-MP-mp-1086-synth_doped.cif,data/source/MP/raw/cifs/mp-1086.cif,mp-1086,0.0,,2011-05-12 17:28:32,14.234280973849424,10.17188/1187404,"@misc{osti_1187404,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TaC (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187404"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686613'}},0.0,8.2505789,520.0,-22.23710222,-11.11855111,"{'tags': ['Tantalum carbide (1/1)', 'Tantalum(IV) carbide']}",-22.23710222,-11.11855111,-0.5762719450000002,"['xas', 'elasticity', 'bandstructure']",True,"[618845, 618833, 53974, 618820, 618830, 159875, 618843, 618846, 618823, 618841, 77406, 618844, 618825, 159878, 159877, 618828, 618831, 618848, 44497, 618838, 26956, 155163, 43525, 618839, 618835, 185979, 38239, 618829, 618837, 618832, 159879, 159876, 180601, 601144, 618847, 618818, 618836]",True,2021-05-12 10:56:10.715000,NM,2,14,mp-1086,,TaC,"{'functional': 'PBE', 'labels': ['Ta_pv', 'C'], 'pot_type': 'paw'}","{'Ta': 1.0, 'C': 1.0}",GGA,mp-1086,"['mp-992237', 'mp-990522', 'mp-1086', 'mp-1059363', 'mp-1059373', 'mp-1059393', 'mp-1237232', 'mp-1440573', 'mp-1686613', 'mp-1792077', 'mp-993854', 'mp-1596236', 'mp-1595188', 'mp-1059385']",0.0001919,"{'Ta': 1.0, 'C': 1.0}",22.51011209588414,[],NM,False,225,0,"[0, 0]",8.525057502271965e-06,0.0001919,0,0.0001919,MP,data/source/MP/cleaned/cifs/MP-mp-1086.cif,True,,data/final/MP/graphs/C0.848Ta1-MP-mp-1086-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
As2Ba0.64Fe2Na0.36,3,0.0560000000000001,2.0,False,As4Ba1.28Fe4Na0.72,As4Ba1Fe4Na1,31.0,Ferrite,True,As40Ba12.8Fe40Na7.2,As-Ba-Fe-Na,4,Supercon,Ba0.64Na0.36Fe2As2,MP-mp-1227868,Ba1Na1Fe4As4,As-Ba-Fe-Na,As40Ba10Fe40Na10,C m m m,orthorhombic,5.458732000131759,5.462821,6.96934908,data/final/MP/cifs/As2Ba0.64Fe2Na0.36-MP-mp-1227868-synth_doped.cif,data/source/MP/raw/cifs/mp-1227868.cif,mp-1227868,0.0,,2019-01-13 03:39:01.428000,5.934244973483095,,,{'GGA': {'task_id': 'mp-1731957'}},0.0195872770000011,4.30353274,520.0,-59.62394279,-5.962394279,{'tags': []},-59.62394279,-5.962394279,-0.3865939246551718,[],False,[],True,2021-05-12 11:00:59.151000,FM,10,4,mp-1227868,,BaNa(FeAs)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Na_pv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Na': 1.0, 'Fe': 4.0, 'As': 4.0}",GGA,mp-1227868,"['mp-1227868', 'mp-1396889', 'mp-1731957', 'mp-1827521']",0.9949323,"{'Ba': 1.0, 'Na': 1.0, 'Fe': 4.0, 'As': 4.0}",191.22642477974767,[],FM,True,65,1,"[0.0, 0.0, 0.3, 0.3, 0.3, 0.3, 0.0, 0.0, 0.0, 0.0]",0.0052029017493055,0.9949323,4,0.9949323,MP,data/source/MP/cleaned/cifs/MP-mp-1227868.cif,True,,data/final/MP/graphs/As2Ba0.64Fe2Na0.36-MP-mp-1227868-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
In1.5Pb1.5Y1,1,0.0,2.0,False,In3Pb3Y2,In3Pb3Y2,1.0,Other,True,In37.5Pb37.5Y25,In-Pb-Y,3,Supercon,Y1In1.5Pb1.5,MP-mp-1216252,Y2In3Pb3,In-Pb-Y,In37.5Pb37.5Y25,P m m m,orthorhombic,4.802002,4.813112,9.513121,data/final/MP/cifs/In1.5Pb1.5Y1-MP-mp-1216252.cif,data/source/MP/raw/cifs/mp-1216252.cif,mp-1216252,0.0,,2019-01-12 17:47:36.961000,8.63878787111893,,,{'GGA': {'task_id': 'mp-1751437'}},0.0291969237500024,6.8991088,520.0,-34.94739929,-4.36842491125,{'tags': []},-34.94739929,-4.36842491125,-0.3276830829166668,['bandstructure'],True,[],True,2021-05-12 10:58:39.488000,NM,8,5,mp-1216252,,Y2(InPb)3,"{'functional': 'PBE', 'labels': ['Y_sv', 'In_d', 'Pb_d'], 'pot_type': 'paw'}","{'Y': 2.0, 'In': 3.0, 'Pb': 3.0}",GGA,mp-1216252,"['mp-1216252', 'mp-1399831', 'mp-1751437', 'mp-1830052', 'mp-1622670']",0.0092117,"{'Y': 2.0, 'In': 3.0, 'Pb': 3.0}",219.8727078533684,[],NM,False,47,0,"[0, 0, 0, 0, 0, 0, 0, 0]",4.189560446102851e-05,0.0092117,0,0.0092117,MP,data/source/MP/cleaned/cifs/MP-mp-1216252.cif,False,,data/final/MP/graphs/In1.5Pb1.5Y1-MP-mp-1216252.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
La0.93Nd0.07Pt1Si1,2,0.0466666666666666,2.0,False,La1.86Nd0.14Pt2Si2,La2Pt2Si2,2.29,Other,True,La31Nd2.333Pt33.333Si33.333,La-Nd-Pt-Si,4,Supercon,La0.93Nd0.07Pt1Si1,MP-mp-1206485,La2Si2Pt2,La-Pt-Si,La33.333Pt33.333Si33.333,I 41 m d,tetragonal,4.277808001286174,4.277808001286175,7.94541446,data/final/MP/cifs/La0.93Nd0.07Pt1Si1-MP-mp-1206485-synth_doped.cif,data/source/MP/raw/cifs/mp-1206485.cif,mp-1206485,0.0,,2019-01-12 09:47:13.211000,8.943745313538361,,,{'GGA': {'task_id': 'mp-1734531'}},0.0,7.90579938,520.0,-39.77896993,-6.629828321666667,{'tags': ['LaPtSi']},-39.77896993,-6.629828321666667,-1.1287520433333331,['bandstructure'],True,[],True,2021-05-12 10:58:37.524000,NM,6,5,mp-1206485,,LaSiPt,"{'functional': 'PBE', 'labels': ['La', 'Si', 'Pt'], 'pot_type': 'paw'}","{'La': 1.0, 'Si': 1.0, 'Pt': 1.0}",GGA,mp-1206485,"['mp-1206485', 'mp-1387492', 'mp-1734531', 'mp-1788111', 'mp-1628393']",1.825e-05,"{'La': 2.0, 'Si': 2.0, 'Pt': 2.0}",134.4491846861766,[],NM,False,109,0,"[0, 0, 0, 0, 0, 0]",2.714780315343388e-07,1.825e-05,0,3.65e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1206485.cif,True,,data/final/MP/graphs/La0.93Nd0.07Pt1Si1-MP-mp-1206485-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,0,0,1,0,1.0,False
Mo3Os1,1,0.0,2.0,False,Mo6Os2,Mo6Os2,11.0225,Other,True,Mo75Os25,Mo-Os,2,Supercon,Mo3Os1,MP-mp-801,Mo6Os2,Mo-Os,Mo75Os25,P m -3 n,cubic,5.00328,5.00328,5.00328,data/final/MP/cifs/Mo3Os1-MP-mp-801.cif,data/source/MP/raw/cifs/mp-801.cif,mp-801,0.0,,2011-05-14 14:27:05,12.676168145087573,10.17188/1307897,"@misc{osti_1307897,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Mo3Os (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1307897"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700314'}},0.0111346537500001,8.33990966,520.0,-87.43951346,-10.9299391825,{'tags': ['Molybdenum osmium (3/1)']},-87.43951346,-10.9299391825,0.0111346537500001,"['bandstructure', 'elasticity']",True,"[644078, 644079, 105054]",True,2021-05-12 10:56:31.128000,NM,8,8,mp-801,,Mo3Os,"{'functional': 'PBE', 'labels': ['Mo_pv', 'Os_pv'], 'pot_type': 'paw'}","{'Mo': 3.0, 'Os': 1.0}",GGA,mp-801,"['mp-913744', 'mp-930504', 'mp-930040', 'mp-801', 'mp-1429890', 'mp-1700314', 'mp-1803125', 'mp-1591437']",0.0054499,"{'Mo': 6.0, 'Os': 2.0}",125.24616141128756,[],NM,False,131,0,"[-0.0, -0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0]",8.702701845054452e-05,0.0054499,0,0.0108998,MP,data/source/MP/cleaned/cifs/MP-mp-801.cif,False,,data/final/MP/graphs/Mo3Os1-MP-mp-801.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Pd0.26Ti0.74,2,0.02,8.0,False,Pd2.08Ti5.92,Pd2Ti6,1.66,Other,True,Pd26Ti74,Pd-Ti,2,Supercon,Pd0.26Ti0.74,MP-mp-1079796,Ti6Pd2,Pd-Ti,Pd25Ti75,P m -3 n,cubic,5.062402,5.062402,5.062402,data/final/MP/cifs/Pd0.26Ti0.74-MP-mp-1079796-synth_doped.cif,data/source/MP/raw/cifs/mp-1079796.cif,mp-1079796,0.0,,2018-04-16 08:50:50,6.400084291337905,,,{'GGA': {'task_id': 'mp-1753631'}},0.0,5.87293662,520.0,-60.50496802,-7.5631210025,{'tags': ['Titanium palladium (3/1)']},-60.50496802,-7.5631210025,-0.3465315374999997,['bandstructure'],True,[167644],True,2021-05-12 10:58:16.596000,NM,8,5,mp-1079796,,Ti3Pd,"{'functional': 'PBE', 'labels': ['Ti_pv', 'Pd'], 'pot_type': 'paw'}","{'Ti': 3.0, 'Pd': 1.0}",GGA,mp-1079796,"['mp-1079796', 'mp-1389837', 'mp-1753631', 'mp-1788391', 'mp-1624029']",0.06889515,"{'Ti': 6.0, 'Pd': 2.0}",129.73880313804727,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0010620592811649,0.06889515,0,0.1377903,MP,data/source/MP/cleaned/cifs/MP-mp-1079796.cif,True,,data/final/MP/graphs/Pd0.26Ti0.74-MP-mp-1079796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Nb3Rh0.98Ru0.02,2,0.01,2.0,False,Nb6Rh1.96Ru0.04,Nb6Rh2,2.42,Other,True,Nb75Rh24.5Ru0.5,Nb-Rh-Ru,3,Supercon,Nb3Rh0.98Ru0.02,MP-mp-1545,Nb6Rh2,Nb-Rh,Nb75Rh25,P m -3 n,cubic,5.186072,5.186072,5.186072,data/final/MP/cifs/Nb3Rh0.98Ru0.02-MP-mp-1545-synth_doped.cif,data/source/MP/raw/cifs/mp-1545.cif,mp-1545,0.0,,2011-05-14 11:20:25,9.086567873234834,10.17188/1191190,"@misc{osti_1191190,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Rh (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191190"",
    place = ""United States"",
    year = ""2015"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700041'}},0.0,5.48706495,520.0,-77.37430008,-9.67178751,{'tags': ['Niobium rhodium (3/1)']},-77.37430008,-9.67178751,-0.2547317625000005,"['xas', 'elasticity', 'bandstructure']",True,"[105216, 645269]",True,2021-05-12 10:56:12.755000,NM,8,8,mp-1545,,Nb3Rh,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Rh_pv'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Rh': 1.0}",GGA,mp-1545,"['mp-942004', 'mp-943019', 'mp-935201', 'mp-1545', 'mp-1433570', 'mp-1700041', 'mp-1786474', 'mp-1591392']",0.00021655,"{'Nb': 6.0, 'Rh': 2.0}",139.48118416938905,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",3.1050783127424102e-06,0.00021655,0,0.0004331,MP,data/source/MP/cleaned/cifs/MP-mp-1545.cif,True,,data/final/MP/graphs/Nb3Rh0.98Ru0.02-MP-mp-1545-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Cu1La1.7Sm0.3O4,3,0.0857142857142857,1.0,True,Cu1La1.7Sm0.3O4,Cu1La2O4,25.0,Cuprate,True,Cu14.286La24.286Sm4.286O57.142857142857146,Cu-La-Sm-O,4,Supercon,La1.7Sm0.3Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La1.7Sm0.3O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La1.7Sm0.3O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B2Ir0.06Mg0.94,2,0.04,1.0,True,B2Ir0.06Mg0.94,B2Mg1,28.1,Other,True,B66.667Ir2Mg31.333,B-Ir-Mg,3,Supercon,Mg0.94Ir0.06B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B2Ir0.06Mg0.94-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B2Ir0.06Mg0.94-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
B4Ru1Y1,1,0.0,4.0,False,B16Ru4Y4,B16Ru4Y4,1.38,Other,True,B66.667Ru16.667Y16.667,B-Ru-Y,3,Supercon,Y1Ru1B4,MP-mp-1190832,Y4B16Ru4,B-Ru-Y,B66.667Ru16.667Y16.667,P b a m,orthorhombic,3.563103,5.968499,11.544975,data/final/MP/cifs/B4Ru1Y1-MP-mp-1190832.cif,data/source/MP/raw/cifs/mp-1190832.cif,mp-1190832,0.0,,2019-01-11 21:14:51.688000,6.309400580091938,,,{'GGA': {'task_id': 'mp-1680437'}},0.0,7.07633512,520.0,-184.8076091,-7.700317045833334,"{'tags': ['Yttrium ruthenium boride (1/1/4)', 'YRuB4', 'YCrB4']}",-184.8076091,-7.700317045833334,-0.6239124038888887,[],False,[615400],True,2021-05-12 10:59:54.607000,NM,24,4,mp-1190832,,YB4Ru,"{'functional': 'PBE', 'labels': ['Y_sv', 'B', 'Ru_pv'], 'pot_type': 'paw'}","{'Y': 1.0, 'B': 4.0, 'Ru': 1.0}",GGA,mp-1190832,"['mp-1190832', 'mp-1342920', 'mp-1680437', 'mp-1878439']",0.001950875,"{'Y': 4.0, 'B': 16.0, 'Ru': 4.0}",245.51978725430607,[],NM,False,55,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.1783588961476415e-05,0.001950875,0,0.0078035,MP,data/source/MP/cleaned/cifs/MP-mp-1190832.cif,False,,data/final/MP/graphs/B4Ru1Y1-MP-mp-1190832.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
La1Pb1.5Tl1.5,1,0.0,2.0,False,La2Pb3Tl3,La2Pb3Tl3,1.75,Other,True,La25Pb37.5Tl37.5,La-Pb-Tl,3,Supercon,La1Tl1.5Pb1.5,MP-mp-1223251,La2Tl3Pb3,La-Pb-Tl,La25Pb37.5Tl37.5,P m m m,orthorhombic,4.961547,4.964855,9.764526,data/final/MP/cifs/La1Pb1.5Tl1.5-MP-mp-1223251.cif,data/source/MP/raw/cifs/mp-1223251.cif,mp-1223251,0.0,,2019-01-12 23:40:18.720000,10.44208212786813,,,{'GGA': {'task_id': 'mp-1742479'}},0.0035900799999999,7.53756798,520.0,-31.31707156,-3.914633945,{'tags': []},-31.31707156,-3.914633945,-0.4023983374999997,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,8,5,mp-1223251,,La2(TlPb)3,"{'functional': 'PBE', 'labels': ['La', 'Tl_d', 'Pb_d'], 'pot_type': 'paw'}","{'La': 2.0, 'Tl': 3.0, 'Pb': 3.0}",GGA,mp-1223251,"['mp-1223251', 'mp-1393287', 'mp-1742479', 'mp-1774517', 'mp-1622544']",0.0282386,"{'La': 2.0, 'Tl': 3.0, 'Pb': 3.0}",240.5330981573209,[],NM,False,47,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0001174000593528,0.0282386,0,0.0282386,MP,data/source/MP/cleaned/cifs/MP-mp-1223251.cif,False,,data/final/MP/graphs/La1Pb1.5Tl1.5-MP-mp-1223251.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Co1.99Cu1Rh0.01S4,2,0.0028571428571428,2.0,False,Co3.98Cu2Rh0.02S8,Co4Cu2S8,2.61,Other,True,Co28.429Cu14.286Rh0.143S57.143,Co-Cu-Rh-S,4,Supercon,Cu1Co1.99Rh0.01S4,MP-mp-3925,Co4Cu2S8,Co-Cu-S,Co28.571Cu14.286S57.143,F d -3 m,cubic,6.69987918,6.699879179999999,6.699879179999999,data/final/MP/cifs/Co1.99Cu1Rh0.01S4-MP-mp-3925-synth_doped.cif,data/source/MP/raw/cifs/mp-3925.cif,mp-3925,0.0,,2011-05-15 03:07:38,4.836104359598833,10.17188/1207634,"@misc{osti_1207634,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Co2CuS4 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207634"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698326'}},0.0,5.68331854,520.0,-75.59837827,-5.399884162142857,"{'tags': ['Cobalt copper sulfide (2/1/4)', 'Carrollite', 'Dicobalt(III) copper sulfide']}",-75.59837827,-5.399884162142857,-0.7070782010714284,"['xas', 'bandstructure']",True,"[622571, 31107, 52943]",True,2021-05-12 10:57:08.928000,NM,14,8,mp-3925,,Co2CuS4,"{'functional': 'PBE', 'labels': ['Co', 'Cu_pv', 'S'], 'pot_type': 'paw'}","{'Co': 2.0, 'Cu': 1.0, 'S': 4.0}",GGA,mp-3925,"['mp-931396', 'mp-915858', 'mp-932359', 'mp-3925', 'mp-1425952', 'mp-1698326', 'mp-1833413', 'mp-1599756']",0.00593025,"{'Co': 4.0, 'Cu': 2.0, 'S': 8.0}",212.6600516474575,[],NM,False,227,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",5.5772110972972206e-05,0.00593025,0,0.0118605,MP,data/source/MP/cleaned/cifs/MP-mp-3925.cif,True,,data/final/MP/graphs/Co1.99Cu1Rh0.01S4-MP-mp-3925-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Pb1O2,1,0.0,2.0,False,Pb2O4,Pb2O4,0.0,Oxide,True,Pb33.333O66.66666666666667,Pb-O,2,Supercon,O2Pb1,MP-mp-20725,Pb2O4,Pb-O,Pb33.333O66.66666666666667,P 42/m n m,tetragonal,3.449215,5.081642,5.081642,data/final/MP/cifs/Pb1O2-MP-mp-20725.cif,data/source/MP/raw/cifs/mp-20725.cif,mp-20725,0.0131999999999998,,2013-10-20 20:15:10,8.918867085097688,10.17188/1195886,"@misc{osti_1195886,
    author = ""Persson, Kristin"",
    title = ""Materials Data on PbO2 (SG:136) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195886"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1673023'}},0.0,3.74554412,520.0,-32.26702035,-5.377836725000001,"{'tags': ['Plattnerite', 'Lead(IV) oxide', 'Lead oxide (1/2)', 'Lead dioxide']}",-32.26702035,-5.377836725000001,-1.299647031666667,"['xas', 'elasticity', 'bandstructure']",True,"[56002, 647277, 43460, 34234, 23292, 647262, 647279]",True,2021-05-12 10:56:14.760000,NM,6,11,mp-20725,oxide,PbO2,"{'functional': 'PBE', 'labels': ['Pb_d', 'O'], 'pot_type': 'paw'}","{'Pb': 1.0, 'O': 2.0}",GGA,mp-20725,"['mp-684871', 'mp-658988', 'mp-655790', 'mp-20725', 'mp-1077012', 'mp-1077853', 'mp-1439278', 'mp-1673023', 'mp-1783649', 'mp-1588161', 'mp-679376']",0.0004533,"{'Pb': 2.0, 'O': 4.0}",89.06937356371414,[],NM,False,136,0,"[0, 0, 0, 0, 0, 0]",1.0178582870030858e-05,0.0004533,0,0.0009066,MP,data/source/MP/cleaned/cifs/MP-mp-20725.cif,False,,data/final/MP/graphs/Pb1O2-MP-mp-20725.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ca1.82Cl2Cu1Na0.18O2,3,0.0514285714285714,1.0,True,Ca1.82Cl2Cu1Na0.18O2,Ca2Cl2Cu1O2,27.055,Cuprate,True,Ca26Cl28.571Cu14.286Na2.571O28.571428571428573,Ca-Cl-Cu-Na-O,5,Supercon,Ca1.82Na0.18Cu1Cl2O2,MP-mp-23143,Ca2Cu1Cl2O2,Ca-Cl-Cu-O,Ca28.571Cl28.571Cu14.286O28.571428571428573,I 4/m m m,tetragonal,3.88024600076171,3.880246000761709,8.12907187,data/final/MP/cifs/Ca1.82Cl2Cu1Na0.18O2-MP-mp-23143-synth_doped.cif,data/source/MP/raw/cifs/mp-23143.cif,mp-23143,0.0,,2014-02-21 09:50:06,3.554337150605878,10.17188/1199263,"@misc{osti_1199263,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ca2Cu(ClO)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199263"",
    place = ""United States"",
    year = ""2016"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700223'}},0.0191527683333321,4.19679796,520.0,-35.95348475,-5.136212107142858,"{'tags': ['Dicalcium copper dioxide dichloride', 'Dicalcium dichlorodioxocuprate']}",-35.95348475,-5.136212107142858,-2.407440427142858,"['xas', 'elasticity', 'bandstructure']",True,"[1027, 83117, 41581]",True,2021-05-12 10:56:16.728000,NM,7,8,mp-23143,oxide,Ca2Cu(ClO)2,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Cu_pv', 'Cl', 'O'], 'pot_type': 'paw'}","{'Ca': 2.0, 'Cu': 1.0, 'Cl': 2.0, 'O': 2.0}",GGA,mp-23143,"['mp-992231', 'mp-990553', 'mp-23143', 'mp-1436301', 'mp-1700223', 'mp-1803462', 'mp-993865', 'mp-1592909']",0.0134962,"{'Ca': 2.0, 'Cu': 1.0, 'Cl': 2.0, 'O': 2.0}",115.21141865211318,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001171429026557,0.0134962,0,0.0134962,MP,data/source/MP/cleaned/cifs/MP-mp-23143.cif,True,,data/final/MP/graphs/Ca1.82Cl2Cu1Na0.18O2-MP-mp-23143-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Lu1Rh1,1,0.0,1.0,True,Lu1Rh1,Lu1Rh1,0.0,Other,True,Lu50Rh50,Lu-Rh,2,Supercon,Lu1Rh1,MP-mp-377,Lu1Rh1,Lu-Rh,Lu50Rh50,P m -3 m,cubic,3.357307,3.357307,3.357307,data/final/MP/cifs/Lu1Rh1-MP-mp-377.cif,data/source/MP/raw/cifs/mp-377.cif,mp-377,0.0,,2011-05-12 19:29:26,12.193306704540737,10.17188/1207398,"@misc{osti_1207398,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LuRh (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207398"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686363'}},0.0,4.90640627,520.0,-13.9440909,-6.97204545,{'tags': ['Lutetium rhodium (1/1)']},-13.9440909,-6.97204545,-1.029416255,"['xas', 'elasticity', 'bandstructure']",True,"[642541, 104821]",True,2021-05-12 10:56:20.740000,NM,2,8,mp-377,,LuRh,"{'functional': 'PBE', 'labels': ['Lu_3', 'Rh_pv'], 'pot_type': 'paw'}","{'Lu': 1.0, 'Rh': 1.0}",GGA,mp-377,"['mp-377', 'mp-941772', 'mp-941905', 'mp-935108', 'mp-1440083', 'mp-1686363', 'mp-1794188', 'mp-1591525']",0.0003359,"{'Lu': 1.0, 'Rh': 1.0}",37.84192040473962,[],NM,False,221,0,"[0, 0]",8.876399411218286e-06,0.0003359,0,0.0003359,MP,data/source/MP/cleaned/cifs/MP-mp-377.cif,False,,data/final/MP/graphs/Lu1Rh1-MP-mp-377.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ni0.06S2Ta1,3,0.114630467571644,4.0,False,Ni0.24S8Ta4,Ni1S8Ta4,1.9,Ferrite,True,Ni1.961S65.359Ta32.68,Ni-S-Ta,3,Supercon,Ni0.06Ta1S2,MP-mp-1218136,Ta4Ni1S8,Ni-S-Ta,Ni7.692S61.538Ta30.769,P -3 m 1,trigonal,3.369069999250622,3.36906982,24.425977,data/final/MP/cifs/Ni0.06S2Ta1-MP-mp-1218136-synth_doped.cif,data/source/MP/raw/cifs/mp-1218136.cif,mp-1218136,0.0,,2019-01-12 19:21:19.076000,7.185617374365983,,,{'GGA': {'task_id': 'mp-1746242'}},0.0414952845607894,5.36411464,520.0,-98.60879648,-7.585292036923077,{'tags': []},-98.60879648,-7.585292036923077,-1.2561500265384615,[],False,[],True,2021-05-12 11:00:42.526000,FM,13,4,mp-1218136,,Ta4NiS8,"{'functional': 'PBE', 'labels': ['Ta_pv', 'Ni_pv', 'S'], 'pot_type': 'paw'}","{'Ta': 4.0, 'Ni': 1.0, 'S': 8.0}",GGA,mp-1218136,"['mp-1218136', 'mp-1395464', 'mp-1746242', 'mp-1876649']",0.5894077,"{'Ta': 4.0, 'Ni': 1.0, 'S': 8.0}",240.1057793870966,[],FM,True,164,1,"[0.0, 0.0, 0.0, 0.0, 0.5, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.002454783477118,0.5894077,1,0.5894077,MP,data/source/MP/cleaned/cifs/MP-mp-1218136.cif,True,,data/final/MP/graphs/Ni0.06S2Ta1-MP-mp-1218136-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Cu2O1,1,0.0,2.0,False,Cu4O2,Cu4O2,0.0,Oxide,True,Cu66.667O33.333333333333336,Cu-O,2,Supercon,Cu2O1,MP-mp-361,Cu4O2,Cu-O,Cu66.667O33.333333333333336,P n -3 m,cubic,4.287813,4.287813,4.287813,data/final/MP/cifs/Cu2O1-MP-mp-361.cif,data/source/MP/raw/cifs/mp-361.cif,mp-361,0.5126999999999997,,2011-05-13 22:13:11,6.028164790035252,10.17188/1207131,"@misc{osti_1207131,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Cu2O (SG:224) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207131"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668827'}},0.0,4.17338442,700.0,-28.78570065,-4.797616775,"{'tags': ['Cuprite', 'Dicopper oxide', 'High pressure experimental phase']}",-28.78570065,-4.797616775,-0.644491993333333,"['diel', 'xas', 'elasticity', 'bandstructure']",True,"[167446, 173982, 31057, 52043, 38233, 246903, 173983, 628621, 172174, 190598, 63281, 190597, 53322, 261853, 628619, 180846, 26963]",True,2021-05-12 10:56:20.740000,NM,6,17,mp-361,oxide,Cu2O,"{'functional': 'PBE', 'labels': ['Cu_pv', 'O'], 'pot_type': 'paw'}","{'Cu': 2.0, 'O': 1.0}",GGA,mp-361,"['mp-704614', 'mp-669954', 'mp-716614', 'mp-715519', 'mp-717628', 'mp-660277', 'mp-656780', 'mp-361', 'mp-1077115', 'mp-1077478', 'mp-1440712', 'mp-1541175', 'mp-1540470', 'mp-1668827', 'mp-1799952', 'mp-1588240', 'mp-1594958']",0.01225915,"{'Cu': 4.0, 'O': 2.0}",78.83290124625067,[],NM,False,224,0,"[-0.0, -0.0, -0.0, -0.0, 0.0, 0.0]",0.0003110160810067,0.01225915,0,0.0245183,MP,data/source/MP/cleaned/cifs/MP-mp-361.cif,False,,data/final/MP/graphs/Cu2O1-MP-mp-361.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Fe2K0.86Se1.82,3,0.0547008547008546,1.0,True,Fe2K0.86Se1.82,Fe2K1Se2,30.05,Ferrite,True,Fe42.735K18.376Se38.889,Fe-K-Se,3,Supercon,K0.86Fe2Se1.82,MP-mp-1070735,K1Fe2Se2,Fe-K-Se,Fe40K20Se40,I 4/m m m,tetragonal,3.783558000712664,3.783558000712664,7.91886339,data/final/MP/cifs/Fe2K0.86Se1.82-MP-mp-1070735-synth_doped.cif,data/source/MP/raw/cifs/mp-1070735.cif,mp-1070735,0.0,,2018-03-22 03:52:22,4.804538531009527,,,{'GGA': {'task_id': 'mp-1761650'}},0.0327827750000011,3.42423866,520.0,-27.50456218,-5.500912436,{'tags': ['Potassium iron selenide (1/2/2)']},-27.50456218,-5.500912436,-0.6812646755374999,['bandstructure'],True,[186573],True,2021-05-12 10:58:14.654000,FM,5,8,mp-1070735,,K(FeSe)2,"{'functional': 'PBE', 'labels': ['K_sv', 'Fe_pv', 'Se'], 'pot_type': 'paw'}","{'K': 1.0, 'Fe': 2.0, 'Se': 2.0}",GGA,mp-1070735,"['mp-1070735', 'mp-1070765', 'mp-1070841', 'mp-1416829', 'mp-1761650', 'mp-1797161', 'mp-1585994', 'mp-1070830']",6.0503851,"{'K': 1.0, 'Fe': 2.0, 'Se': 2.0}",106.69540665041993,[],FM,True,139,1,"[0.0, 2.8, 2.8, 0.0, 0.0]",0.0567070813069176,6.0503851,2,6.0503851,MP,data/source/MP/cleaned/cifs/MP-mp-1070735.cif,True,,data/final/MP/graphs/Fe2K0.86Se1.82-MP-mp-1070735-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As2Ba0.737Fe2K0.263,3,0.0948,2.0,False,As4Ba1.474Fe4K0.526,As4Ba1Fe4K1,24.0,Ferrite,True,As40Ba14.74Fe40K5.26,As-Ba-Fe-K,4,Supercon,Ba0.737K0.263Fe2As2,MP-mp-1223517,K1Ba1Fe4As4,As-Ba-Fe-K,As40Ba10Fe40K10,C m m m,orthorhombic,5.479027,5.480024002658328,7.13170472,data/final/MP/cifs/As2Ba0.737Fe2K0.263-MP-mp-1223517-synth_doped.cif,data/source/MP/raw/cifs/mp-1223517.cif,mp-1223517,0.0,,2019-01-12 23:54:03.876000,5.87534599912672,,,{'GGA': {'task_id': 'mp-1743010'}},0.0132513644999994,4.21185628,520.0,-59.66633886,-5.966633886,{'tags': []},-59.66633886,-5.966633886,-0.4120461663000007,[],False,[],True,2021-05-12 11:00:52.054000,FM,10,4,mp-1223517,,KBa(FeAs)4,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",GGA,mp-1223517,"['mp-1223517', 'mp-1396881', 'mp-1743010', 'mp-1827585']",0.9947188,"{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",197.6961518155852,[],FM,True,65,1,"[0.0, 0.0, 0.3, 0.3, 0.3, 0.3, 0.0, 0.0, 0.0, 0.0]",0.0050315536790412,0.9947188,4,0.9947188,MP,data/source/MP/cleaned/cifs/MP-mp-1223517.cif,True,,data/final/MP/graphs/As2Ba0.737Fe2K0.263-MP-mp-1223517-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
As1F0.17Fe1Gd1O0.83,3,0.085,2.0,False,As2F0.34Fe2Gd2O1.66,As2Fe2Gd2O2,22.0,Ferrite,True,As25F4.25Fe25Gd25O20.75,As-F-Fe-Gd-O,5,Supercon,Gd1Fe1As1F0.17O0.83,MP-mp-1078679,Gd2Fe2As2O2,As-Fe-Gd-O,As25Fe25Gd25O25,P 4/n m m,tetragonal,3.996524,3.996524,9.110606,data/final/MP/cifs/As1F0.17Fe1Gd1O0.83-MP-mp-1078679-synth_doped.cif,data/source/MP/raw/cifs/mp-1078679.cif,mp-1078679,0.0,,2018-04-12 14:54:44,6.938465251324023,,,{'GGA+U': {'task_id': 'mp-1704492'}},0.2756975050000001,4.06882668,520.0,-71.78498399,-8.97312299875,{'tags': ['Gadolinium iron arsenic oxide (1/1/1/1)']},-71.78498399,-8.97312299875,-1.670570473750001,['bandstructure'],True,"[425013, 422003, 425006, 425015, 425010, 236655, 425016]",True,2021-05-12 10:58:16.596000,FM,8,10,mp-1078679,oxide,GdFeAsO,"{'functional': 'PBE', 'labels': ['Gd', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Gd': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-1078679,"['mp-1078679', 'mp-1079389', 'mp-1079927', 'mp-1080502', 'mp-1080613', 'mp-1095209', 'mp-1438268', 'mp-1704492', 'mp-1864230', 'mp-1589235']",10.7990939,"{'Gd': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",145.5164583479414,[],FM,True,129,2,"[6.9, 6.9, 3.6, 3.6, 0.0, 0.0, 0.0, 0.0]",0.1484243641248952,10.7990939,4,21.5981878,MP,data/source/MP/cleaned/cifs/MP-mp-1078679.cif,True,,data/final/MP/graphs/As1F0.17Fe1Gd1O0.83-MP-mp-1078679-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Nd0.92Ni1Th0.08O3,2,0.0319999999999999,4.0,False,Nd3.68Ni4Th0.32O12,Nd4Ni4O12,0.0,Oxide,True,Nd18.4Ni20Th1.6O60,Nd-Ni-Th-O,4,Supercon,Nd0.92Th0.08Ni1O3,MP-mp-22106,Nd4Ni4O12,Nd-Ni-O,Nd20Ni20O60,P n m a,orthorhombic,5.431762,5.495849,7.709429,data/final/MP/cifs/Nd0.92Ni1Th0.08O3-MP-mp-22106-synth_doped.cif,data/source/MP/raw/cifs/mp-22106.cif,mp-22106,0.0,,2014-02-19 13:18:08,7.242194237367626,,,{'GGA+U': {'task_id': 'mp-1701351'}},0.0,3.99854667,520.0,-131.66600273,-6.5833001365,"{'tags': ['Neodymium nickel(III) oxide', 'Dineodymium niccolate', 'Neodymium niccolate', 'Neodymium nickel oxide', 'Neodymium niccolate(III)']}",-131.66600273,-6.5833001365,-2.425267555500001,"['xas', 'bandstructure']",True,"[155746, 67725, 164825, 67724, 416213, 78319, 164562, 155747, 67723, 69788, 155748, 67722, 24875, 416212]",True,2021-05-12 10:57:01.079000,FM,20,11,mp-22106,oxide,NdNiO3,"{'functional': 'PBE', 'labels': ['Nd_3', 'Ni_pv', 'O'], 'pot_type': 'paw'}","{'Nd': 1.0, 'Ni': 1.0, 'O': 3.0}",GGA+U,mp-22106,"['mp-919926', 'mp-918860', 'mp-905914', 'mp-602303', 'mp-25591', 'mp-1189695', 'mp-22106', 'mp-1416651', 'mp-1701351', 'mp-1930748', 'mp-1599871']",1.00005245,"{'Nd': 4.0, 'Ni': 4.0, 'O': 12.0}",230.14298278419733,[],FM,True,62,1,"[0.0, 0.0, 0.0, 0.0, 1.4, 1.4, 1.4, 1.4, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0173814111193255,1.00005245,4,4.0002098,MP,data/source/MP/cleaned/cifs/MP-mp-22106.cif,True,,data/final/MP/graphs/Nd0.92Ni1Th0.08O3-MP-mp-22106-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Th1Tl3,1,0.0,1.0,True,Th1Tl3,Th1Tl3,0.87,Other,True,Th25Tl75,Th-Tl,2,Supercon,Th1Tl3,MP-mp-2061,Th1Tl3,Th-Tl,Th25Tl75,P m -3 m,cubic,4.841818,4.841818,4.841818,data/final/MP/cifs/Th1Tl3-MP-mp-2061.cif,data/source/MP/raw/cifs/mp-2061.cif,mp-2061,0.0,,2011-05-13 03:24:15,12.36451305089252,10.17188/1195746,"@misc{osti_1195746,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ThTl3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195746"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700984'}},0.0,7.4134386,520.0,-15.15059102,-3.787647755,{'tags': ['Thorium thallium (1/3)']},-15.15059102,-3.787647755,-0.1622008324999999,"['xas', 'elasticity', 'bandstructure']",True,"[653246, 106159, 106160]",True,2021-05-12 10:56:14.760000,NM,4,8,mp-2061,,ThTl3,"{'functional': 'PBE', 'labels': ['Th', 'Tl_d'], 'pot_type': 'paw'}","{'Th': 1.0, 'Tl': 3.0}",GGA,mp-2061,"['mp-993509', 'mp-991563', 'mp-2061', 'mp-1438535', 'mp-1700984', 'mp-1803821', 'mp-994821', 'mp-1593434']",0.0021339,"{'Th': 1.0, 'Tl': 3.0}",113.5077152188092,[],NM,False,221,0,"[0, 0, 0, 0]",1.879960314491816e-05,0.0021339,0,0.0021339,MP,data/source/MP/cleaned/cifs/MP-mp-2061.cif,False,,data/final/MP/graphs/Th1Tl3-MP-mp-2061.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
B2Fe0.003Mg0.997,2,0.002,1.0,True,B2Fe0.003Mg0.997,B2Mg1,37.8,Other,True,B66.667Fe0.1Mg33.233,B-Fe-Mg,3,Supercon,Mg0.997Fe0.003B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B2Fe0.003Mg0.997-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B2Fe0.003Mg0.997-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
As1Fe1La0.5Y0.5O1,1,0.0,2.0,False,As2Fe2La1Y1O2,As2Fe2La1Y1O2,0.0,Ferrite,True,As25Fe25La12.5Y12.5O25,As-Fe-La-Y-O,5,Supercon,La0.5Y0.5Fe1As1O1,MP-mp-1222786,La1Y1Fe2As2O2,As-Fe-La-Y-O,As25Fe25La12.5Y12.5O25,P 4 m m,tetragonal,4.113923,4.113923,8.980687,data/final/MP/cifs/As1Fe1La0.5Y0.5O1-MP-mp-1222786.cif,data/source/MP/raw/cifs/mp-1222786.cif,mp-1222786,0.0,,2019-01-12 23:16:19.599000,5.695751494849528,,,{'GGA+U': {'task_id': 'mp-1754089'}},0.2822735440104154,5.1653492,520.0,-55.19504052,-6.899380065,{'tags': []},-55.19504052,-6.899380065,-1.6905483227083336,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,FM,8,5,mp-1222786,oxide,LaYFe2(AsO)2,"{'functional': 'PBE', 'labels': ['La', 'Y_sv', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'La': 1.0, 'Y': 1.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",GGA+U,mp-1222786,"['mp-1222786', 'mp-1398732', 'mp-1754089', 'mp-1779506', 'mp-1619122']",7.653468,"{'La': 1.0, 'Y': 1.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",151.99240183736552,[],FM,True,99,1,"[0.0, 0.0, 3.6, 3.6, 0.0, 0.0, 0.0, 0.0]",0.0503542802632288,7.653468,2,7.653468,MP,data/source/MP/cleaned/cifs/MP-mp-1222786.cif,False,,data/final/MP/graphs/As1Fe1La0.5Y0.5O1-MP-mp-1222786.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
Ag0.5Sn0.5Te1,1,0.0,2.0,False,Ag1Sn1Te2,Ag1Sn1Te2,0.0,Other,True,Ag25Sn25Te50,Ag-Sn-Te,3,Supercon,Sn0.5Ag0.5Te1,MP-mp-1229006,Ag1Sn1Te2,Ag-Sn-Te,Ag25Sn25Te50,P 4/m m m,tetragonal,4.34439,4.34439,6.074553,data/final/MP/cifs/Ag0.5Sn0.5Te1-MP-mp-1229006.cif,data/source/MP/raw/cifs/mp-1229006.cif,mp-1229006,0.0,,2019-01-13 04:39:05.516000,6.977893003537542,,,{'GGA': {'task_id': 'mp-1732744'}},0.0364139496875002,5.54955594,520.0,-13.64719625,-3.4117990625,{'tags': []},-13.64719625,-3.4117990625,-0.3406166329166669,['bandstructure'],True,[],True,2021-05-12 10:58:49.477000,NM,4,5,mp-1229006,,AgSnTe2,"{'functional': 'PBE', 'labels': ['Ag', 'Sn_d', 'Te'], 'pot_type': 'paw'}","{'Ag': 1.0, 'Sn': 1.0, 'Te': 2.0}",GGA,mp-1229006,"['mp-1229006', 'mp-1445755', 'mp-1732744', 'mp-1803164', 'mp-1584969']",0.0064562,"{'Ag': 1.0, 'Sn': 1.0, 'Te': 2.0}",114.64943961316844,[],NM,False,123,0,"[0, 0, 0, 0]",5.631252993284104e-05,0.0064562,0,0.0064562,MP,data/source/MP/cleaned/cifs/MP-mp-1229006.cif,False,,data/final/MP/graphs/Ag0.5Sn0.5Te1-MP-mp-1229006.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Al2La0.994Tb0.006,2,0.004,2.0,False,Al4La1.988Tb0.012,Al4La2,1.996,Other,True,Al66.667La33.133Tb0.2,Al-La-Tb,3,Supercon,La0.9941Tb0.0059Al2,MP-mp-2694,La2Al4,Al-La,Al66.667La33.333,F d -3 m,cubic,5.75810346,5.75810346,5.75810346,data/final/MP/cifs/Al2La0.994Tb0.006-MP-mp-2694-synth_doped.cif,data/source/MP/raw/cifs/mp-2694.cif,mp-2694,0.0,,2011-05-12 21:07:48,4.744791242841679,10.17188/1201263,"@misc{osti_1201263,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaAl2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201263"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686658'}},0.0,8.10972418,520.0,-27.8605497,-4.64342495,{'tags': ['Aluminium lanthanum (2/1)']},-27.8605497,-4.64342495,-0.5010386950000001,"['xas', 'elasticity', 'bandstructure']",True,"[608275, 608277, 608265, 608290, 608288, 57933, 608270, 608269, 603920, 608272, 608286, 608273, 608289, 604450, 608266]",True,2021-05-12 10:56:18.721000,NM,6,10,mp-2694,,LaAl2,"{'functional': 'PBE', 'labels': ['La', 'Al'], 'pot_type': 'paw'}","{'La': 1.0, 'Al': 2.0}",GGA,mp-2694,"['mp-940230', 'mp-925817', 'mp-940644', 'mp-2694', 'mp-1258643', 'mp-1440554', 'mp-1686658', 'mp-1787219', 'mp-1596037', 'mp-1594760']",0.0008869,"{'La': 2.0, 'Al': 4.0}",134.99677475891534,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",1.3139573172527638e-05,0.0008869,0,0.0017738,MP,data/source/MP/cleaned/cifs/MP-mp-2694.cif,True,,data/final/MP/graphs/Al2La0.994Tb0.006-MP-mp-2694-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
La2Se3,1,0.0,8.0,False,La16Se24,La16Se24,0.0,Other,True,La40Se60,La-Se,2,Supercon,La2Se3,MP-mp-32798,La16Se24,La-Se,La40Se60,I -4 2 d,tetragonal,9.107081997617948,9.107081997617948,15.059985729999998,data/final/MP/cifs/La2Se3-MP-mp-32798.cif,data/source/MP/raw/cifs/mp-32798.cif,mp-32798,1.5393000000000008,,2014-02-15 04:39:36,6.055498727469831,10.17188/1206384,"@misc{osti_1206384,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La2Se3 (SG:122) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1206384"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-741112'}},0.0,5.36735938,520.0,-244.08205631,-6.10205140775,{'tags': []},-244.08205631,-6.10205140775,-2.3133016791562504,"['xas', 'bandstructure']",True,[],True,2021-05-12 10:57:06.958000,NM,40,7,mp-32798,,La2Se3,"{'functional': 'PBE', 'labels': ['La', 'Se'], 'pot_type': 'paw'}","{'La': 2.0, 'Se': 3.0}",GGA,mp-32798,"['mp-729671', 'mp-741112', 'mp-32798', 'mp-32886', 'mp-1333383', 'mp-1847775', 'mp-749005']",0.0002667375,"{'La': 16.0, 'Se': 24.0}",1129.108536303408,[],NM,False,122,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.889898031402881e-06,0.0002667375,0,0.0021339,MP,data/source/MP/cleaned/cifs/MP-mp-32798.cif,False,,data/final/MP/graphs/La2Se3-MP-mp-32798.json,0,True,-42m,0,0,0,0,6,0,0,0,0,1,0,1.0,False
Cu1Nd1.85Th0.15O4,2,0.0428571428571428,1.0,True,Cu1Nd1.85Th0.15O4,Cu1Nd2O4,22.5,Cuprate,True,Cu14.286Nd26.429Th2.143O57.142857142857146,Cu-Nd-Th-O,4,Supercon,Nd1.85Th0.15Cu1O4,MP-mp-4158,Nd2Cu1O4,Cu-Nd-O,Cu14.286Nd28.571O57.142857142857146,I 4/m m m,tetragonal,3.973854000245551,3.973854000245551,6.78296857,data/final/MP/cifs/Cu1Nd1.85Th0.15O4-MP-mp-4158-synth_doped.cif,data/source/MP/raw/cifs/mp-4158.cif,mp-4158,0.0,,2011-05-13 10:19:33,7.086167303782593,10.17188/1207899,"@misc{osti_1207899,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nd2CuO4 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207899"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-670050'}},0.0009497997619085,3.16510927,520.0,-51.48091453,-7.354416361428571,"{'tags': ['Dineodymium copper tetraoxide', 'Dineodymium copper oxide', 'Dineodymium cuprate', 'High pressure experimental phase']}",-51.48091453,-7.354416361428571,-2.971653917142857,"['xas', 'elasticity', 'bandstructure']",True,"[261376, 203228, 160629, 261375, 69479, 186590, 4203, 75830, 75825, 202885, 203229, 71181, 82067, 75828, 69886, 75826, 75829, 75824, 75827, 69482, 86752]",True,2021-05-12 10:56:20.740000,NM,7,11,mp-4158,oxide,Nd2CuO4,"{'functional': 'PBE', 'labels': ['Nd_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Nd': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-4158,"['mp-670050', 'mp-660368', 'mp-4158', 'mp-1078016', 'mp-1173374', 'mp-1440751', 'mp-1668619', 'mp-1797319', 'mp-1588086', 'mp-1590518', 'mp-688505']",0.0084899,"{'Nd': 2.0, 'Cu': 1.0, 'O': 4.0}",97.4899480873212,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",8.708487558528232e-05,0.0084899,0,0.0084899,MP,data/source/MP/cleaned/cifs/MP-mp-4158.cif,True,,data/final/MP/graphs/Cu1Nd1.85Th0.15O4-MP-mp-4158-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B2C1Ce1Pt2,1,0.0,1.0,True,B2C1Ce1Pt2,B2C1Ce1Pt2,0.0,Heavy_fermion,True,B33.333C16.667Ce16.667Pt33.333,B-C-Ce-Pt,4,Supercon,Ce1Pt2B2C1,MP-mp-1024975,Ce1B2Pt2C1,B-C-Ce-Pt,B33.333C16.667Ce16.667Pt33.333,I 4/m m m,tetragonal,3.8275560027595534,3.8275560027595534,6.06664062,data/final/MP/cifs/B2C1Ce1Pt2-MP-mp-1024975.cif,data/source/MP/raw/cifs/mp-1024975.cif,mp-1024975,0.0,,2016-09-26 05:29:41,11.772380988801745,10.17188/1355251,"@article{osti_1355251,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeB2Pt2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1355251"",
    place = ""United States"",
    year = ""2017"",
    month = ""5""
}
",{'GGA': {'task_id': 'mp-1756783'}},0.0329790513888879,8.32804416,520.0,-44.42929675,-7.404882791666666,"{'tags': ['LuNi2B2C', 'CePt2.1B2.4C1.2']}",-44.42929675,-7.404882791666666,-0.6281379888888878,['bandstructure'],True,[],True,2021-05-12 10:58:09.072000,NM,6,5,mp-1024975,,CeB2Pt2C,"{'functional': 'PBE', 'labels': ['Ce', 'B', 'Pt', 'C'], 'pot_type': 'paw'}","{'Ce': 1.0, 'B': 2.0, 'Pt': 2.0, 'C': 1.0}",GGA,mp-1024975,"['mp-1024975', 'mp-1389594', 'mp-1756783', 'mp-1800027', 'mp-1626932']",0.0028164,"{'Ce': 1.0, 'B': 2.0, 'Pt': 2.0, 'C': 1.0}",79.54259308706459,[],NM,False,139,0,"[-0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",3.540744512713164e-05,0.0028164,0,0.0028164,MP,data/source/MP/cleaned/cifs/MP-mp-1024975.cif,False,,data/final/MP/graphs/B2C1Ce1Pt2-MP-mp-1024975.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ba2Cu4Tm1O8,1,0.0,1.0,True,Ba2Cu4Tm1O8,Ba2Cu4Tm1O8,79.42,Cuprate,True,Ba13.333Cu26.667Tm6.667O53.333333333333336,Ba-Cu-Tm-O,4,Supercon,Tm1Ba2Cu4O8,MP-mp-6710,Ba2Tm1Cu4O8,Ba-Cu-Tm-O,Ba13.333Cu26.667Tm6.667O53.333333333333336,C m m m,orthorhombic,3.865297,3.8869580003373287,13.86982093,data/final/MP/cifs/Ba2Cu4Tm1O8-MP-mp-6710.cif,data/source/MP/raw/cifs/mp-6710.cif,mp-6710,0.0,,2011-05-16 03:10:26,6.645830128925235,10.17188/1281743,"@misc{osti_1281743,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Tm(CuO2)4 (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281743"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677992'}},0.0,3.30740365,520.0,-89.79535451,-5.986356967333333,"{'tags': ['Thulium dibarium tetracopper octaoxide', 'Thulium dibarium tricopper copper(III) oxide']}",-89.79535451,-5.986356967333333,-2.066470847111112,"['xas', 'bandstructure']",True,"[78622, 75686]",True,2021-05-12 10:57:32.679000,NM,15,7,mp-6710,oxide,Ba2Tm(CuO2)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Tm_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Tm': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-6710,"['mp-1007646', 'mp-1001301', 'mp-6710', 'mp-1420256', 'mp-1677992', 'mp-1831034', 'mp-1603852']",0.0025713,"{'Ba': 2.0, 'Tm': 1.0, 'Cu': 4.0, 'O': 8.0}",206.32772996439093,[],NM,False,65,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.2462212425076202e-05,0.0025713,0,0.0025713,MP,data/source/MP/cleaned/cifs/MP-mp-6710.cif,False,,data/final/MP/graphs/Ba2Cu4Tm1O8-MP-mp-6710.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
N0.8V1,3,0.111111111111111,1.0,True,N0.8V1,N1V1,4.54,Other,True,N44.444V55.556,N-V,2,Supercon,N0.8V1,MP-mp-1018027,V1N1,N-V,N50V50,P -6 m 2,hexagonal,2.650884,2.7441139966135384,2.74411362,data/final/MP/cifs/N0.8V1-MP-mp-1018027-synth_doped.cif,data/source/MP/raw/cifs/mp-1018027.cif,mp-1018027,0.0,,2017-04-06 22:50:08,6.238650289574885,10.17188/1350109,"@article{osti_1350109,
    author = ""Persson, Kristin"",
    title = ""Materials Data on VN (SG:187) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1350109"",
    place = ""United States"",
    year = ""2017"",
    month = ""4""
}
",{'GGA': {'task_id': 'mp-1708543'}},0.0,8.01774245,520.0,-19.7434431,-9.87172155,"{'tags': ['Tantalum nitride', 'Vanadium nitride', 'Niobium nitride']}",-19.7434431,-9.87172155,-1.3420210524999998,"['xas', 'bandstructure']",True,"[169820, 236426, 236427, 236425, 191061]",True,2021-05-12 10:56:51.169000,NM,2,29,mp-1018027,,VN,"{'functional': 'PBE', 'labels': ['V_pv', 'N'], 'pot_type': 'paw'}","{'V': 1.0, 'N': 1.0}",GGA,mp-1018027,"['mp-1018027', 'mp-1018232', 'mp-1018180', 'mp-1018364', 'mp-1057791', 'mp-1057832', 'mp-1057871', 'mp-1058279', 'mp-1058305', 'mp-1058336', 'mp-1058343', 'mp-1058365', 'mp-1058410', 'mp-1059217', 'mp-1059301', 'mp-1059342', 'mp-1059261', 'mp-1059121', 'mp-1059171', 'mp-1115473', 'mp-1423003', 'mp-1708543', 'mp-1790797', 'mp-1607807', 'mp-1059185', 'mp-1058318', 'mp-1058380', 'mp-1057845', 'mp-1059319']",0.0042068,"{'V': 1.0, 'N': 1.0}",17.287236565507055,[],NM,False,187,0,"[0, 0]",0.0002433471644851,0.0042068,0,0.0042068,MP,data/source/MP/cleaned/cifs/MP-mp-1018027.cif,True,,data/final/MP/graphs/N0.8V1-MP-mp-1018027-synth_doped.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Ce1Cu2Ge0.04Si1.96,2,0.016,1.0,True,Ce1Cu2Ge0.04Si1.96,Ce1Cu2Si2,0.385,Heavy_fermion,True,Ce20Cu40Ge0.8Si39.2,Ce-Cu-Ge-Si,4,Supercon,Ce1Cu2Si1.96Ge0.04,MP-mp-5452,Ce1Cu2Si2,Ce-Cu-Si,Ce20Cu40Si40,I 4/m m m,tetragonal,4.075731996715381,4.075731996715381,5.70132195,data/final/MP/cifs/Ce1Cu2Ge0.04Si1.96-MP-mp-5452-synth_doped.cif,data/source/MP/raw/cifs/mp-5452.cif,mp-5452,0.0,,2011-05-13 06:29:11,6.571257460055593,10.17188/1266988,"@misc{osti_1266988,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ce(SiCu)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1266988"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668622'}},0.0,8.51519913,520.0,-27.86039596,-5.572079192,"{'tags': ['Cerium copper silicon (1/2/2)', 'Cerium copper silicide (1/2/2)']}",-27.86039596,-5.572079192,-0.5472530850000006,"['xas', 'elasticity', 'bandstructure']",True,"[620924, 620948, 102140, 620940, 620921, 620914, 164068, 620946, 620920, 620949, 102141, 620930, 620939, 620931, 620951, 620944, 657643, 657672, 620943, 55797, 52851]",True,2021-05-12 10:56:22.739000,NM,5,9,mp-5452,,Ce(CuSi)2,"{'functional': 'PBE', 'labels': ['Ce', 'Cu_pv', 'Si'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Cu': 2.0, 'Si': 2.0}",GGA,mp-5452,"['mp-5452', 'mp-1097881', 'mp-1156698', 'mp-1248439', 'mp-1440927', 'mp-1668622', 'mp-1798875', 'mp-1594230', 'mp-1595235']",0.01041,"{'Ce': 1.0, 'Cu': 2.0, 'Si': 2.0}",81.71700258012696,[],NM,False,139,0,"[-0.0, 0.0, 0.0, 0.0, 0.0]",0.0001273908693578,0.01041,0,0.01041,MP,data/source/MP/cleaned/cifs/MP-mp-5452.cif,True,,data/final/MP/graphs/Ce1Cu2Ge0.04Si1.96-MP-mp-5452-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Pd1Te2,1,0.0,1.0,True,Pd1Te2,Pd1Te2,1.61,Other,True,Pd33.333Te66.667,Pd-Te,2,Supercon,Pd1Te2,MP-mp-782,Te2Pd1,Pd-Te,Pd33.333Te66.667,P -3 m 1,trigonal,4.116332001551086,4.11633193,5.170725,data/final/MP/cifs/Pd1Te2-MP-mp-782.cif,data/source/MP/raw/cifs/mp-782.cif,mp-782,0.0,,2011-05-12 19:10:21,7.914048115404642,10.17188/1307608,"@misc{osti_1307608,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Te2Pd (SG:164) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1307608"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671974'}},0.0,6.78872762,520.0,-12.46921459,-4.156404863333333,"{'tags': ['Merenskyite', 'Palladium(IV) telluride', 'Palladium telluride (1/2) - 2H', 'Palladium telluride (1/2)']}",-12.46921459,-4.156404863333333,-0.6155769733333329,"['xas', 'elasticity', 'bandstructure']",True,"[41387, 648995, 649013, 649016, 42555, 42554, 83642]",True,2021-05-12 10:56:31.128000,NM,3,8,mp-782,,Te2Pd,"{'functional': 'PBE', 'labels': ['Te', 'Pd'], 'pot_type': 'paw'}","{'Te': 2.0, 'Pd': 1.0}",GGA,mp-782,"['mp-908021', 'mp-923293', 'mp-922494', 'mp-782', 'mp-1442195', 'mp-1671974', 'mp-1800542', 'mp-1587195']",4.83e-05,"{'Te': 2.0, 'Pd': 1.0}",75.87572485123682,[],NM,False,164,0,"[0, 0, 0]",6.365672300949712e-07,4.83e-05,0,4.83e-05,MP,data/source/MP/cleaned/cifs/MP-mp-782.cif,False,,data/final/MP/graphs/Pd1Te2-MP-mp-782.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Pd7Se2,3,0.0444444444444444,1.0,True,Pd7Se2,Pd8Se2,0.53,Other,True,Pd77.778Se22.222,Pd-Se,2,Supercon,Pd7Se2,MP-mp-7818,Pd8Se2,Pd-Se,Pd80Se20,P -4 21 c,tetragonal,5.314807,5.314807,5.762397,data/final/MP/cifs/Pd7Se2-MP-mp-7818-synth_doped.cif,data/source/MP/raw/cifs/mp-7818.cif,mp-7818,0.0,,2011-05-30 06:45:10,10.29633329731544,10.17188/1307580,"@misc{osti_1307580,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Pd4Se (SG:114) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1307580"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696479'}},0.0,5.07601896,520.0,-50.03404921,-5.003404921,{'tags': ['Palladium selenide (4/1)']},-50.03404921,-5.003404921,-0.2547171774687499,"['bandstructure', 'elasticity']",True,[23864],True,2021-05-12 10:56:31.128000,NM,10,8,mp-7818,,Pd4Se,"{'functional': 'PBE', 'labels': ['Pd', 'Se'], 'pot_type': 'paw'}","{'Pd': 4.0, 'Se': 1.0}",GGA,mp-7818,"['mp-913043', 'mp-7818', 'mp-929268', 'mp-930128', 'mp-1429762', 'mp-1696479', 'mp-1779253', 'mp-1601294']",9.195e-05,"{'Pd': 8.0, 'Se': 2.0}",162.7714275309073,[],NM,False,114,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.1298051678331617e-06,9.195e-05,0,0.0001839,MP,data/source/MP/cleaned/cifs/MP-mp-7818.cif,True,,data/final/MP/graphs/Pd7Se2-MP-mp-7818-synth_doped.json,0,True,-42m,0,0,0,0,6,0,0,1,0,0,0,1.0,False
C1Nb2S2,1,0.0,1.0,True,C1Nb2S2,C1Nb2S2,7.6,Other,True,C20Nb40S40,C-Nb-S,3,Supercon,Nb2S2C1,MP-mp-4384,Nb2C1S2,C-Nb-S,C20Nb40S40,R -3 m,trigonal,3.2830823586498266,3.2830823586498266,9.7168594,data/final/MP/cifs/C1Nb2S2-MP-mp-4384.cif,data/source/MP/raw/cifs/mp-4384.cif,mp-4384,0.0,,2011-05-13 07:11:14,4.889648234296121,10.17188/1208116,"@misc{osti_1208116,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb2CS2 (SG:166) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208116"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704899'}},0.0162807446666697,4.58380871,520.0,-41.97079203,-8.394158405999999,{'tags': ['Niobium sulfide carbide (2/2/1) - 3R']},-41.97079203,-8.394158405999999,-1.0549003032499995,"['xas', 'elasticity', 'bandstructure']",True,"[95110, 95112]",True,2021-05-12 10:56:20.740000,NM,5,8,mp-4384,,Nb2CS2,"{'functional': 'PBE', 'labels': ['Nb_pv', 'C', 'S'], 'pot_type': 'paw'}","{'Nb': 2.0, 'C': 1.0, 'S': 2.0}",GGA,mp-4384,"['mp-927530', 'mp-927969', 'mp-917657', 'mp-4384', 'mp-1438036', 'mp-1704899', 'mp-1783792', 'mp-1591503']",0.0087424,"{'Nb': 2.0, 'C': 1.0, 'S': 2.0}",88.96017323087814,[],NM,False,166,0,"[0, 0, 0, 0, 0]",9.82731899286085e-05,0.0087424,0,0.0087424,MP,data/source/MP/cleaned/cifs/MP-mp-4384.cif,False,,data/final/MP/graphs/C1Nb2S2-MP-mp-4384.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
C1Mg1Ni2.98Ru0.02,2,0.008,1.0,True,C1Mg1Ni2.98Ru0.02,C1Mg1Ni3,6.51,Other,True,C20Mg20Ni59.6Ru0.4,C-Mg-Ni-Ru,4,Supercon,Mg1C1Ni2.98Ru0.02,MP-mp-10700,Mg1Ni3C1,C-Mg-Ni,C20Mg20Ni60,P m -3 m,cubic,3.810209,3.810209,3.810209,data/final/MP/cifs/C1Mg1Ni2.98Ru0.02-MP-mp-10700-synth_doped.cif,data/source/MP/raw/cifs/mp-10700.cif,mp-10700,0.0,,2011-05-28 10:04:44,6.376007671789427,10.17188/1187303,"@misc{osti_1187303,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MgNi3C (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187303"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678621'}},0.0,6.64260176,520.0,-28.85099542,-5.770199084,{'tags': ['Magnesium nickel carbide (1/3/1)']},-28.85099542,-5.770199084,-0.1367049259999994,"['xas', 'elasticity', 'bandstructure']",True,[77152],True,2021-05-12 10:56:10.715000,NM,5,8,mp-10700,,MgNi3C,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Ni_pv', 'C'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",GGA,mp-10700,"['mp-927245', 'mp-927653', 'mp-911184', 'mp-10700', 'mp-1438083', 'mp-1678621', 'mp-1791467', 'mp-1591421']",0.0387875,"{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",55.31544309398296,[],NM,False,221,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",0.0007012056277683,0.0387875,0,0.0387875,MP,data/source/MP/cleaned/cifs/MP-mp-10700.cif,True,,data/final/MP/graphs/C1Mg1Ni2.98Ru0.02-MP-mp-10700-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ni1U6,1,0.0,2.0,False,Ni2U12,Ni2U12,0.54,Heavy_fermion,True,Ni14.286U85.714,Ni-U,2,Supercon,Ni1U6,MP-mp-636821,U12Ni2,Ni-U,Ni14.286U85.714,I 4/m c m,tetragonal,5.111043998487085,7.71527587106345,7.71527587,data/final/MP/cifs/Ni1U6-MP-mp-636821.cif,data/source/MP/raw/cifs/mp-636821.cif,mp-636821,0.0,,2013-06-22 21:13:19,18.230911680670584,10.17188/1279605,"@misc{osti_1279605,
    author = ""Persson, Kristin"",
    title = ""Materials Data on U6Ni (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1279605"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1676488'}},0.0415476701785717,14.04127197,520.0,-147.32239377,-10.52302812642857,{'tags': ['Nickel uranium (1/6)']},-147.32239377,-10.52302812642857,-0.0189428778571425,"['xas', 'bandstructure']",True,"[647009, 260983, 105435]",True,2021-05-12 10:57:30.779000,NM,14,8,mp-636821,,U6Ni,"{'functional': 'PBE', 'labels': ['U', 'Ni_pv'], 'pot_type': 'paw'}","{'U': 6.0, 'Ni': 1.0}",GGA,mp-636821,"['mp-927547', 'mp-928282', 'mp-911601', 'mp-636821', 'mp-1104188', 'mp-1417911', 'mp-1676488', 'mp-1603623']",0.00106325,"{'U': 12.0, 'Ni': 2.0}",270.8586987978932,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",7.850957009827223e-06,0.00106325,0,0.0021265,MP,data/source/MP/cleaned/cifs/MP-mp-636821.cif,False,,data/final/MP/graphs/Ni1U6-MP-mp-636821.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Al0.19Nb3Sn0.81,3,0.0949999999999999,2.0,False,Al0.38Nb6Sn1.62,Nb6Sn2,14.6,Other,True,Al4.75Nb75Sn20.25,Al-Nb-Sn,3,Supercon,Nb3Sn0.81Al0.19,MP-mp-1326,Nb6Sn2,Nb-Sn,Nb75Sn25,P m -3 n,cubic,5.334611,5.334611,5.334611,data/final/MP/cifs/Al0.19Nb3Sn0.81-MP-mp-1326-synth_doped.cif,data/source/MP/raw/cifs/mp-1326.cif,mp-1326,0.0,,2011-05-14 09:51:48,8.694218121896231,10.17188/1189484,"@misc{osti_1189484,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Sn (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189484"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668415'}},0.0,6.59372491,520.0,-69.93787048,-8.74223381,{'tags': ['Niobium tin (3/1)']},-69.93787048,-8.74223381,-0.163862066250001,"['xas', 'elasticity', 'bandstructure']",True,"[105230, 645503, 645489, 105231, 645498, 645485, 645474, 645496, 645480, 645488, 645482, 645487, 645500, 645493, 645477, 645484, 645502, 645483, 150878, 645479, 645481, 645486, 645473]",True,2021-05-12 10:56:12.755000,NM,8,9,mp-1326,,Nb3Sn,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Sn_d'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Sn': 1.0}",GGA,mp-1326,"['mp-930046', 'mp-913770', 'mp-930577', 'mp-1326', 'mp-1440651', 'mp-1668415', 'mp-1880085', 'mp-1594093', 'mp-1594507']",0.62023085,"{'Nb': 6.0, 'Sn': 2.0}",151.81275738025872,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0081709977567491,0.62023085,0,1.2404617,MP,data/source/MP/cleaned/cifs/MP-mp-1326.cif,True,,data/final/MP/graphs/Al0.19Nb3Sn0.81-MP-mp-1326-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
B2Co3Er1,1,0.0,1.0,True,B2Co3Er1,B2Co3Er1,0.0,Other,True,B33.333Co50Er16.667,B-Co-Er,3,Supercon,Er1Co3B2,MP-mp-5353,Er1Co3B2,B-Co-Er,B33.333Co50Er16.667,P 6/m m m,hexagonal,3.027787,4.969194002042071,4.96919466,data/final/MP/cifs/B2Co3Er1-MP-mp-5353.cif,data/source/MP/raw/cifs/mp-5353.cif,mp-5353,0.0,,2011-05-12 23:52:52,9.378277254400826,10.17188/1263561,"@misc{osti_1263561,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ErCo3B2 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1263561"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702245'}},0.0,5.62889645,520.0,-42.36553074,-7.060921789999999,"{'tags': ['Cobalt erbium boride (3/1/2)', 'Erbium cobalt boride (1/3/2)']}",-42.36553074,-7.060921789999999,-0.5190125005555544,"['xas', 'elasticity', 'bandstructure']",True,"[612931, 44159, 612922]",True,2021-05-12 10:56:22.739000,NM,6,8,mp-5353,,ErCo3B2,"{'functional': 'PBE', 'labels': ['Er_3', 'Co', 'B'], 'pot_type': 'paw'}","{'Er': 1.0, 'Co': 3.0, 'B': 2.0}",GGA,mp-5353,"['mp-910074', 'mp-925580', 'mp-926017', 'mp-5353', 'mp-1441272', 'mp-1702245', 'mp-1932438', 'mp-1593616']",0.0076701,"{'Er': 1.0, 'Co': 3.0, 'B': 2.0}",64.7482347575826,[],NM,False,65,0,"[-0.0, 0.0, -0.0, 0.0, 0.0, 0.0]",0.0001184603723748,0.0076701,0,0.0076701,MP,data/source/MP/cleaned/cifs/MP-mp-5353.cif,False,,data/final/MP/graphs/B2Co3Er1-MP-mp-5353.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
F0.03Fe1La1P1O0.97,2,0.015,2.0,False,F0.06Fe2La2P2O1.94,Fe2La2P2O2,7.8,Ferrite,True,F0.75Fe25La25P25O24.25,F-Fe-La-P-O,5,Supercon,La1Fe1P1F0.03O0.97,MP-mp-510668,La2Fe2P2O2,Fe-La-P-O,Fe25La25P25O25,P 4/n m m,tetragonal,4.068879,4.068879,9.084981,data/final/MP/cifs/F0.03Fe1La1P1O0.97-MP-mp-510668-synth_doped.cif,data/source/MP/raw/cifs/mp-510668.cif,mp-510668,0.0,,2014-02-26 04:17:37,5.337337070142887,,,{'GGA+U': {'task_id': 'mp-1704083'}},0.3903949226041714,6.29241646,520.0,-55.52669053,-6.94083631625,{'tags': []},-55.52669053,-6.94083631625,-1.734766549583334,"['xas', 'bandstructure']",True,"[162724, 420381, 391428]",True,2021-05-12 10:57:15.388000,FM,8,7,mp-510668,oxide,LaFePO,"{'functional': 'PBE', 'labels': ['La', 'Fe_pv', 'P', 'O'], 'pot_type': 'paw'}","{'La': 1.0, 'Fe': 1.0, 'P': 1.0, 'O': 1.0}",GGA+U,mp-510668,"['mp-542977', 'mp-510668', 'mp-1422599', 'mp-1704083', 'mp-1768909', 'mp-1779846', 'mp-1595432']",3.95130975,"{'La': 2.0, 'Fe': 2.0, 'P': 2.0, 'O': 2.0}",150.40891327693348,[],FM,True,129,1,"[0.0, 0.0, 3.7, 3.7, 0.0, 0.0, 0.0, 0.0]",0.0525408988591631,3.95130975,2,7.9026195,MP,data/source/MP/cleaned/cifs/MP-mp-510668.cif,True,,data/final/MP/graphs/F0.03Fe1La1P1O0.97-MP-mp-510668-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Al0.9In0.1Nb3,2,0.0499999999999999,2.0,False,Al1.8In0.2Nb6,Al2Nb6,18.3,Other,True,Al22.5In2.5Nb75,Al-In-Nb,3,Supercon,Nb3Al0.9In0.1,MP-mp-796,Nb6Al2,Al-Nb,Al25Nb75,P m -3 n,cubic,5.215254,5.215254,5.215254,data/final/MP/cifs/Al0.9In0.1Nb3-MP-mp-796-synth_doped.cif,data/source/MP/raw/cifs/mp-796.cif,mp-796,0.0,,2011-05-13 16:07:37,7.157298025966356,,,{'GGA': {'task_id': 'mp-1686893'}},0.0460773865000003,5.52947534,520.0,-69.48918494,-8.6861481175,"{'tags': ['Aluminium niobium (1/3)', 'Niobium aluminide (3/1)', 'Aluminum niobium (1/3)']}",-69.48918494,-8.6861481175,-0.1737753800000003,"['bandstructure', 'elasticity']",True,"[608675, 608654, 608688, 608668, 608669, 608685, 608676, 608683, 58014, 608657, 107856, 608655, 608666, 608691, 608656, 608665, 608673, 608653, 608661]",True,2021-05-12 10:56:31.128000,NM,8,10,mp-796,,Nb3Al,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Al': 1.0}",GGA,mp-796,"['mp-911586', 'mp-927906', 'mp-796', 'mp-927472', 'mp-1260512', 'mp-1440919', 'mp-1686893', 'mp-1927652', 'mp-1591599', 'mp-1587739']",0.16323955,"{'Nb': 6.0, 'Al': 2.0}",141.8490379078192,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0023015954483396,0.16323955,0,0.3264791,MP,data/source/MP/cleaned/cifs/MP-mp-796.cif,True,,data/final/MP/graphs/Al0.9In0.1Nb3-MP-mp-796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
C1Hf0.5Nb0.5,1,0.0,2.0,False,C2Hf1Nb1,C2Hf1Nb1,4.8,Other,True,C50Hf25Nb25,C-Hf-Nb,3,Supercon,C1Hf0.5Nb0.5,MP-mp-1224334,Hf1Nb1C2,C-Hf-Nb,C50Hf25Nb25,R -3 m,trigonal,3.2283724814233605,3.228372481423361,5.61495687,data/final/MP/cifs/C1Hf0.5Nb0.5-MP-mp-1224334.cif,data/source/MP/raw/cifs/mp-1224334.cif,mp-1224334,0.0,,2019-01-13 00:35:56.434000,10.261089831989311,,,{'GGA': {'task_id': 'mp-1767424'}},0.0,6.85563077,520.0,-41.42178362,-10.355445905,{'tags': []},-41.42178362,-10.355445905,-0.7274320824999982,['bandstructure'],True,[],True,2021-05-12 10:58:45.495000,NM,4,5,mp-1224334,,HfNbC2,"{'functional': 'PBE', 'labels': ['Hf_pv', 'Nb_pv', 'C'], 'pot_type': 'paw'}","{'Hf': 1.0, 'Nb': 1.0, 'C': 2.0}",GGA,mp-1224334,"['mp-1224334', 'mp-1414286', 'mp-1767424', 'mp-1793357', 'mp-1609501']",0.0053282,"{'Hf': 1.0, 'Nb': 1.0, 'C': 2.0}",47.80708216089565,[],NM,False,166,0,"[0, 0, 0, 0]",0.0001114521062395,0.0053282,0,0.0053282,MP,data/source/MP/cleaned/cifs/MP-mp-1224334.cif,False,,data/final/MP/graphs/C1Hf0.5Nb0.5-MP-mp-1224334.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ba2Cu1Tl2O6.08,2,0.0065638332786347,1.9736710526315788,False,Ba3.947Cu1.974Tl3.947O12,Ba4Cu2Tl4O12,16.0,Cuprate,True,Ba18.051Cu9.025Tl18.051O54.87364620938629,Ba-Cu-Tl-O,4,Supercon,Tl2Ba2Cu1O6.08,MP-mp-6027,Ba4Tl4Cu2O12,Ba-Cu-Tl-O,Ba18.182Cu9.091Tl18.182O54.54545454545455,C m c a,orthorhombic,5.504110002693673,5.585743,12.28312762,data/final/MP/cifs/Ba2Cu1Tl2O6.08-MP-mp-6027-synth_doped.cif,data/source/MP/raw/cifs/mp-6027.cif,mp-6027,0.0,,2011-05-19 00:05:23,7.606665315628389,10.17188/1277350,"@misc{osti_1277350,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Tl2CuO6 (SG:64) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277350"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1673478'}},0.0059215576010052,4.10961464,520.0,-115.75418737,-5.261553971363636,"{'tags': ['Dithallium dibarium cuprate', 'Dithallium(III) dibarium copper oxide']}",-115.75418737,-5.261553971363636,-1.7862630028787878,"['xas', 'bandstructure']",True,"[202723, 202724, 202722]",True,2021-05-12 10:57:28.836000,NM,22,8,mp-6027,oxide,Ba2Tl2CuO6,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Tl_d', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Tl': 2.0, 'Cu': 1.0, 'O': 6.0}",GGA,mp-6027,"['mp-925246', 'mp-909581', 'mp-924678', 'mp-6027', 'mp-1504634', 'mp-1673478', 'mp-1837163', 'mp-1605186']",2.9e-05,"{'Ba': 4.0, 'Tl': 4.0, 'Cu': 2.0, 'O': 12.0}",368.0385386017736,[],NM,False,64,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.5759219189476614e-07,2.9e-05,0,5.8e-05,MP,data/source/MP/cleaned/cifs/MP-mp-6027.cif,True,,data/final/MP/graphs/Ba2Cu1Tl2O6.08-MP-mp-6027-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ir4Lu2.5Sc2.5Si10,1,0.0,2.0,False,Ir8Lu5Sc5Si20,Ir8Lu5Sc5Si20,7.915,Other,True,Ir21.053Lu13.158Sc13.158Si52.632,Ir-Lu-Sc-Si,4,Supercon,Lu2.5Sc2.5Ir4Si10,MP-mp-1222705,Lu5Sc5Si20Ir8,Ir-Lu-Sc-Si,Ir21.053Lu13.158Sc13.158Si52.632,A m m 2,orthorhombic,4.166219,12.48801631,12.48801631,data/final/MP/cifs/Ir4Lu2.5Sc2.5Si10-MP-mp-1222705.cif,data/source/MP/raw/cifs/mp-1222705.cif,mp-1222705,0.0,,2019-01-12 23:12:10.840000,8.176031432166369,,,,0.0184141923684206,7.3489303,520.0,-265.85059347,-6.996068249210526,{'tags': []},-265.85059347,-6.996068249210526,-0.8144676732894723,[],False,[],True,2021-05-12 11:00:49.659000,NM,38,4,mp-1222705,,Lu5Sc5(Si5Ir2)4,"{'functional': 'PBE', 'labels': ['Lu_3', 'Sc_sv', 'Si', 'Ir'], 'pot_type': 'paw'}","{'Lu': 5.0, 'Sc': 5.0, 'Si': 20.0, 'Ir': 8.0}",GGA,mp-1222705,"['mp-1222705', 'mp-1237041', 'mp-1362299', 'mp-1888051']",0.0048667,"{'Lu': 5.0, 'Sc': 5.0, 'Si': 20.0, 'Ir': 8.0}",649.7241455555084,[],NM,False,38,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",7.490409635059837e-06,0.0048667,0,0.0048667,MP,data/source/MP/cleaned/cifs/MP-mp-1222705.cif,False,,data/final/MP/graphs/Ir4Lu2.5Sc2.5Si10-MP-mp-1222705.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Ba1S3V1,1,0.0,2.0,False,Ba2S6V2,Ba2S6V2,0.0,Other,True,Ba20S60V20,Ba-S-V,3,Supercon,Ba1V1S3,MP-mp-3451,Ba2V2S6,Ba-S-V,Ba20S60V20,C m c 21,orthorhombic,5.656075,6.75630834,6.75630834,data/final/MP/cifs/Ba1S3V1-MP-mp-3451.cif,data/source/MP/raw/cifs/mp-3451.cif,mp-3451,0.0,,2011-05-13 22:56:51,4.193676611513987,10.17188/1206846,"@misc{osti_1206846,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BaVS3 (SG:36) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1206846"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-918783'}},0.0,4.44651932,520.0,-60.50749342,-6.0507493420000005,"{'tags': ['Barium trithiovanadate(IV) - LT', 'Barium vanadium(IV) sulfide', 'Barium trithiovanadate(IV))']}",-60.50749342,-6.0507493420000005,-1.670104041875001,"['xas', 'bandstructure']",True,"[154184, 154183, 63229, 52692, 154182, 616099]",True,2021-05-12 10:57:06.958000,FM,10,9,mp-3451,,BaVS3,"{'functional': 'PBE', 'labels': ['Ba_sv', 'V_pv', 'S'], 'pot_type': 'paw'}","{'Ba': 1.0, 'V': 1.0, 'S': 3.0}",GGA,mp-3451,"['mp-919779', 'mp-905795', 'mp-918783', 'mp-3451', 'mp-1116287', 'mp-1416069', 'mp-1695102', 'mp-1862640', 'mp-1593773']",0.71868475,"{'Ba': 2.0, 'V': 2.0, 'S': 6.0}",225.2738103242721,[],FM,True,36,1,"[0.0, 0.0, 0.8, 0.8, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0063805441827923,0.71868475,2,1.4373695,MP,data/source/MP/cleaned/cifs/MP-mp-3451.cif,False,,data/final/MP/graphs/Ba1S3V1-MP-mp-3451.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Bi1Ca0.7Cu2Pb1Sr2Y0.3O8,3,0.0266666666666666,4.0,False,Bi4Ca2.8Cu8Pb4Sr8Y1.2O32,Bi4Ca2Cu8Pb4Sr8Y2O32,75.0,Cuprate,True,Bi6.667Ca4.667Cu13.333Pb6.667Sr13.333Y2O53.333333333333336,Bi-Ca-Cu-Pb-Sr-Y-O,7,Supercon,Bi1Pb1Sr2Y0.3Ca0.7Cu2O8,MP-mp-1218870,Sr8Ca2Y2Cu8Bi4Pb4O32,Bi-Ca-Cu-Pb-Sr-Y-O,Bi6.667Ca3.333Cu13.333Pb6.667Sr13.333Y3.333O53.333333333333336,P 1 2/c 1,monoclinic,5.393147,5.46205321,31.57964053,data/final/MP/cifs/Bi1Ca0.7Cu2Pb1Sr2Y0.3O8-MP-mp-1218870-synth_doped.cif,data/source/MP/raw/cifs/mp-1218870.cif,mp-1218870,0.0,,2019-01-12 19:58:05.080000,6.504642892556258,,,,0.0174792517343735,3.51648169,520.0,-359.0010128,-5.983350213333334,{'tags': []},-359.0010128,-5.983350213333334,-2.1497632024444444,[],False,[],True,2021-05-12 11:00:42.526000,NM,60,2,mp-1218870,oxide,Sr4CaYCu4Bi2(PbO8)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Y_sv', 'Cu_pv', 'Bi', 'Pb_d', 'O'], 'pot_type': 'paw'}","{'Sr': 4.0, 'Ca': 1.0, 'Y': 1.0, 'Cu': 4.0, 'Bi': 2.0, 'Pb': 2.0, 'O': 16.0}",GGA,mp-1218870,"['mp-1218870', 'mp-1894487']",0.0660297,"{'Sr': 8.0, 'Ca': 2.0, 'Y': 2.0, 'Cu': 8.0, 'Bi': 4.0, 'Pb': 4.0, 'O': 32.0}",930.2587864724716,[],NM,False,13,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001419598523769,0.0660297,0,0.1320594,MP,data/source/MP/cleaned/cifs/MP-mp-1218870.cif,True,,data/final/MP/graphs/Bi1Ca0.7Cu2Pb1Sr2Y0.3O8-MP-mp-1218870-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,1,0,0,0,1.0,False
Cr3P1,1,0.0,4.0,False,Cr12P4,Cr12P4,0.0,Other,True,Cr75P25,Cr-P,2,Supercon,Cr3P1,MP-mp-7806,Cr12P4,Cr-P,Cr75P25,I -4,tetragonal,4.496333998887737,6.812610168845308,6.81261017,data/final/MP/cifs/Cr3P1-MP-mp-7806.cif,data/source/MP/raw/cifs/mp-7806.cif,mp-7806,0.0,,2011-06-07 21:49:58,6.678066804759648,10.17188/1307129,"@misc{osti_1307129,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Cr3P (SG:82) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1307129"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678236'}},0.0,8.42570271,520.0,-142.92372229,-8.932732643125,{'tags': ['Chromium phosphide (3/1)']},-142.92372229,-8.932732643125,-0.3396214139583335,['bandstructure'],True,"[291337, 626511, 626503, 626509, 23560]",True,2021-05-12 10:59:07.834000,NM,16,9,mp-7806,,Cr3P,"{'functional': 'PBE', 'labels': ['Cr_pv', 'P'], 'pot_type': 'paw'}","{'Cr': 3.0, 'P': 1.0}",GGA,mp-7806,"['mp-943210', 'mp-932959', 'mp-942191', 'mp-7806', 'mp-1105191', 'mp-1383010', 'mp-1678236', 'mp-1835787', 'mp-1600579']",0.000644725,"{'Cr': 12.0, 'P': 4.0}",185.9566949535869,[],NM,False,82,0,"[-0.0, -0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",1.3868282616249276e-05,0.000644725,0,0.0025789,MP,data/source/MP/cleaned/cifs/MP-mp-7806.cif,False,,data/final/MP/graphs/Cr3P1-MP-mp-7806.json,0,True,-4,0,0,0,0,2,0,0,0,0,1,0,1.0,False
Ge13Os4Y3,1,0.0,2.0,False,Ge26Os8Y6,Ge26Os8Y6,3.9,Other,True,Ge65Os20Y15,Ge-Os-Y,3,Supercon,Y3Os4Ge13,MP-mp-1198205,Y6Ge26Os8,Ge-Os-Y,Ge65Os20Y15,P m -3 n,cubic,9.0934,9.0934,9.0934,data/final/MP/cifs/Ge13Os4Y3-MP-mp-1198205.cif,data/source/MP/raw/cifs/mp-1198205.cif,mp-1198205,0.0,,2019-01-12 03:02:00.957000,8.70959116088354,,,,0.0,4.84806071,520.0,-262.4765163,-6.5619129075,"{'tags': ['Yttrium osmium germanide (3/4/13)', 'Yb3Rh4Sn13', 'Y3Os4Ge13']}",-262.4765163,-6.5619129075,-0.3415008837500004,[],False,[637488],True,2021-05-12 11:00:03.538000,NM,40,3,mp-1198205,,Y3Ge13Os4,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ge_d', 'Os_pv'], 'pot_type': 'paw'}","{'Y': 3.0, 'Ge': 13.0, 'Os': 4.0}",GGA,mp-1198205,"['mp-1198205', 'mp-1366924', 'mp-1892472']",0.0039324,"{'Y': 6.0, 'Ge': 26.0, 'Os': 8.0}",751.9325509005042,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.0459448777129308e-05,0.0039324,0,0.0078648,MP,data/source/MP/cleaned/cifs/MP-mp-1198205.cif,False,,data/final/MP/graphs/Ge13Os4Y3-MP-mp-1198205.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
La0.75Pb3Pr0.25,3,0.125,1.0,True,La0.75Pb3Pr0.25,La1Pb3,0.8,Other,True,La18.75Pb75Pr6.25,La-Pb-Pr,3,Supercon,La0.75Pr0.25Pb3,MP-mp-21432,La1Pb3,La-Pb,La25Pb75,P m -3 m,cubic,4.968277,4.968277,4.968277,data/final/MP/cifs/La0.75Pb3Pr0.25-MP-mp-21432-synth_doped.cif,data/source/MP/raw/cifs/mp-21432.cif,mp-21432,0.0,,2014-02-21 08:53:02,10.297552988886016,10.17188/1196890,"@misc{osti_1196890,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaPb3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196890"",
    place = ""United States"",
    year = ""2016"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687535'}},0.0,7.94036935,520.0,-17.86283558,-4.465708895,{'tags': ['Lanthanum lead (1/3)']},-17.86283558,-4.465708895,-0.447221816249999,"['xas', 'elasticity', 'bandstructure']",True,"[641644, 104691, 641647, 641640, 104692, 151360]",True,2021-05-12 10:56:16.728000,NM,4,8,mp-21432,,LaPb3,"{'functional': 'PBE', 'labels': ['La', 'Pb_d'], 'pot_type': 'paw'}","{'La': 1.0, 'Pb': 3.0}",GGA,mp-21432,"['mp-993074', 'mp-991107', 'mp-21432', 'mp-1439281', 'mp-1687535', 'mp-1784789', 'mp-994394', 'mp-1589043']",0.0017048,"{'La': 1.0, 'Pb': 3.0}",122.63583830653424,[],NM,False,221,0,"[0, 0, 0, 0]",1.3901319740961604e-05,0.0017048,0,0.0017048,MP,data/source/MP/cleaned/cifs/MP-mp-21432.cif,True,,data/final/MP/graphs/La0.75Pb3Pr0.25-MP-mp-21432-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
P0.95Zr1,2,0.0256410256410256,1.0,True,P0.95Zr1,P1Zr1,4.6,Other,True,P48.718Zr51.282,P-Zr,2,Supercon,P0.95Zr1,MP-mp-930,Zr1P1,P-Zr,P50Zr50,F m -3 m,cubic,3.74816374,3.74816374,3.74816374,data/final/MP/cifs/P0.95Zr1-MP-mp-930-synth_doped.cif,data/source/MP/raw/cifs/mp-930.cif,mp-930,0.0,,2011-05-12 17:59:10,5.449688528138726,10.17188/1313121,"@misc{osti_1313121,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrP (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1313121"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1673432'}},0.0429869912500002,6.87100048,520.0,-16.62322252,-8.31161126,{'tags': ['Zirconium phosphide (1/1)']},-16.62322252,-8.31161126,-1.3311096916666667,"['xas', 'elasticity', 'bandstructure']",True,"[648314, 77861]",True,2021-05-12 10:56:35.166000,NM,2,8,mp-930,,ZrP,"{'functional': 'PBE', 'labels': ['Zr_sv', 'P'], 'pot_type': 'paw'}","{'Zr': 1.0, 'P': 1.0}",GGA,mp-930,"['mp-1000936', 'mp-1007381', 'mp-930', 'mp-1439154', 'mp-1673432', 'mp-1791844', 'mp-1012140', 'mp-1588377']",7.12e-05,"{'Zr': 1.0, 'P': 1.0}",37.23408349016082,[],NM,False,225,0,"[0, 0]",1.912226469031116e-06,7.12e-05,0,7.12e-05,MP,data/source/MP/cleaned/cifs/MP-mp-930.cif,True,,data/final/MP/graphs/P0.95Zr1-MP-mp-930-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Fe1,1,0.0,1.0,True,Fe1,Fe1,1.0,Other,True,Fe100,Fe,1,Supercon,Fe1,MP-mp-1271562,Fe4,Fe,Fe100,I 4/m m m,tetragonal,2.4526872400000004,2.4526872,2.471224809534501,data/final/MP/cifs/Fe1-MP-mp-1271562.cif,data/source/MP/raw/cifs/mp-1271562.cif,mp-1271562,0.0,,2020-02-17 05:24:18.913000,8.109373819647873,,,,0.0170570950000001,5.23954351,520.0,-33.81180542,-8.452951355,{'tags': []},-33.81180542,-8.452951355,0.0170570950000001,[],False,[],True,2021-05-12 11:01:17.921000,FM,4,5,mp-1271562,,Fe,"{'functional': 'PBE', 'labels': ['Fe_pv'], 'pot_type': 'paw'}",{'Fe': 1.0},GGA,mp-1271562,"['mp-1271068', 'mp-1271218', 'mp-1271671', 'mp-1271562', 'mp-1794171']",2.2024392,{'Fe': 4.0},45.74104301350541,[],FM,True,69,1,[2.2],0.1926006977453236,2.2024392,1,8.8097568,MP,data/source/MP/cleaned/cifs/MP-mp-1271562.cif,False,,data/final/MP/graphs/Fe1-MP-mp-1271562.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As0.5In1Te0.5,1,0.0,2.0,False,As1In2Te1,As1In2Te1,0.44,Other,True,As25In50Te25,As-In-Te,3,Supercon,As0.5In1Te0.5,MP-mp-1224061,In2Te1As1,As-In-Te,As25In50Te25,P -4 m 2,tetragonal,4.701115,4.701115,6.583608,data/final/MP/cifs/As0.5In1Te0.5-MP-mp-1224061.cif,data/source/MP/raw/cifs/mp-1224061.cif,mp-1224061,0.0,,2019-01-13 00:21:55.906000,4.932028049459638,,,{'GGA': {'task_id': 'mp-1734835'}},0.116332665000006,4.37301654,520.0,-13.87548332,-3.46887083,{'tags': []},-13.87548332,-3.46887083,-0.2479241312500004,['bandstructure'],True,[],True,2021-05-12 10:58:45.495000,NM,4,5,mp-1224061,,In2TeAs,"{'functional': 'PBE', 'labels': ['In_d', 'Te', 'As'], 'pot_type': 'paw'}","{'In': 2.0, 'Te': 1.0, 'As': 1.0}",GGA,mp-1224061,"['mp-1224061', 'mp-1446429', 'mp-1734835', 'mp-1780936', 'mp-1625098']",0.0036186,"{'In': 2.0, 'Te': 1.0, 'As': 1.0}",145.50091170035404,[],NM,False,115,0,"[0, 0, 0, 0]",2.4869947258146253e-05,0.0036186,0,0.0036186,MP,data/source/MP/cleaned/cifs/MP-mp-1224061.cif,False,,data/final/MP/graphs/As0.5In1Te0.5-MP-mp-1224061.json,0,True,-42m,0,0,0,0,6,0,0,1,0,0,0,1.0,False
Ca1Pb1,1,0.0,1.0,True,Ca1Pb1,Ca1Pb1,7.0,Other,True,Ca50Pb50,Ca-Pb,2,Supercon,Ca1Pb1,MP-mp-20034,Ca1Pb1,Ca-Pb,Ca50Pb50,P 4/m m m,tetragonal,3.612159,3.612159,4.638609,data/final/MP/cifs/Ca1Pb1-MP-mp-20034.cif,data/source/MP/raw/cifs/mp-20034.cif,mp-20034,0.0,,2014-02-21 10:39:18,6.784425736643719,10.17188/1195201,"@misc{osti_1195201,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CaPb (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195201"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-928222'}},0.0,5.25123168,520.0,-6.76001093,-3.380005465,{'tags': ['Calcium lead (1/1)']},-6.76001093,-3.380005465,-0.5208819899999999,"['xas', 'elasticity', 'bandstructure']",True,"[619484, 58918, 191273]",True,2021-05-12 10:56:14.760000,NM,2,11,mp-20034,,CaPb,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Pb_d'], 'pot_type': 'paw'}","{'Ca': 1.0, 'Pb': 1.0}",GGA,mp-20034,"['mp-928222', 'mp-928750', 'mp-912164', 'mp-20034', 'mp-1059970', 'mp-1059942', 'mp-1060023', 'mp-1439595', 'mp-1927540', 'mp-1589540', 'mp-1060003']",0.000888,"{'Ca': 1.0, 'Pb': 1.0}",60.52314451507982,[],NM,False,123,0,"[0, 0]",1.467207309062978e-05,0.000888,0,0.000888,MP,data/source/MP/cleaned/cifs/MP-mp-20034.cif,False,,data/final/MP/graphs/Ca1Pb1-MP-mp-20034.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Pt3Th7,1,0.0,2.0,False,Pt6Th14,Pt6Th14,0.49,Other,True,Pt30Th70,Pt-Th,2,Supercon,Pt3Th7,MP-mp-569074,Th14Pt6,Pt-Th,Pt30Th70,P 63 m c,hexagonal,6.463049,10.077857998081694,10.07785796,data/final/MP/cifs/Pt3Th7-MP-mp-569074.cif,data/source/MP/raw/cifs/mp-569074.cif,mp-569074,0.0,,2014-02-24 14:29:52,12.908392789242765,10.17188/1274921,"@misc{osti_1274921,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Th7Pt3 (SG:186) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1274921"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1734700'}},0.0,7.45597568,520.0,-154.98959574,-7.749479787,{'tags': ['Thorium platinum (7/3)']},-154.98959574,-7.749479787,-0.7385066989999999,"['xas', 'bandstructure']",True,"[649758, 150671]",True,2021-05-12 10:57:24.969000,NM,20,8,mp-569074,,Th7Pt3,"{'functional': 'PBE', 'labels': ['Th', 'Pt'], 'pot_type': 'paw'}","{'Th': 7.0, 'Pt': 3.0}",GGA,mp-569074,"['mp-914548', 'mp-977924', 'mp-569074', 'mp-1105885', 'mp-1382061', 'mp-1734700', 'mp-1880677', 'mp-1612712']",0.0211116,"{'Th': 14.0, 'Pt': 6.0}",568.4660692754667,[],NM,False,186,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",7.427567322323248e-05,0.0211116,0,0.0422232,MP,data/source/MP/cleaned/cifs/MP-mp-569074.cif,False,,data/final/MP/graphs/Pt3Th7-MP-mp-569074.json,0,True,6mm,0,5,0,0,0,0,0,1,0,0,0,1.0,False
C0.978Mg1Ni3,2,0.0070711128967457,1.0,True,C0.978Mg1Ni3,C1Mg1Ni3,7.3,Other,True,C19.646Mg20.088Ni60.265,C-Mg-Ni,3,Supercon,Mg1C0.978Ni3,MP-mp-10700,Mg1Ni3C1,C-Mg-Ni,C20Mg20Ni60,P m -3 m,cubic,3.810209,3.810209,3.810209,data/final/MP/cifs/C0.978Mg1Ni3-MP-mp-10700-synth_doped.cif,data/source/MP/raw/cifs/mp-10700.cif,mp-10700,0.0,,2011-05-28 10:04:44,6.376007671789427,10.17188/1187303,"@misc{osti_1187303,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MgNi3C (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187303"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678621'}},0.0,6.64260176,520.0,-28.85099542,-5.770199084,{'tags': ['Magnesium nickel carbide (1/3/1)']},-28.85099542,-5.770199084,-0.1367049259999994,"['xas', 'elasticity', 'bandstructure']",True,[77152],True,2021-05-12 10:56:10.715000,NM,5,8,mp-10700,,MgNi3C,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Ni_pv', 'C'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",GGA,mp-10700,"['mp-927245', 'mp-927653', 'mp-911184', 'mp-10700', 'mp-1438083', 'mp-1678621', 'mp-1791467', 'mp-1591421']",0.0387875,"{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",55.31544309398296,[],NM,False,221,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",0.0007012056277683,0.0387875,0,0.0387875,MP,data/source/MP/cleaned/cifs/MP-mp-10700.cif,True,,data/final/MP/graphs/C0.978Mg1Ni3-MP-mp-10700-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
As1F0.175Fe1Nd1O0.825,3,0.0875,2.0,False,As2F0.35Fe2Nd2O1.65,As2Fe2Nd2O2,53.0,Ferrite,True,As25F4.375Fe25Nd25O20.625,As-F-Fe-Nd-O,5,Supercon,Nd1Fe1As1F0.175O0.825,MP-mp-622621,Nd2Fe2As2O2,As-Fe-Nd-O,As25Fe25Nd25O25,P 4/n m m,tetragonal,4.074653,4.074653,9.170967,data/final/MP/cifs/As1F0.175Fe1Nd1O0.825-MP-mp-622621-synth_doped.cif,data/source/MP/raw/cifs/mp-622621.cif,mp-622621,0.0,,2014-02-16 22:28:25,6.347279619112142,10.17188/1278150,"@misc{osti_1278150,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NdFeAsO (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278150"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-1677677'}},0.2809314202083302,3.74777613,520.0,-52.70842543,-6.58855317875,{'tags': ['Neodymium iron arsenic oxide (1/1/1/1)']},-52.70842543,-6.58855317875,-1.61299541125,"['xas', 'bandstructure']",True,"[163547, 164679, 422001, 163546, 236651, 236650, 602466, 164680, 164676]",True,2021-05-12 10:57:28.836000,FM,8,8,mp-622621,oxide,NdFeAsO,"{'functional': 'PBE', 'labels': ['Nd_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Nd': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-622621,"['mp-622621', 'mp-1079381', 'mp-1173401', 'mp-1438697', 'mp-1677677', 'mp-1772072', 'mp-1926310', 'mp-1592869']",3.83954265,"{'Nd': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",152.26370404041757,[],FM,True,129,1,"[0.0, 0.0, 3.6, 3.6, -0.0, -0.0, -0.0, -0.0]",0.0504328024094411,3.83954265,2,7.6790853,MP,data/source/MP/cleaned/cifs/MP-mp-622621.cif,True,,data/final/MP/graphs/As1F0.175Fe1Nd1O0.825-MP-mp-622621-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ge2Pd1.98Pt0.02Sr1,2,0.008,1.0,True,Ge2Pd1.98Pt0.02Sr1,Ge2Pd2Sr1,2.96,Other,True,Ge40Pd39.6Pt0.4Sr20,Ge-Pd-Pt-Sr,4,Supercon,Sr1Pd1.98Pt0.02Ge2,MP-mp-978986,Sr1Ge2Pd2,Ge-Pd-Sr,Ge40Pd40Sr20,I 4/m m m,tetragonal,4.438671999438209,4.438671999438209,6.03054834,data/final/MP/cifs/Ge2Pd1.98Pt0.02Sr1-MP-mp-978986-synth_doped.cif,data/source/MP/raw/cifs/mp-978986.cif,mp-978986,0.0,,2015-10-09 03:56:43,7.295677176868866,10.17188/1316057,"@misc{osti_1316057,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr(GePd)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1316057"",
    place = ""United States"",
    year = ""2016"",
    month = ""9"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688092'}},0.0,4.0155429,520.0,-24.8627221,-4.97254442,"{'tags': ['Strontium palladium germanide (1/2/2)', 'Strontium palladium germanium (1/2/2)', 'High pressure experimental phase']}",-24.8627221,-4.97254442,-0.7134818633333324,"['xas', 'elasticity', 'bandstructure']",True,"[165985, 181157, 181155, 181156, 168133]",True,2021-05-12 10:56:37.246000,NM,5,9,mp-978986,,Sr(GePd)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ge_d', 'Pd'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Ge': 2.0, 'Pd': 2.0}",GGA,mp-978986,"['mp-1005776', 'mp-978986', 'mp-1005866', 'mp-979737', 'mp-1438850', 'mp-1688092', 'mp-1782349', 'mp-1011093', 'mp-1589601']",0.0012593,"{'Sr': 1.0, 'Ge': 2.0, 'Pd': 2.0}",101.45304755163892,[],NM,False,139,0,"[0, 0, 0, 0, 0]",1.2412638460752248e-05,0.0012593,0,0.0012593,MP,data/source/MP/cleaned/cifs/MP-mp-978986.cif,True,,data/final/MP/graphs/Ge2Pd1.98Pt0.02Sr1-MP-mp-978986-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Be13Th0.043U0.957,2,0.0061428571428571,2.0,False,Be26Th0.086U1.914,Be26U2,0.5315,Heavy_fermion,True,Be92.857Th0.307U6.836,Be-Th-U,3,Supercon,U0.957Th0.043Be13,MP-mp-1163,U2Be26,Be-U,Be92.857U7.143,F m -3 c,cubic,7.174675929999999,7.174675929999999,7.174675929999999,data/final/MP/cifs/Be13Th0.043U0.957-MP-mp-1163-synth_doped.cif,data/source/MP/raw/cifs/mp-1163.cif,mp-1163,0.0,,2011-05-15 13:39:09,4.516943134220159,10.17188/1188115,"@misc{osti_1188115,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UBe13 (SG:226) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188115"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1676276'}},0.0,5.60901004,520.0,-121.44122023,-4.337186436785714,"{'tags': ['Uranium beryllium (1/13)', 'Beryllium uranium (13/1)']}",-121.44122023,-4.337186436785714,-0.0583452042857146,"['xas', 'bandstructure']",True,"[616470, 58748, 616481, 58747, 58749, 659562, 107528, 600563, 58750, 616488, 58751]",True,2021-05-12 10:56:51.169000,NM,28,8,mp-1163,,UBe13,"{'functional': 'PBE', 'labels': ['U', 'Be_sv'], 'pot_type': 'paw'}","{'U': 1.0, 'Be': 13.0}",GGA,mp-1163,"['mp-1163', 'mp-906858', 'mp-920459', 'mp-921486', 'mp-1381018', 'mp-1676276', 'mp-1775695', 'mp-1603627']",0.0460573,"{'U': 2.0, 'Be': 26.0}",261.15110606061,[],NM,False,226,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0003527252914587,0.0460573,0,0.0921146,MP,data/source/MP/cleaned/cifs/MP-mp-1163.cif,True,,data/final/MP/graphs/Be13Th0.043U0.957-MP-mp-1163-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ce0.21Cu1Sm1.79O4,3,0.0599999999999999,1.0,True,Ce0.21Cu1Sm1.79O4,Cu1Sm2O4,0.0,Cuprate,True,Ce3Cu14.286Sm25.571O57.142857142857146,Ce-Cu-Sm-O,4,Supercon,Sm1.79Ce0.21Cu1O4,MP-mp-4210,Sm2Cu1O4,Cu-Sm-O,Cu14.286Sm28.571O57.142857142857146,I 4/m m m,tetragonal,3.936481999770292,3.936481999770292,6.66682973,data/final/MP/cifs/Ce0.21Cu1Sm1.79O4-MP-mp-4210-synth_doped.cif,data/source/MP/raw/cifs/mp-4210.cif,mp-4210,0.0,,2011-05-13 10:20:22,7.575626216473968,10.17188/1207966,"@misc{osti_1207966,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sm2CuO4 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207966"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-670158'}},0.0084157301785579,3.24265454,520.0,-51.71666507,-7.38809501,"{'tags': ['Samarium cuprate', 'Disamarium copper oxide', 'Disamarium copper tetraoxide']}",-51.71666507,-7.38809501,-3.0194917299999995,"['xas', 'elasticity', 'bandstructure']",True,"[261378, 72243, 71182, 95371, 261377]",True,2021-05-12 10:56:20.740000,NM,7,8,mp-4210,oxide,Sm2CuO4,"{'functional': 'PBE', 'labels': ['Sm_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sm': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-4210,"['mp-660482', 'mp-670158', 'mp-4210', 'mp-1412888', 'mp-1702500', 'mp-1798108', 'mp-1589420', 'mp-688388']",0.0004776,"{'Sm': 2.0, 'Cu': 1.0, 'O': 4.0}",93.8732216032902,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",5.087712894507291e-06,0.0004776,0,0.0004776,MP,data/source/MP/cleaned/cifs/MP-mp-4210.cif,True,,data/final/MP/graphs/Ce0.21Cu1Sm1.79O4-MP-mp-4210-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Pb0.987Te1Tl0.013,2,0.013,1.0,True,Pb0.987Te1Tl0.013,Pb1Te1,1.32,Other,True,Pb49.35Te50Tl0.65,Pb-Te-Tl,3,Supercon,Pb0.987Tl0.013Te1,MP-mp-19717,Te1Pb1,Pb-Te,Pb50Te50,F m -3 m,cubic,4.64263261,4.64263261,4.64263261,data/final/MP/cifs/Pb0.987Te1Tl0.013-MP-mp-19717-synth_doped.cif,data/source/MP/raw/cifs/mp-19717.cif,mp-19717,1.0581999999999994,,2013-09-21 09:56:54,7.856997090559908,10.17188/1194927,"@misc{osti_1194927,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TePb (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1194927"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686920'}},0.0,4.9735213,520.0,-7.66743933,-3.833719665,"{'tags': ['Altaite', 'Lead telluride (1/1)', 'High pressure experimental phase', 'Lead telluride']}",-7.66743933,-3.833719665,-0.6167456649999998,"['eos', 'xas', 'bandstructure', 'diel', 'phonons', 'elasticity']",True,"[194220, 648583, 648588, 648607, 63099, 648584, 648590, 604178, 648595, 96500, 648608, 648596, 648597, 182660, 648599, 648593, 648603, 96504, 648591, 648586, 96506, 600843, 600522, 648614, 182662, 648606, 186788, 96505, 153711, 648581, 648605, 648587, 248494, 648585, 190437, 648600, 648617, 602956, 38295, 648589, 648615, 63098, 648592, 290707, 648612, 648594, 182661, 648616, 248495, 648613]",True,2021-05-12 10:56:14.760000,NM,2,34,mp-19717,,TePb,"{'functional': 'PBE', 'labels': ['Te', 'Pb_d'], 'pot_type': 'paw'}","{'Te': 1.0, 'Pb': 1.0}",GGA,mp-19717,"['mp-658057', 'mp-655294', 'mp-656827', 'mp-19717', 'mp-1056883', 'mp-1056867', 'mp-1056875', 'mp-1059285', 'mp-1059296', 'mp-1059300', 'mp-1059866', 'mp-1059872', 'mp-1059851', 'mp-1060231', 'mp-1060244', 'mp-1060254', 'mp-1061267', 'mp-1061381', 'mp-1061396', 'mp-1061412', 'mp-1061239', 'mp-1061250', 'mp-1142129', 'mp-1440755', 'mp-1686920', 'mp-1801248', 'mp-1594316', 'mp-1595339', 'mp-1059310', 'mp-1060260', 'mp-1061273', 'mp-1061416', 'mp-1056891', 'mp-1059878']",0.0014838,"{'Te': 1.0, 'Pb': 1.0}",70.75839192630549,[],NM,False,225,0,"[0, 0]",2.096995083700277e-05,0.0014838,0,0.0014838,MP,data/source/MP/cleaned/cifs/MP-mp-19717.cif,True,,data/final/MP/graphs/Pb0.987Te1Tl0.013-MP-mp-19717-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
La1Pd0.8Sb2,3,0.0789473684210526,2.0,False,La2Pd1.6Sb4,La2Pd2Sb4,3.25,Other,True,La26.316Pd21.053Sb52.632,La-Pd-Sb,3,Supercon,La1Pd0.8Sb2,MP-mp-1078519,La2Sb4Pd2,La-Pd-Sb,La25Pd25Sb50,P 4/n m m,tetragonal,4.566829,4.566829,10.045954,data/final/MP/cifs/La1Pd0.8Sb2-MP-mp-1078519-synth_doped.cif,data/source/MP/raw/cifs/mp-1078519.cif,mp-1078519,0.0,,2018-04-11 18:33:42,7.748720616927392,,,{'GGA': {'task_id': 'mp-1704095'}},0.0,7.60803076,520.0,-43.90140433,-5.48767554125,{'tags': ['Palladium lanthanum antimonide (1/1/2)']},-43.90140433,-5.48767554125,-0.9902026924999996,['bandstructure'],True,[658217],True,2021-05-12 10:58:14.654000,NM,8,5,mp-1078519,,LaSb2Pd,"{'functional': 'PBE', 'labels': ['La', 'Sb', 'Pd'], 'pot_type': 'paw'}","{'La': 1.0, 'Sb': 2.0, 'Pd': 1.0}",GGA,mp-1078519,"['mp-1078519', 'mp-1420314', 'mp-1704095', 'mp-1789408', 'mp-1602377']",0.00062085,"{'La': 2.0, 'Sb': 4.0, 'Pd': 2.0}",209.5176844270638,[],NM,False,129,0,"[0, 0, 0, 0, 0, 0, 0, 0]",5.92646870547223e-06,0.00062085,0,0.0012417,MP,data/source/MP/cleaned/cifs/MP-mp-1078519.cif,True,,data/final/MP/graphs/La1Pd0.8Sb2-MP-mp-1078519-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Br1.75C2Cl0.25Y2,3,0.0833333333333333,1.0,True,Br1.75C2Cl0.25Y2,Br2C2Y2,4.7,Other,True,Br29.167C33.333Cl4.167Y33.333,Br-C-Cl-Y,4,Supercon,Y2Br1.75Cl0.25C2,MP-mp-643367,Y2C2Br2,Br-C-Y,Br33.333C33.333Y33.333,C 1 2/m 1,monoclinic,3.846773999724948,4.02928774,10.04420137,data/final/MP/cifs/Br1.75C2Cl0.25Y2-MP-mp-643367-synth_doped.cif,data/source/MP/raw/cifs/mp-643367.cif,mp-643367,0.0,,2013-06-28 23:28:36,4.453038714645779,10.17188/1280298,"@misc{osti_1280298,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YCBr (SG:12) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1280298"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698781'}},0.0,3.4577348,520.0,-41.14365364,-6.857275606666666,{'tags': ['Yttrium bromide carbide (2/2/2)']},-41.14365364,-6.857275606666666,-1.2585473713888884,"['xas', 'elasticity', 'bandstructure']",True,[78871],True,2021-05-12 10:56:27.046000,NM,6,11,mp-643367,,YCBr,"{'functional': 'PBE', 'labels': ['Y_sv', 'C', 'Br'], 'pot_type': 'paw'}","{'Y': 1.0, 'C': 1.0, 'Br': 1.0}",GGA,mp-643367,"['mp-643367', 'mp-1002327', 'mp-1003939', 'mp-1048935', 'mp-1048950', 'mp-1423619', 'mp-1698781', 'mp-1779867', 'mp-1009265', 'mp-1593059', 'mp-1048942']",0.0169429,"{'Y': 2.0, 'C': 2.0, 'Br': 2.0}",134.8560417099284,[],NM,False,12,0,"[0, 0, 0, 0, 0, 0]",0.000251273873757,0.0169429,0,0.0338858,MP,data/source/MP/cleaned/cifs/MP-mp-643367.cif,True,,data/final/MP/graphs/Br1.75C2Cl0.25Y2-MP-mp-643367-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
Co0.3Ni0.7Zr2,3,0.1333333333333333,2.0,False,Co0.6Ni1.4Zr4,Co1Ni1Zr4,1.87,Other,True,Co10Ni23.333Zr66.667,Co-Ni-Zr,3,Supercon,Zr2Co0.3Ni0.7,MP-mp-1215379,Zr4Co1Ni1,Co-Ni-Zr,Co16.667Ni16.667Zr66.667,I 4 2 2,tetragonal,5.30408692094024,5.30408692,5.30408692,data/final/MP/cifs/Co0.3Ni0.7Zr2-MP-mp-1215379-synth_doped.cif,data/source/MP/raw/cifs/mp-1215379.cif,mp-1215379,0.0,,2019-01-12 17:04:40.863000,7.126495060084947,,,{'GGA': {'task_id': 'mp-1759199'}},0.0060319050000003,4.68660376,520.0,-48.79738245,-8.132897075,{'tags': []},-48.79738245,-8.132897075,-0.286354242500001,['bandstructure'],True,[],True,2021-05-12 10:58:39.488000,NM,6,5,mp-1215379,,Zr4CoNi,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Co', 'Ni_pv'], 'pot_type': 'paw'}","{'Zr': 4.0, 'Co': 1.0, 'Ni': 1.0}",GGA,mp-1215379,"['mp-1215379', 'mp-1385448', 'mp-1759199', 'mp-1802552', 'mp-1624939']",0.0012606,"{'Zr': 4.0, 'Co': 1.0, 'Ni': 1.0}",112.4322142594959,[],NM,False,97,0,"[0.0, 0.0, 0.0, 0.0, -0.0, 0.0]",1.1212089064531888e-05,0.0012606,0,0.0012606,MP,data/source/MP/cleaned/cifs/MP-mp-1215379.cif,True,,data/final/MP/graphs/Co0.3Ni0.7Zr2-MP-mp-1215379-synth_doped.json,0,True,422,0,0,0,0,4,0,0,0,0,1,0,1.0,False
B4Gd0.1Rh4Y0.9,2,0.0222222222222222,2.0,False,B8Gd0.2Rh8Y1.8,B8Rh8Y2,8.66,Other,True,B44.444Gd1.111Rh44.444Y10,B-Gd-Rh-Y,4,Supercon,Y0.9Gd0.1Rh4B4,MP-mp-5984,Y2B8Rh8,B-Rh-Y,B44.444Rh44.444Y11.111,P 42/n m c,tetragonal,5.347098,5.347098,7.470892,data/final/MP/cifs/B4Gd0.1Rh4Y0.9-MP-mp-5984-synth_doped.cif,data/source/MP/raw/cifs/mp-5984.cif,mp-5984,0.0,,2011-05-17 01:51:06,8.454483259902709,10.17188/1277215,"@misc{osti_1277215,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Y(BRh)4 (SG:137) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277215"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1705290'}},0.0126497084259256,6.88552514,520.0,-135.64692549,-7.535940305,"{'tags': ['Yttrium rhodium boride (1/4/4)', 'Rhodium yttrium boride (4/1/4)']}",-135.64692549,-7.535940305,-0.5757992298148148,"['xas', 'bandstructure']",True,"[44569, 615346, 602655, 87283]",True,2021-05-12 10:57:26.891000,NM,18,8,mp-5984,,Y(BRh)4,"{'functional': 'PBE', 'labels': ['Y_sv', 'B', 'Rh_pv'], 'pot_type': 'paw'}","{'Y': 1.0, 'B': 4.0, 'Rh': 4.0}",GGA,mp-5984,"['mp-910312', 'mp-5984', 'mp-926161', 'mp-925748', 'mp-1430442', 'mp-1705290', 'mp-1828135', 'mp-1604702']",0.00010715,"{'Y': 2.0, 'B': 8.0, 'Rh': 8.0}",213.60368753104515,[],NM,False,137,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.0032598335590702e-06,0.00010715,0,0.0002143,MP,data/source/MP/cleaned/cifs/MP-mp-5984.cif,True,,data/final/MP/graphs/B4Gd0.1Rh4Y0.9-MP-mp-5984-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Al0.15Ga0.85Nb3,3,0.075,2.0,False,Al0.3Ga1.7Nb6,Ga2Nb6,17.1,Other,True,Al3.75Ga21.25Nb75,Al-Ga-Nb,3,Supercon,Nb3Ga0.85Al0.15,MP-mp-2670,Nb6Ga2,Ga-Nb,Ga25Nb75,P m -3 n,cubic,5.189021,5.189021,5.189021,data/final/MP/cifs/Al0.15Ga0.85Nb3-MP-mp-2670-synth_doped.cif,data/source/MP/raw/cifs/mp-2670.cif,mp-2670,0.0,,2011-05-14 07:55:50,8.28234811962253,10.17188/1201220,"@misc{osti_1201220,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Ga (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201220"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686575'}},0.0550303606249986,4.96610647,520.0,-68.03986833,-8.50498354125,"{'tags': ['Gallium niobium (1/3)', 'Niobium gallide (3/1)']}",-68.03986833,-8.50498354125,-0.1719807556250003,"['xas', 'elasticity', 'bandstructure']",True,"[634772, 634745, 634746, 634774, 634731, 634748, 634762, 634767, 108484, 634734, 634761, 103831]",True,2021-05-12 10:56:18.721000,NM,8,9,mp-2670,,Nb3Ga,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Ga_d'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Ga': 1.0}",GGA,mp-2670,"['mp-928915', 'mp-912435', 'mp-929292', 'mp-2670', 'mp-1078851', 'mp-1440107', 'mp-1686575', 'mp-1781117', 'mp-1594502']",0.0001134,"{'Nb': 6.0, 'Ga': 2.0}",139.71926259628808,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.6232550600794926e-06,0.0001134,0,0.0002268,MP,data/source/MP/cleaned/cifs/MP-mp-2670.cif,True,,data/final/MP/graphs/Al0.15Ga0.85Nb3-MP-mp-2670-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Tl1,1,0.0,3.0,False,Tl3,Tl3,1.989218182,Other,True,Tl100,Tl,1,Supercon,Tl1,MP-mp-972351,Tl3,Tl,Tl100,R -3 m,trigonal,3.651788378708598,3.651788378708598,8.50182559,data/final/MP/cifs/Tl1-MP-mp-972351.cif,data/source/MP/raw/cifs/mp-972351.cif,mp-972351,0.0,,2015-09-16 00:06:25,10.703955888179133,10.17188/1313812,"@misc{osti_1313812,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Tl (SG:166) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1313812"",
    place = ""United States"",
    year = ""2016"",
    month = ""8"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1732814'}},0.0,5.6689897,520.0,-7.08792944,-2.362643146666666,{'tags': []},-7.08792944,-2.362643146666666,0.0,"['xas', 'bandstructure']",True,[],True,2021-05-12 10:57:55.580000,NM,3,8,mp-972351,,Tl,"{'functional': 'PBE', 'labels': ['Tl_d'], 'pot_type': 'paw'}",{'Tl': 1.0},GGA,mp-972351,"['mp-1005217', 'mp-1005251', 'mp-972351', 'mp-1427672', 'mp-1732814', 'mp-1929187', 'mp-1010810', 'mp-1615820']",0.0009075333333333,{'Tl': 3.0},95.11991391484368,[],NM,False,166,0,"[0, 0, 0]",2.862281816652413e-05,0.0009075333333333,0,0.0027226,MP,data/source/MP/cleaned/cifs/MP-mp-972351.cif,False,,data/final/MP/graphs/Tl1-MP-mp-972351.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
B5Mo1.7Ta0.3,3,0.0857142857142857,1.0,True,B5Mo1.7Ta0.3,B5Mo2,7.0,Other,True,B71.429Mo24.286Ta4.286,B-Mo-Ta,3,Supercon,B5Mo1.7Ta0.3,MP-mp-7229,B5Mo2,B-Mo,B71.429Mo28.571,R -3 m,trigonal,3.086062143206312,3.086062143206312,7.38317517,data/final/MP/cifs/B5Mo1.7Ta0.3-MP-mp-7229-synth_doped.cif,data/source/MP/raw/cifs/mp-7229.cif,mp-7229,0.0,,2011-05-27 17:15:57,6.910597742884047,10.17188/1287525,"@misc{osti_1287525,
    author = ""Persson, Kristin"",
    title = ""Materials Data on B5Mo2 (SG:166) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1287525"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678538'}},0.4354736101190504,10.26159619,520.0,-54.63026953,-7.804324218571429,"{'tags': ['Molybdenum boride (2/5)', 'Molybdenum boride (1/2.5) - epsilon']}",-54.63026953,-7.804324218571429,0.0654250548809522,['bandstructure'],True,"[157530, 614795, 614810, 24282]",True,2021-05-12 10:58:55.498000,NM,7,11,mp-7229,,B5Mo2,"{'functional': 'PBE', 'labels': ['B', 'Mo_pv'], 'pot_type': 'paw'}","{'B': 5.0, 'Mo': 2.0}",GGA,mp-7229,"['mp-1001204', 'mp-7229', 'mp-1007569', 'mp-1077992', 'mp-1078025', 'mp-1078031', 'mp-1441558', 'mp-1678538', 'mp-1793658', 'mp-1012321', 'mp-1593525']",0.0189101,"{'B': 5.0, 'Mo': 2.0}",59.09541989544843,[],NM,False,166,0,"[0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0]",0.0003199926497426,0.0189101,0,0.0189101,MP,data/source/MP/cleaned/cifs/MP-mp-7229.cif,True,,data/final/MP/graphs/B5Mo1.7Ta0.3-MP-mp-7229-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
C1Nb0.1Ti0.9,3,0.0999999999999999,1.0,True,C1Nb0.1Ti0.9,C1Ti1,0.0,Other,True,C50Nb5Ti45,C-Nb-Ti,3,Supercon,C1Nb0.1Ti0.9,MP-mp-631,Ti1C1,C-Ti,C50Ti50,F m -3 m,cubic,3.06576752,3.06576752,3.06576752,data/final/MP/cifs/C1Nb0.1Ti0.9-MP-mp-631-synth_doped.cif,data/source/MP/raw/cifs/mp-631.cif,mp-631,0.0,,2011-05-12 17:27:06,4.879907058924726,10.17188/1279030,"@misc{osti_1279030,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TiC (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1279030"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672261'}},0.0,7.31044973,520.0,-18.74228076,-9.37114038,"{'tags': ['Titanium carbide (1/1)', 'Khamrabaevite', 'Titanium carbide']}",-18.74228076,-9.37114038,-0.810004021666666,"['xas', 'elasticity', 'bandstructure']",True,"[159871, 618935, 618942, 93504, 618941, 618925, 618940, 618932, 618948, 618950, 618926, 26952, 180598, 618944, 151365, 618928, 618934, 618946, 618927, 618945, 618936, 618929, 618951, 181681, 658392, 618931, 618930, 424343, 658339, 181783, 618947, 618933, 192036, 184912, 1546, 618922, 44494]",True,2021-05-12 10:56:27.046000,NM,2,25,mp-631,,TiC,"{'functional': 'PBE', 'labels': ['Ti_pv', 'C'], 'pot_type': 'paw'}","{'Ti': 1.0, 'C': 1.0}",GGA,mp-631,"['mp-919615', 'mp-918624', 'mp-905509', 'mp-631', 'mp-1057920', 'mp-1057881', 'mp-1057898', 'mp-1060446', 'mp-1060380', 'mp-1060866', 'mp-1060882', 'mp-1060888', 'mp-1060404', 'mp-1060916', 'mp-1060937', 'mp-1060964', 'mp-1440902', 'mp-1672261', 'mp-1795312', 'mp-1593670', 'mp-1592621', 'mp-1057913', 'mp-1060945', 'mp-1060434', 'mp-1060923']",4.44e-05,"{'Ti': 1.0, 'C': 1.0}",20.375236427159287,[],NM,False,225,0,"[0, 0]",2.179115818298764e-06,4.44e-05,0,4.44e-05,MP,data/source/MP/cleaned/cifs/MP-mp-631.cif,True,,data/final/MP/graphs/C1Nb0.1Ti0.9-MP-mp-631-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
C2La0.75Ni1Y0.25,3,0.125,1.0,True,C2La0.75Ni1Y0.25,C2La1Ni1,1.65,Other,True,C50La18.75Ni25Y6.25,C-La-Ni-Y,4,Supercon,La0.75Y0.25Ni1C2,MP-mp-1018048,La1Ni1C2,C-La-Ni,C50La25Ni25,A m m 2,orthorhombic,3.82731293,3.82731293,3.977635,data/final/MP/cifs/C2La0.75Ni1Y0.25-MP-mp-1018048-synth_doped.cif,data/source/MP/raw/cifs/mp-1018048.cif,mp-1018048,0.0,,2017-04-06 23:27:44,6.5955568384756855,10.17188/1350127,"@article{osti_1350127,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaNiC2 (SG:38) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1350127"",
    place = ""United States"",
    year = ""2017"",
    month = ""4""
}
",{'GGA': {'task_id': 'mp-1697101'}},0.0,8.87914765,520.0,-30.18892584,-7.54723146,"{'tags': ['LaNiC2', 'Lanthanum nickel carbide (1/1/2)', 'CeNiC2']}",-30.18892584,-7.54723146,-0.2548051637499995,"['bandstructure', 'elasticity']",True,[618179],True,2021-05-12 10:56:08.727000,NM,4,12,mp-1018048,,LaNiC2,"{'functional': 'PBE', 'labels': ['La', 'Ni_pv', 'C'], 'pot_type': 'paw'}","{'La': 1.0, 'Ni': 1.0, 'C': 2.0}",GGA,mp-1018048,"['mp-1018048', 'mp-1018270', 'mp-1018463', 'mp-1067001', 'mp-1067047', 'mp-1067181', 'mp-1115476', 'mp-1412950', 'mp-1697101', 'mp-1783297', 'mp-1594865', 'mp-1067093']",0.005804,"{'La': 1.0, 'Ni': 1.0, 'C': 2.0}",55.79651958097468,[],NM,False,38,0,"[0.0, -0.0, 0.0, 0.0]",0.0001040208250189,0.005804,0,0.005804,MP,data/source/MP/cleaned/cifs/MP-mp-1018048.cif,True,,data/final/MP/graphs/C2La0.75Ni1Y0.25-MP-mp-1018048-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Fe0.2P1Ru0.8Zr1,3,0.1333333333333333,4.0,False,Fe0.8P4Ru3.2Zr4,P4Ru4Zr4,2.6,Other,True,Fe6.667P33.333Ru26.667Zr33.333,Fe-P-Ru-Zr,4,Supercon,Zr1Ru0.8Fe0.2P1,MP-mp-22268,Zr4P4Ru4,P-Ru-Zr,P33.333Ru33.333Zr33.333,P n m a,orthorhombic,3.896771,6.476559,7.378435,data/final/MP/cifs/Fe0.2P1Ru0.8Zr1-MP-mp-22268-synth_doped.cif,data/source/MP/raw/cifs/mp-22268.cif,mp-22268,0.0,,2014-02-22 18:40:36,7.963823777103373,10.17188/1197495,"@misc{osti_1197495,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrPRu (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197495"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677547'}},0.0,7.91938263,520.0,-106.40582437,-8.867152030833333,"{'tags': ['Ruthenium zirconium phosphide (1/1/1)', 'Zirconium ruthenium phosphide (1/1/1)']}",-106.40582437,-8.867152030833333,-1.1220211002777785,"['xas', 'elasticity', 'bandstructure']",True,"[648038, 30727]",True,2021-05-12 10:56:16.728000,NM,12,9,mp-22268,,ZrPRu,"{'functional': 'PBE', 'labels': ['Zr_sv', 'P', 'Ru_pv'], 'pot_type': 'paw'}","{'Zr': 1.0, 'P': 1.0, 'Ru': 1.0}",GGA,mp-22268,"['mp-921696', 'mp-907212', 'mp-920689', 'mp-22268', 'mp-1102635', 'mp-1442687', 'mp-1677547', 'mp-1785321', 'mp-1602314']",3.01e-05,"{'Zr': 4.0, 'P': 4.0, 'Ru': 4.0}",186.21448765818843,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.46566233992512e-07,3.01e-05,0,0.0001204,MP,data/source/MP/cleaned/cifs/MP-mp-22268.cif,True,,data/final/MP/graphs/Fe0.2P1Ru0.8Zr1-MP-mp-22268-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ce1Co0.05Ru1.95,2,0.0333333333333333,2.0,False,Ce2Co0.1Ru3.9,Ce2Ru4,2.4,Heavy_fermion,True,Ce33.333Co1.667Ru65,Ce-Co-Ru,3,Supercon,Ce1Ru1.95Co0.05,MP-mp-607,Ce2Ru4,Ce-Ru,Ce33.333Ru66.667,F d -3 m,cubic,5.35903077,5.35903077,5.35903077,data/final/MP/cifs/Ce1Co0.05Ru1.95-MP-mp-607-synth_doped.cif,data/source/MP/raw/cifs/mp-607.cif,mp-607,0.0,,2011-05-13 22:34:26,10.444470046690055,10.17188/1277529,"@misc{osti_1277529,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeRu2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277529"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686879'}},0.0,8.61419203,520.0,-50.66413619,-8.444022698333333,"{'tags': ['Cerium ruthenium (1/2)', 'Cerium ruthenium hydride (1/2/4)']}",-50.66413619,-8.444022698333333,-0.2833998766666663,"['xas', 'elasticity', 'bandstructure']",True,"[621326, 656077, 621978, 621973, 621980, 621984, 102277, 621972, 621976, 621979, 604113, 621977, 621982, 621983, 102276, 656078]",True,2021-05-12 10:56:27.046000,NM,6,14,mp-607,,CeRu2,"{'functional': 'PBE', 'labels': ['Ce', 'Ru_pv'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Ru': 2.0}",GGA,mp-607,"['mp-928203', 'mp-912221', 'mp-928809', 'mp-607', 'mp-1071462', 'mp-1071593', 'mp-1071613', 'mp-1077792', 'mp-1440763', 'mp-1686879', 'mp-1803198', 'mp-1591928', 'mp-1591642', 'mp-1071635']",1.005e-05,"{'Ce': 2.0, 'Ru': 4.0}",108.82877852828122,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",1.846937939745105e-07,1.005e-05,0,2.01e-05,MP,data/source/MP/cleaned/cifs/MP-mp-607.cif,True,,data/final/MP/graphs/Ce1Co0.05Ru1.95-MP-mp-607-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
As0.2Ba1Sb1.8Ti2O1,3,0.0666666666666666,1.0,True,As0.2Ba1Sb1.8Ti2O1,Ba1Sb2Ti2O1,0.48,Oxide,True,As3.333Ba16.667Sb30Ti33.333O16.666666666666668,As-Ba-Sb-Ti-O,5,Supercon,Ba1Ti2As0.2Sb1.8O1,MP-mp-1070806,Ba1Ti2Sb2O1,Ba-Sb-Ti-O,Ba16.667Sb33.333Ti33.333O16.666666666666668,P 4/m m m,tetragonal,4.113474,4.113474,8.312382,data/final/MP/cifs/As0.2Ba1Sb1.8Ti2O1-MP-mp-1070806-synth_doped.cif,data/source/MP/raw/cifs/mp-1070806.cif,mp-1070806,0.0,,2018-03-22 04:02:04,5.8154485533321445,,,{'GGA': {'task_id': 'mp-1702174'}},0.0,5.89751533,520.0,-39.14932631,-6.524887718333333,{'tags': []},-39.14932631,-6.524887718333333,-1.5507346602777776,['bandstructure'],True,"[430061, 237789, 430060]",True,2021-05-12 10:58:14.654000,NM,6,16,mp-1070806,oxide,BaTi2Sb2O,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ti_pv', 'Sb', 'O'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Ti': 2.0, 'Sb': 2.0, 'O': 1.0}",GGA,mp-1070806,"['mp-1071055', 'mp-1071068', 'mp-1071083', 'mp-1071088', 'mp-1070806', 'mp-1071124', 'mp-1070846', 'mp-1070900', 'mp-1071137', 'mp-1423542', 'mp-1702174', 'mp-1785425', 'mp-1588663', 'mp-1070899', 'mp-1071129', 'mp-1071119']",0.001055,"{'Ba': 1.0, 'Ti': 2.0, 'Sb': 2.0, 'O': 1.0}",140.65105900950408,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0]",7.500832254158225e-06,0.001055,0,0.001055,MP,data/source/MP/cleaned/cifs/MP-mp-1070806.cif,True,,data/final/MP/graphs/As0.2Ba1Sb1.8Ti2O1-MP-mp-1070806-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Re2Y1,1,0.0,4.0,False,Re8Y4,Re8Y4,1.83,Other,True,Re66.667Y33.333,Re-Y,2,Supercon,Re2Y1,MP-mp-570923,Y4Re8,Re-Y,Re66.667Y33.333,P 63/m m c,hexagonal,5.438966003235356,5.43896624,8.857122,data/final/MP/cifs/Re2Y1-MP-mp-570923.cif,data/source/MP/raw/cifs/mp-570923.cif,mp-570923,0.0,,2014-02-16 05:30:52,13.503777057126308,10.17188/1276003,"@misc{osti_1276003,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YRe2 (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1276003"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697141'}},0.0,5.65038246,520.0,-128.04078153,-10.6700651275,"{'tags': ['Yttrium rhenium (1/2)', 'Rhenium yttrium (2/1)']}",-128.04078153,-10.6700651275,-0.2182232997222222,"['xas', 'elasticity', 'bandstructure']",True,"[150517, 650202]",True,2021-05-12 10:56:27.046000,NM,12,9,mp-570923,,YRe2,"{'functional': 'PBE', 'labels': ['Y_sv', 'Re_pv'], 'pot_type': 'paw'}","{'Y': 1.0, 'Re': 2.0}",GGA,mp-570923,"['mp-914512', 'mp-1001396', 'mp-570923', 'mp-1103175', 'mp-1415857', 'mp-1697141', 'mp-1927082', 'mp-1007838', 'mp-1601976']",0.0003852,"{'Y': 4.0, 'Re': 8.0}",226.9112204333356,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.7903208887489656e-06,0.0003852,0,0.0015408,MP,data/source/MP/cleaned/cifs/MP-mp-570923.cif,False,,data/final/MP/graphs/Re2Y1-MP-mp-570923.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ni1P1,1,0.0,8.0,False,Ni8P8,Ni8P8,0.0,Ferrite,True,Ni50P50,Ni-P,2,Supercon,Ni1P1,MP-mp-27844,Ni8P8,Ni-P,Ni50P50,P b c a,orthorhombic,4.876484,6.026122,6.916299,data/final/MP/cifs/Ni1P1-MP-mp-27844.cif,data/source/MP/raw/cifs/mp-27844.cif,mp-27844,0.0,,2014-02-25 22:28:51,5.86076118891282,10.17188/1202021,"@misc{osti_1202021,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NiP (SG:61) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1202021"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1669876'}},0.0165408539583244,8.82130478,520.0,-96.49635754,-6.03102234625,"{'tags': ['Nickel(III) phosphide', 'High pressure experimental phase', 'Nickel phosphide']}",-96.49635754,-6.03102234625,-0.4343027529166674,"['xas', 'bandstructure']",True,"[27159, 261827]",True,2021-05-12 10:57:03.017000,NM,16,9,mp-27844,,NiP,"{'functional': 'PBE', 'labels': ['Ni_pv', 'P'], 'pot_type': 'paw'}","{'Ni': 1.0, 'P': 1.0}",GGA,mp-27844,"['mp-918396', 'mp-919395', 'mp-905051', 'mp-504700', 'mp-27844', 'mp-1427305', 'mp-1669876', 'mp-1785181', 'mp-1599558']",3.82875e-05,"{'Ni': 8.0, 'P': 8.0}",203.24435095403896,[],NM,False,61,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.507052956513737e-06,3.82875e-05,0,0.0003063,MP,data/source/MP/cleaned/cifs/MP-mp-27844.cif,False,,data/final/MP/graphs/Ni1P1-MP-mp-27844.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ni1Pr2O4,1,0.0,4.0,False,Ni4Pr8O16,Ni4Pr8O16,0.0,OxideHeavy_fermion,False,Ni14.286Pr28.571O57.142857142857146,Ni-Pr-O,3,Supercon,Pr2Ni1O4,MP-mp-505093,Pr8Ni4O16,Ni-Pr-O,Ni14.286Pr28.571O57.142857142857146,P 42/n c m,tetragonal,5.583771,5.583771,12.295205,data/final/MP/cifs/Ni1Pr2O4-MP-mp-505093.cif,data/source/MP/raw/cifs/mp-505093.cif,mp-505093,1.3358999999999996,,2013-06-09 09:07:47,7.008795796992463,,,{'GGA+U': {'task_id': 'mp-701194'}},0.0580957187499988,5.2076329,520.0,-202.19910413,-7.221396576071428,{'tags': []},-202.19910413,-7.221396576071428,-2.957856720357144,"['xas', 'bandstructure']",True,[67813],True,2021-05-12 10:57:10.838000,FM,28,11,mp-505093,oxide,Pr2NiO4,"{'functional': 'PBE', 'labels': ['Pr_3', 'Ni_pv', 'O'], 'pot_type': 'paw'}","{'Pr': 2.0, 'Ni': 1.0, 'O': 4.0}",GGA+U,mp-505093,"['mp-712552', 'mp-701194', 'mp-681012', 'mp-541293', 'mp-616627', 'mp-505093', 'mp-1446689', 'mp-1767070', 'mp-1768957', 'mp-1841243', 'mp-1614027']",2.00075925,"{'Pr': 8.0, 'Ni': 4.0, 'O': 16.0}",383.346031638731,[],FM,True,138,1,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 1.8, 1.8, 1.8, 1.8, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.02087679626104,2.00075925,4,8.003037,MP,data/source/MP/cleaned/cifs/MP-mp-505093.cif,False,,data/final/MP/graphs/Ni1Pr2O4-MP-mp-505093.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B1C1Li0.78,3,0.1055155875299759,2.0,False,B2C2Li1.56,B2C2Li2,0.0,Other,True,B35.971C35.971Li28.058,B-C-Li,3,Supercon,Li0.78B1C1,MP-mp-9244,Li2B2C2,B-C-Li,B33.333C33.333Li33.333,P 63/m m c,hexagonal,2.7490620015432032,2.74906241,7.019742,data/final/MP/cifs/B1C1Li0.78-MP-mp-9244-synth_doped.cif,data/source/MP/raw/cifs/mp-9244.cif,mp-9244,1.127199999999999,,2011-05-27 17:30:21,2.151446160042454,10.17188/1313087,"@misc{osti_1313087,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LiBC (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1313087"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668043'}},0.0,4.30786984,520.0,-37.8844428,-6.3140738,"{'tags': ['Lithium borocarbide', 'Lithium boro carbide (1/1/1)', 'Lithium boride carbide (1/1/1)']}",-37.8844428,-6.3140738,-0.3757086875000001,"['xas', 'bandstructure', 'diel', 'phonons', 'elasticity']",True,"[78731, 425059, 245288, 245287]",True,2021-05-12 10:56:35.166000,NM,6,15,mp-9244,,LiBC,"{'functional': 'PBE', 'labels': ['Li_sv', 'B', 'C'], 'pot_type': 'paw'}","{'Li': 1.0, 'B': 1.0, 'C': 1.0}",GGA,mp-9244,"['mp-670388', 'mp-660798', 'mp-9244', 'mp-1071857', 'mp-1071853', 'mp-1071847', 'mp-1077436', 'mp-1077757', 'mp-1142136', 'mp-1180508', 'mp-1438968', 'mp-1668043', 'mp-1793967', 'mp-1071855', 'mp-688134']",0.0017849,"{'Li': 2.0, 'B': 2.0, 'C': 2.0}",45.94316789830389,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0]",7.77003450850804e-05,0.0017849,0,0.0035698,MP,data/source/MP/cleaned/cifs/MP-mp-9244.cif,True,,data/final/MP/graphs/B1C1Li0.78-MP-mp-9244-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ga3Zr1,1,0.0,2.0,False,Ga6Zr2,Ga6Zr2,0.69,Other,True,Ga75Zr25,Ga-Zr,2,Supercon,Ga3Zr1,MP-mp-1080001,Zr2Ga6,Ga-Zr,Ga75Zr25,I 4/m m m,tetragonal,3.993206001734663,3.9932060017346624,9.27068006,data/final/MP/cifs/Ga3Zr1-MP-mp-1080001.cif,data/source/MP/raw/cifs/mp-1080001.cif,mp-1080001,0.0,,2018-04-17 03:20:32,7.085235528005324,,,{'GGA': {'task_id': 'mp-1703271'}},0.0,4.76849238,520.0,-39.17602841,-4.89700355125,{'tags': ['Zirconium gallide (1/3)']},-39.17602841,-4.89700355125,-0.4890063768750003,['bandstructure'],True,"[635698, 635699]",True,2021-05-12 10:58:16.596000,NM,8,6,mp-1080001,,ZrGa3,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Ga_d'], 'pot_type': 'paw'}","{'Zr': 1.0, 'Ga': 3.0}",GGA,mp-1080001,"['mp-1080001', 'mp-1091403', 'mp-1414241', 'mp-1703271', 'mp-1778641', 'mp-1597104']",8.145e-05,"{'Zr': 2.0, 'Ga': 6.0}",140.80387585184562,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.1569283800923492e-06,8.145e-05,0,0.0001629,MP,data/source/MP/cleaned/cifs/MP-mp-1080001.cif,False,,data/final/MP/graphs/Ga3Zr1-MP-mp-1080001.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
La1Rh1Sn1,1,0.0,3.0,False,La3Rh3Sn3,La3Rh3Sn3,1.916666667,Other,True,La33.333Rh33.333Sn33.333,La-Rh-Sn,3,Supercon,La1Rh1Sn1,MP-mp-12378,La3Sn3Rh3,La-Rh-Sn,La33.333Rh33.333Sn33.333,P -6 2 m,hexagonal,4.263607,7.547882002584576,7.547881520000001,data/final/MP/cifs/La1Rh1Sn1-MP-mp-12378.cif,data/source/MP/raw/cifs/mp-12378.cif,mp-12378,0.0,,2011-06-03 16:48:40,8.537739857086851,10.17188/1188740,"@misc{osti_1188740,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaSnRh (SG:189) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188740"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700036'}},0.0,8.63735371,520.0,-56.94432923,-6.327147692222223,{'tags': ['Lanthanum rhodium stannide']},-56.94432923,-6.327147692222223,-0.8905187488888894,"['xas', 'bandstructure']",True,[415594],True,2021-05-12 10:56:51.169000,NM,9,9,mp-12378,,LaSnRh,"{'functional': 'PBE', 'labels': ['La', 'Sn_d', 'Rh_pv'], 'pot_type': 'paw'}","{'La': 1.0, 'Sn': 1.0, 'Rh': 1.0}",GGA,mp-12378,"['mp-914008', 'mp-930741', 'mp-12378', 'mp-1115733', 'mp-1413199', 'mp-1700036', 'mp-1787563', 'mp-977715', 'mp-1602531']",0.0006105,"{'La': 3.0, 'Sn': 3.0, 'Rh': 3.0}",210.3574827885869,[],NM,False,189,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0]",8.70660732254859e-06,0.0006105,0,0.0018315,MP,data/source/MP/cleaned/cifs/MP-mp-12378.cif,False,,data/final/MP/graphs/La1Rh1Sn1-MP-mp-12378.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Ga5Rh1U1,1,0.0,1.0,True,Ga5Rh1U1,Ga5Rh1U1,0.0,Heavy_fermion,True,Ga71.429Rh14.286U14.286,Ga-Rh-U,3,Supercon,U1Rh1Ga5,MP-mp-1078033,U1Ga5Rh1,Ga-Rh-U,Ga71.429Rh14.286U14.286,P 4/m m m,tetragonal,4.330887,4.330887,6.785446,data/final/MP/cifs/Ga5Rh1U1-MP-mp-1078033.cif,data/source/MP/raw/cifs/mp-1078033.cif,mp-1078033,0.0,,2018-04-10 11:56:13,8.996682314527355,,,{'GGA': {'task_id': 'mp-1697872'}},0.0,5.6548679,520.0,-36.91620441,-5.273743487142857,"{'tags': ['HoCoGa5', 'Uranium rhodium gallide (1/1/5)', 'URhGa5']}",-36.91620441,-5.273743487142857,-0.4457152025000001,['bandstructure'],True,[600550],True,2021-05-12 10:58:14.654000,NM,7,5,mp-1078033,,UGa5Rh,"{'functional': 'PBE', 'labels': ['U', 'Ga_d', 'Rh_pv'], 'pot_type': 'paw'}","{'U': 1.0, 'Ga': 5.0, 'Rh': 1.0}",GGA,mp-1078033,"['mp-1078033', 'mp-1475450', 'mp-1697872', 'mp-1785999', 'mp-1596393']",0.0003606,"{'U': 1.0, 'Ga': 5.0, 'Rh': 1.0}",127.27177570859186,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0, 0]",2.833306897718224e-06,0.0003606,0,0.0003606,MP,data/source/MP/cleaned/cifs/MP-mp-1078033.cif,False,,data/final/MP/graphs/Ga5Rh1U1-MP-mp-1078033.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ga1Ni2Zr1,1,0.0,1.0,True,Ga1Ni2Zr1,Ga1Ni2Zr1,2.87,Other,True,Ga25Ni50Zr25,Ga-Ni-Zr,3,Supercon,Ni2Zr1Ga1,MP-mp-22580,Zr1Ga1Ni2,Ga-Ni-Zr,Ga25Ni50Zr25,F m -3 m,cubic,4.32844951,4.328449509999999,4.328449509999999,data/final/MP/cifs/Ga1Ni2Zr1-MP-mp-22580.cif,data/source/MP/raw/cifs/mp-22580.cif,mp-22580,0.0,,2014-02-21 11:19:08,8.059961670929592,10.17188/1198801,"@misc{osti_1198801,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrGaNi2 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198801"",
    place = ""United States"",
    year = ""2016"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701292'}},0.0166428195026888,6.17074416,520.0,-25.25551084,-6.31387771,{'tags': ['Gallium nickel zirconium (1/2/1)']},-25.25551084,-6.31387771,-0.529860206875,"['xas', 'elasticity', 'bandstructure']",True,[103902],True,2021-05-12 10:56:16.728000,NM,4,8,mp-22580,,ZrGaNi2,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Ga_d', 'Ni_pv'], 'pot_type': 'paw'}","{'Zr': 1.0, 'Ga': 1.0, 'Ni': 2.0}",GGA,mp-22580,"['mp-993409', 'mp-991461', 'mp-22580', 'mp-1412922', 'mp-1701292', 'mp-1795292', 'mp-994723', 'mp-1588465']",0.0014644,"{'Zr': 1.0, 'Ga': 1.0, 'Ni': 2.0}",57.34321915229719,[],NM,False,225,0,"[0.0, 0.0, -0.0, -0.0]",2.553745711608407e-05,0.0014644,0,0.0014644,MP,data/source/MP/cleaned/cifs/MP-mp-22580.cif,False,,data/final/MP/graphs/Ga1Ni2Zr1-MP-mp-22580.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Cr0.476Mo0.524,2,0.048,2.0,False,Cr0.952Mo1.048,Cr1Mo1,0.045,Other,True,Cr47.6Mo52.4,Cr-Mo,2,Supercon,Cr0.476Mo0.524,MP-mp-1226200,Cr1Mo1,Cr-Mo,Cr50Mo50,C m m m,orthorhombic,2.65445083,2.65445083,4.22062421,data/final/MP/cifs/Cr0.476Mo0.524-MP-mp-1226200-synth_doped.cif,data/source/MP/raw/cifs/mp-1226200.cif,mp-1226200,0.0,,2019-01-13 02:12:14.151000,8.786506534983348,,,,0.1163129200000003,7.66612065,520.0,-20.26606466,-10.13303233,{'tags': []},-20.26606466,-10.13303233,0.1163129200000003,[],False,[],True,2021-05-12 11:00:56.634000,NM,2,2,mp-1226200,,CrMo,"{'functional': 'PBE', 'labels': ['Cr_pv', 'Mo_pv'], 'pot_type': 'paw'}","{'Cr': 1.0, 'Mo': 1.0}",GGA,mp-1226200,"['mp-1226200', 'mp-1934530']",0.0022757,"{'Cr': 1.0, 'Mo': 1.0}",27.958059603367698,[],NM,False,65,0,"[0.0, -0.0]",8.139692211421852e-05,0.0022757,0,0.0022757,MP,data/source/MP/cleaned/cifs/MP-mp-1226200.cif,True,,data/final/MP/graphs/Cr0.476Mo0.524-MP-mp-1226200-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ce0.97La0.03Ru2,2,0.02,2.0,False,Ce1.94La0.06Ru4,Ce2Ru4,6.17,Heavy_fermion,True,Ce32.333La1Ru66.667,Ce-La-Ru,3,Supercon,Ce0.97La0.03Ru2,MP-mp-607,Ce2Ru4,Ce-Ru,Ce33.333Ru66.667,F d -3 m,cubic,5.35903077,5.35903077,5.35903077,data/final/MP/cifs/Ce0.97La0.03Ru2-MP-mp-607-synth_doped.cif,data/source/MP/raw/cifs/mp-607.cif,mp-607,0.0,,2011-05-13 22:34:26,10.444470046690055,10.17188/1277529,"@misc{osti_1277529,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeRu2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277529"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686879'}},0.0,8.61419203,520.0,-50.66413619,-8.444022698333333,"{'tags': ['Cerium ruthenium (1/2)', 'Cerium ruthenium hydride (1/2/4)']}",-50.66413619,-8.444022698333333,-0.2833998766666663,"['xas', 'elasticity', 'bandstructure']",True,"[621326, 656077, 621978, 621973, 621980, 621984, 102277, 621972, 621976, 621979, 604113, 621977, 621982, 621983, 102276, 656078]",True,2021-05-12 10:56:27.046000,NM,6,14,mp-607,,CeRu2,"{'functional': 'PBE', 'labels': ['Ce', 'Ru_pv'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Ru': 2.0}",GGA,mp-607,"['mp-928203', 'mp-912221', 'mp-928809', 'mp-607', 'mp-1071462', 'mp-1071593', 'mp-1071613', 'mp-1077792', 'mp-1440763', 'mp-1686879', 'mp-1803198', 'mp-1591928', 'mp-1591642', 'mp-1071635']",1.005e-05,"{'Ce': 2.0, 'Ru': 4.0}",108.82877852828122,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",1.846937939745105e-07,1.005e-05,0,2.01e-05,MP,data/source/MP/cleaned/cifs/MP-mp-607.cif,True,,data/final/MP/graphs/Ce0.97La0.03Ru2-MP-mp-607-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
S1Se1Ta1,1,0.0,1.0,True,S1Se1Ta1,S1Se1Ta1,3.53,Other,True,S33.333Se33.333Ta33.333,S-Se-Ta,3,Supercon,S1Se1Ta1,MP-mp-1217890,Ta1Se1S1,S-Se-Ta,S33.333Se33.333Ta33.333,P 3 m 1,trigonal,3.4333280014504988,3.43332777,6.39995,data/final/MP/cifs/S1Se1Ta1-MP-mp-1217890.cif,data/source/MP/raw/cifs/mp-1217890.cif,mp-1217890,0.0,,2019-01-12 19:09:04.956000,7.420853309436702,,,{'GGA': {'task_id': 'mp-1712748'}},0.0335588799999992,4.5864584,520.0,-22.18986267,-7.39662089,{'tags': []},-22.18986267,-7.39662089,-1.2249078984895845,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,3,5,mp-1217890,,TaSeS,"{'functional': 'PBE', 'labels': ['Ta_pv', 'Se', 'S'], 'pot_type': 'paw'}","{'Ta': 1.0, 'Se': 1.0, 'S': 1.0}",GGA,mp-1217890,"['mp-1217890', 'mp-1426851', 'mp-1712748', 'mp-1784093', 'mp-1610869']",0.0149374,"{'Ta': 1.0, 'Se': 1.0, 'S': 1.0}",65.333776778902,[],NM,False,156,0,"[0, 0, 0]",0.0002286321216443,0.0149374,0,0.0149374,MP,data/source/MP/cleaned/cifs/MP-mp-1217890.cif,False,,data/final/MP/graphs/S1Se1Ta1-MP-mp-1217890.json,0,True,3m,0,0,0,0,0,0,5,1,0,0,0,1.0,False
Co1Na0.72O2,3,0.1129032258064516,1.0,True,Co1Na0.72O2,Co1Na1O2,0.0,Oxide,True,Co26.882Na19.355O53.763440860215056,Co-Na-O,3,Supercon,Na0.72Co1O2,MP-mp-18921,Na1Co1O2,Co-Na-O,Co25Na25O50,R -3 m,trigonal,2.919871454834869,2.919871454834869,5.5138631,data/final/MP/cifs/Co1Na0.72O2-MP-mp-18921-synth_doped.cif,data/source/MP/raw/cifs/mp-18921.cif,mp-18921,2.1838999999999995,,2013-06-06 02:16:11,4.8803582437020205,10.17188/1193659,"@misc{osti_1193659,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NaCoO2 (SG:166) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1193659"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-1688208'}},0.0,3.15019832,520.0,-21.58895337,-5.3972383425,"{'tags': ['Sodium cobalt(III) oxide', 'Sodium dioxocobaltate']}",-21.58895337,-5.3972383425,-1.5685470678879303,"['diel', 'xas', 'elasticity', 'bandstructure']",True,"[96428, 6152]",True,2021-05-12 10:56:22.739000,NM,4,18,mp-18921,oxide,NaCoO2,"{'functional': 'PBE', 'labels': ['Na_pv', 'Co', 'O'], 'pot_type': 'paw'}","{'Na': 1.0, 'Co': 1.0, 'O': 2.0}",GGA+U,mp-18921,"['mp-818780', 'mp-818928', 'mp-607800', 'mp-554427', 'mp-578616', 'mp-18921', 'mp-578617', 'mp-1141837', 'mp-578608', 'mp-578607', 'mp-545943', 'mp-825450', 'mp-835011', 'mp-1476080', 'mp-1688208', 'mp-1793641', 'mp-835772', 'mp-1595307']",2.85e-05,"{'Na': 1.0, 'Co': 1.0, 'O': 2.0}",38.76181433341651,[],NM,False,166,0,"[0, 0, 0, 0]",7.352597005612864e-07,2.85e-05,0,2.85e-05,MP,data/source/MP/cleaned/cifs/MP-mp-18921.cif,True,,data/final/MP/graphs/Co1Na0.72O2-MP-mp-18921-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
In0.2Sn0.8Te1,3,0.1333333333333333,3.0,False,In0.6Sn2.4Te3,In1Sn2Te3,3.035,Other,True,In10Sn40Te50,In-Sn-Te,3,Supercon,Sn0.8In0.2Te1,MP-mp-1223682,In1Sn2Te3,In-Sn-Te,In16.667Sn33.333Te50,P -3 m 1,trigonal,4.468664002131333,4.46866353,11.140244,data/final/MP/cifs/In0.2Sn0.8Te1-MP-mp-1223682-synth_doped.cif,data/source/MP/raw/cifs/mp-1223682.cif,mp-1223682,0.0,,2019-01-13 00:02:36.393000,6.335460875649405,,,{'GGA': {'task_id': 'mp-1729985'}},0.011146198333336,6.10685426,520.0,-21.89398881,-3.648998135,{'tags': []},-21.89398881,-3.648998135,-0.4932097633333339,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,6,5,mp-1223682,,InSn2Te3,"{'functional': 'PBE', 'labels': ['In_d', 'Sn_d', 'Te'], 'pot_type': 'paw'}","{'In': 1.0, 'Sn': 2.0, 'Te': 3.0}",GGA,mp-1223682,"['mp-1223682', 'mp-1399838', 'mp-1729985', 'mp-1831757', 'mp-1621751']",0.0011562,"{'In': 1.0, 'Sn': 2.0, 'Te': 3.0}",192.6551735370664,[],NM,False,164,0,"[0, 0, 0, 0, 0, 0]",6.001396063093784e-06,0.0011562,0,0.0011562,MP,data/source/MP/cleaned/cifs/MP-mp-1223682.cif,True,,data/final/MP/graphs/In0.2Sn0.8Te1-MP-mp-1223682-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ba2Cu1Tl2O6.03,2,0.0024725954009725,1.9900124378109447,False,Ba3.98Cu1.99Tl3.98O12,Ba4Cu2Tl4O12,62.0,Cuprate,True,Ba18.132Cu9.066Tl18.132O54.66908431550318,Ba-Cu-Tl-O,4,Supercon,Tl2Ba2Cu1O6.03,MP-mp-6027,Ba4Tl4Cu2O12,Ba-Cu-Tl-O,Ba18.182Cu9.091Tl18.182O54.54545454545455,C m c a,orthorhombic,5.504110002693673,5.585743,12.28312762,data/final/MP/cifs/Ba2Cu1Tl2O6.03-MP-mp-6027-synth_doped.cif,data/source/MP/raw/cifs/mp-6027.cif,mp-6027,0.0,,2011-05-19 00:05:23,7.606665315628389,10.17188/1277350,"@misc{osti_1277350,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Tl2CuO6 (SG:64) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277350"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1673478'}},0.0059215576010052,4.10961464,520.0,-115.75418737,-5.261553971363636,"{'tags': ['Dithallium dibarium cuprate', 'Dithallium(III) dibarium copper oxide']}",-115.75418737,-5.261553971363636,-1.7862630028787878,"['xas', 'bandstructure']",True,"[202723, 202724, 202722]",True,2021-05-12 10:57:28.836000,NM,22,8,mp-6027,oxide,Ba2Tl2CuO6,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Tl_d', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Tl': 2.0, 'Cu': 1.0, 'O': 6.0}",GGA,mp-6027,"['mp-925246', 'mp-909581', 'mp-924678', 'mp-6027', 'mp-1504634', 'mp-1673478', 'mp-1837163', 'mp-1605186']",2.9e-05,"{'Ba': 4.0, 'Tl': 4.0, 'Cu': 2.0, 'O': 12.0}",368.0385386017736,[],NM,False,64,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.5759219189476614e-07,2.9e-05,0,5.8e-05,MP,data/source/MP/cleaned/cifs/MP-mp-6027.cif,True,,data/final/MP/graphs/Ba2Cu1Tl2O6.03-MP-mp-6027-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
As1Co0.02Fe0.98Na1,2,0.0133333333333333,2.0,False,As2Co0.04Fe1.96Na2,As2Fe2Na2,18.8,Ferrite,True,As33.333Co0.667Fe32.667Na33.333,As-Co-Fe-Na,4,Supercon,Na1Fe0.98Co0.02As1,MP-mp-22152,Na2Fe2As2,As-Fe-Na,As33.333Fe33.333Na33.333,P 4/n m m,tetragonal,3.923688,3.923688,6.918844,data/final/MP/cifs/As1Co0.02Fe0.98Na1-MP-mp-22152-synth_doped.cif,data/source/MP/raw/cifs/mp-22152.cif,mp-22152,0.0,,2014-02-21 10:51:39,4.793908463406792,10.17188/1197381,"@misc{osti_1197381,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NaFeAs (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197381"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704688'}},0.0,4.10723066,520.0,-30.57538864,-5.095898106666667,{'tags': ['Sodium iron arsenide']},-30.57538864,-5.095898106666667,-0.2786807238505749,"['xas', 'elasticity', 'bandstructure']",True,"[163144, 163143]",True,2021-05-12 10:56:16.728000,FM,6,8,mp-22152,,NaFeAs,"{'functional': 'PBE', 'labels': ['Na_pv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Na': 1.0, 'Fe': 1.0, 'As': 1.0}",GGA,mp-22152,"['mp-906352', 'mp-920130', 'mp-919102', 'mp-22152', 'mp-1413190', 'mp-1704688', 'mp-1797758', 'mp-1594769']",0.0693226,"{'Na': 2.0, 'Fe': 2.0, 'As': 2.0}",106.5178694490858,[],FM,True,129,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.0]",0.0013016144682303,0.0693226,2,0.1386452,MP,data/source/MP/cleaned/cifs/MP-mp-22152.cif,True,,data/final/MP/graphs/As1Co0.02Fe0.98Na1-MP-mp-22152-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ag0.5Pd0.5Th2,1,0.0,2.0,False,Ag1Pd1Th4,Ag1Pd1Th4,1.2,Other,True,Ag16.667Pd16.667Th66.667,Ag-Pd-Th,3,Supercon,Pd0.5Ag0.5Th2,MP-mp-1217282,Th4Ag1Pd1,Ag-Pd-Th,Ag16.667Pd16.667Th66.667,I 4 2 2,tetragonal,5.961603997853701,6.055648198969005,6.0556482,data/final/MP/cifs/Ag0.5Pd0.5Th2-MP-mp-1217282.cif,data/source/MP/raw/cifs/mp-1217282.cif,mp-1217282,0.0,,2019-01-12 18:38:43.970000,11.45244679948245,,,{'GGA': {'task_id': 'mp-1720404'}},0.0192808691666659,6.9136474,520.0,-39.3468212,-6.557803533333334,{'tags': []},-39.3468212,-6.557803533333334,-0.2798250644444451,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,6,5,mp-1217282,,Th4AgPd,"{'functional': 'PBE', 'labels': ['Th', 'Ag', 'Pd'], 'pot_type': 'paw'}","{'Th': 4.0, 'Ag': 1.0, 'Pd': 1.0}",GGA,mp-1217282,"['mp-1217282', 'mp-1401604', 'mp-1720404', 'mp-1827307', 'mp-1622279']",0.003215,"{'Th': 4.0, 'Ag': 1.0, 'Pd': 1.0}",165.64730795950294,[],NM,False,97,0,"[0, 0, 0, 0, 0, 0]",1.9408706604432085e-05,0.003215,0,0.003215,MP,data/source/MP/cleaned/cifs/MP-mp-1217282.cif,False,,data/final/MP/graphs/Ag0.5Pd0.5Th2-MP-mp-1217282.json,0,True,422,0,0,0,0,4,0,0,0,0,1,0,1.0,False
Al1Nb2.917Ti0.083,2,0.0415,2.0,False,Al2Nb5.834Ti0.166,Al2Nb6,16.0,Other,True,Al25Nb72.925Ti2.075,Al-Nb-Ti,3,Supercon,Nb2.9175Ti0.0825Al1,MP-mp-796,Nb6Al2,Al-Nb,Al25Nb75,P m -3 n,cubic,5.215254,5.215254,5.215254,data/final/MP/cifs/Al1Nb2.917Ti0.083-MP-mp-796-synth_doped.cif,data/source/MP/raw/cifs/mp-796.cif,mp-796,0.0,,2011-05-13 16:07:37,7.157298025966356,,,{'GGA': {'task_id': 'mp-1686893'}},0.0460773865000003,5.52947534,520.0,-69.48918494,-8.6861481175,"{'tags': ['Aluminium niobium (1/3)', 'Niobium aluminide (3/1)', 'Aluminum niobium (1/3)']}",-69.48918494,-8.6861481175,-0.1737753800000003,"['bandstructure', 'elasticity']",True,"[608675, 608654, 608688, 608668, 608669, 608685, 608676, 608683, 58014, 608657, 107856, 608655, 608666, 608691, 608656, 608665, 608673, 608653, 608661]",True,2021-05-12 10:56:31.128000,NM,8,10,mp-796,,Nb3Al,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Al': 1.0}",GGA,mp-796,"['mp-911586', 'mp-927906', 'mp-796', 'mp-927472', 'mp-1260512', 'mp-1440919', 'mp-1686893', 'mp-1927652', 'mp-1591599', 'mp-1587739']",0.16323955,"{'Nb': 6.0, 'Al': 2.0}",141.8490379078192,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0023015954483396,0.16323955,0,0.3264791,MP,data/source/MP/cleaned/cifs/MP-mp-796.cif,True,,data/final/MP/graphs/Al1Nb2.917Ti0.083-MP-mp-796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ce0.3Ge12Pr0.7Pt4,3,0.0352941176470588,1.0,True,Ce0.3Ge12Pr0.7Pt4,Ge12Pr1Pt4,0.0,Heavy_fermion,True,Ce1.765Ge70.588Pr4.118Pt23.529,Ce-Ge-Pr-Pt,4,Supercon,Pr0.7Ce0.3Pt4Ge12,MP-mp-1105939,Pr1Ge12Pt4,Ge-Pr-Pt,Ge70.588Pr5.882Pt23.529,I m -3,cubic,7.560907531676135,7.560907530000001,7.56090753,data/final/MP/cifs/Ce0.3Ge12Pr0.7Pt4-MP-mp-1105939-synth_doped.cif,data/source/MP/raw/cifs/mp-1105939.cif,mp-1105939,0.0,,2018-07-19 06:58:09,8.947691530234051,,,{'GGA': {'task_id': 'mp-1705662'}},0.0059454020588258,4.25899828,520.0,-91.15368674,-5.361981572941176,{'tags': ['Praseodymium platinum germanide (1/4/12)']},-91.15368674,-5.361981572941176,-0.3889895585294119,['bandstructure'],True,[174554],True,2021-05-12 10:58:22.271000,NM,17,5,mp-1105939,,Pr(Ge3Pt)4,"{'functional': 'PBE', 'labels': ['Pr_3', 'Ge_d', 'Pt'], 'pot_type': 'paw'}","{'Pr': 1.0, 'Ge': 12.0, 'Pt': 4.0}",GGA,mp-1105939,"['mp-1105939', 'mp-1427343', 'mp-1705662', 'mp-1805701', 'mp-1584493']",0.0022709,"{'Pr': 1.0, 'Ge': 12.0, 'Pt': 4.0}",332.73607546662794,[],NM,False,204,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.824928727115922e-06,0.0022709,0,0.0022709,MP,data/source/MP/cleaned/cifs/MP-mp-1105939.cif,True,,data/final/MP/graphs/Ce0.3Ge12Pr0.7Pt4-MP-mp-1105939-synth_doped.json,0,True,m-3,2,0,0,0,0,0,0,0,0,1,0,1.0,False
Ce0.09Cu1Sm1.91O4,2,0.0257142857142857,1.0,True,Ce0.09Cu1Sm1.91O4,Cu1Sm2O4,0.0,Cuprate,True,Ce1.286Cu14.286Sm27.286O57.142857142857146,Ce-Cu-Sm-O,4,Supercon,Sm1.91Ce0.09Cu1O4,MP-mp-4210,Sm2Cu1O4,Cu-Sm-O,Cu14.286Sm28.571O57.142857142857146,I 4/m m m,tetragonal,3.936481999770292,3.936481999770292,6.66682973,data/final/MP/cifs/Ce0.09Cu1Sm1.91O4-MP-mp-4210-synth_doped.cif,data/source/MP/raw/cifs/mp-4210.cif,mp-4210,0.0,,2011-05-13 10:20:22,7.575626216473968,10.17188/1207966,"@misc{osti_1207966,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sm2CuO4 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207966"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-670158'}},0.0084157301785579,3.24265454,520.0,-51.71666507,-7.38809501,"{'tags': ['Samarium cuprate', 'Disamarium copper oxide', 'Disamarium copper tetraoxide']}",-51.71666507,-7.38809501,-3.0194917299999995,"['xas', 'elasticity', 'bandstructure']",True,"[261378, 72243, 71182, 95371, 261377]",True,2021-05-12 10:56:20.740000,NM,7,8,mp-4210,oxide,Sm2CuO4,"{'functional': 'PBE', 'labels': ['Sm_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sm': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-4210,"['mp-660482', 'mp-670158', 'mp-4210', 'mp-1412888', 'mp-1702500', 'mp-1798108', 'mp-1589420', 'mp-688388']",0.0004776,"{'Sm': 2.0, 'Cu': 1.0, 'O': 4.0}",93.8732216032902,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",5.087712894507291e-06,0.0004776,0,0.0004776,MP,data/source/MP/cleaned/cifs/MP-mp-4210.cif,True,,data/final/MP/graphs/Ce0.09Cu1Sm1.91O4-MP-mp-4210-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ba1Ga2,1,0.0,1.0,True,Ba1Ga2,Ba1Ga2,0.0,Other,True,Ba33.333Ga66.667,Ba-Ga,2,Supercon,Ba1Ga2,MP-mp-1219,Ba1Ga2,Ba-Ga,Ba33.333Ga66.667,P 6/m m m,hexagonal,4.480352002757246,4.48035144,5.110307,data/final/MP/cifs/Ba1Ga2-MP-mp-1219.cif,data/source/MP/raw/cifs/mp-1219.cif,mp-1219,0.0,,2015-11-23 14:31:23,5.173339704857009,10.17188/1188645,"@misc{osti_1188645,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BaGa2 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188645"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1673085'}},0.0,2.31056655,520.0,-9.3650975,-3.1216991666666662,"{'tags': ['Barium gallium (1/2)', 'Barium digallium', 'Barium gallide (1/2)']}",-9.3650975,-3.1216991666666662,-0.4633115416666662,"['xas', 'elasticity', 'bandstructure']",True,"[58649, 150472, 417213, 246238]",True,2021-05-12 10:56:12.755000,NM,3,8,mp-1219,,BaGa2,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ga_d'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Ga': 2.0}",GGA,mp-1219,"['mp-987975', 'mp-986801', 'mp-1219', 'mp-1439322', 'mp-1673085', 'mp-1929031', 'mp-988141', 'mp-1594339']",0.0050836,"{'Ba': 1.0, 'Ga': 2.0}",88.83862365515874,[],NM,False,191,0,"[0, 0, 0]",5.722285860407746e-05,0.0050836,0,0.0050836,MP,data/source/MP/cleaned/cifs/MP-mp-1219.cif,False,,data/final/MP/graphs/Ba1Ga2-MP-mp-1219.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ce1Co0.75In5Ni0.25,3,0.0714285714285714,1.0,True,Ce1Co0.75In5Ni0.25,Ce1Co1In5,0.0,Heavy_fermion,True,Ce14.286Co10.714In71.429Ni3.571,Ce-Co-In-Ni,4,Supercon,Ce1Co0.75Ni0.25In5,MP-mp-19961,Ce1In5Co1,Ce-Co-In,Ce14.286Co14.286In71.429,P 4/m m m,tetragonal,4.635989,4.635989,7.564124,data/final/MP/cifs/Ce1Co0.75In5Ni0.25-MP-mp-19961-synth_doped.cif,data/source/MP/raw/cifs/mp-19961.cif,mp-19961,0.0,,2014-02-21 14:08:25,7.897022127398995,10.17188/1195145,"@misc{osti_1195145,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeIn5Co (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195145"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701944'}},0.0,7.80626318,520.0,-28.52795357,-4.075421938571429,{'tags': ['Cerium cobalt indium (1/1/5)']},-28.52795357,-4.075421938571429,-0.2468754242857146,"['xas', 'bandstructure']",True,[102108],True,2021-05-12 10:56:57.051000,FM,7,8,mp-19961,,CeIn5Co,"{'functional': 'PBE', 'labels': ['Ce', 'In_d', 'Co'], 'pot_type': 'paw'}","{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",GGA,mp-19961,"['mp-928775', 'mp-912209', 'mp-928270', 'mp-19961', 'mp-1504062', 'mp-1701944', 'mp-1785253', 'mp-1593180']",0.9310323,"{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",162.57113333428427,[],FM,True,123,1,"[0.7, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0057269226147644,0.9310323,1,0.9310323,MP,data/source/MP/cleaned/cifs/MP-mp-19961.cif,True,,data/final/MP/graphs/Ce1Co0.75In5Ni0.25-MP-mp-19961-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Os2Th1,1,0.0,2.0,False,Os4Th2,Os4Th2,0.0,Other,True,Os66.667Th33.333,Os-Th,2,Supercon,Os2Th1,MP-mp-1828,Th2Os4,Os-Th,Os66.667Th33.333,F d -3 m,cubic,5.4667698,5.466769799999999,5.466769799999999,data/final/MP/cifs/Os2Th1-MP-mp-1828.cif,data/source/MP/raw/cifs/mp-1828.cif,mp-1828,0.0,,2011-05-13 23:04:00,17.607854773817674,10.17188/1193028,"@misc{osti_1193028,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ThOs2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1193028"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1674243'}},0.0,8.41198096,520.0,-61.27169294,-10.211948823333334,"{'tags': ['Osmium technetium (2/1)', 'Osmium thorium (2/1)', 'Thorium osmium (1/2)']}",-61.27169294,-10.211948823333334,-0.2557519033333335,"['xas', 'elasticity', 'bandstructure']",True,"[647835, 105570, 150741, 647836, 647839, 105571]",True,2021-05-12 10:56:14.760000,NM,6,8,mp-1828,,ThOs2,"{'functional': 'PBE', 'labels': ['Th', 'Os_pv'], 'pot_type': 'paw'}","{'Th': 1.0, 'Os': 2.0}",GGA,mp-1828,"['mp-912732', 'mp-929076', 'mp-929475', 'mp-1828', 'mp-1437688', 'mp-1674243', 'mp-1804824', 'mp-1588973']",4.25e-06,"{'Th': 2.0, 'Os': 4.0}",115.52536863934976,[],NM,False,74,0,"[0.0, 0.0, -0.0, 0.0, 0.0, -0.0]",7.357691302016556e-08,4.25e-06,0,8.5e-06,MP,data/source/MP/cleaned/cifs/MP-mp-1828.cif,False,,data/final/MP/graphs/Os2Th1-MP-mp-1828.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
La4Sb3,1,0.0,2.0,False,La8Sb6,La8Sb6,0.25,Other,True,La57.143Sb42.857,La-Sb,2,Supercon,La4Sb3,MP-mp-1223,La8Sb6,La-Sb,La57.143Sb42.857,I -4 3 d,cubic,8.415397481865563,8.41539748,8.41539748,data/final/MP/cifs/La4Sb3-MP-mp-1223.cif,data/source/MP/raw/cifs/mp-1223.cif,mp-1223,0.0,,2011-05-15 03:30:33,6.666385785288553,10.17188/1188657,"@misc{osti_1188657,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La4Sb3 (SG:220) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188657"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1669795'}},0.0,8.04600304,520.0,-80.14158402,-5.724398858571428,"{'tags': ['Lanthanum antimonide (4/3)', 'Antimony lanthanum (3:4)']}",-80.14158402,-5.724398858571428,-1.2165371242857137,"['xas', 'bandstructure']",True,"[641905, 641896, 10441, 641891, 641895]",True,2021-05-12 10:56:51.169000,NM,14,10,mp-1223,,La4Sb3,"{'functional': 'PBE', 'labels': ['La', 'Sb'], 'pot_type': 'paw'}","{'La': 4.0, 'Sb': 3.0}",GGA,mp-1223,"['mp-922583', 'mp-908150', 'mp-923374', 'mp-1223', 'mp-1105013', 'mp-1115732', 'mp-1414003', 'mp-1669795', 'mp-1821907', 'mp-1604810']",0.5129917,"{'La': 8.0, 'Sb': 6.0}",458.7773937776072,[],NM,False,220,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.002236342535433,0.5129917,0,1.0259834,MP,data/source/MP/cleaned/cifs/MP-mp-1223.cif,False,,data/final/MP/graphs/La4Sb3-MP-mp-1223.json,0,True,-43m,5,0,0,0,0,0,0,0,0,1,0,1.0,False
Ag4Ge1,3,0.1,0.75,False,Ag3Ge0.75,Ag3Ge1,0.85,Other,True,Ag80Ge20,Ag-Ge,2,Supercon,Ag4Ge1,MP-mp-1229108,Ag3Ge1,Ag-Ge,Ag75Ge25,P -6 m 2,hexagonal,2.988962003813068,2.98896285,9.487541,data/final/MP/cifs/Ag4Ge1-MP-mp-1229108-synth_doped.cif,data/source/MP/raw/cifs/mp-1229108.cif,mp-1229108,0.0,,2019-01-13 04:44:27.142000,8.963697780882413,,,{'GGA': {'task_id': 'mp-1767438'}},0.0837757537499999,3.98357125,520.0,-12.78559285,-3.1963982125,{'tags': []},-12.78559285,-3.1963982125,0.0837757537499999,['bandstructure'],True,[],True,2021-05-12 10:58:49.477000,NM,4,5,mp-1229108,,Ag3Ge,"{'functional': 'PBE', 'labels': ['Ag', 'Ge_d'], 'pot_type': 'paw'}","{'Ag': 3.0, 'Ge': 1.0}",GGA,mp-1229108,"['mp-1229108', 'mp-1432156', 'mp-1767438', 'mp-1798881', 'mp-1615808']",0.0043985,"{'Ag': 3.0, 'Ge': 1.0}",73.40493335603253,[],NM,False,187,0,"[0, 0, 0, 0]",5.992104071079474e-05,0.0043985,0,0.0043985,MP,data/source/MP/cleaned/cifs/MP-mp-1229108.cif,True,,data/final/MP/graphs/Ag4Ge1-MP-mp-1229108-synth_doped.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Nb2.85Sn1Ta0.15,3,0.0749999999999999,2.0,False,Nb5.7Sn2Ta0.3,Nb6Sn2,18.3,Other,True,Nb71.25Sn25Ta3.75,Nb-Sn-Ta,3,Supercon,Nb2.85Ta0.15Sn1,MP-mp-1326,Nb6Sn2,Nb-Sn,Nb75Sn25,P m -3 n,cubic,5.334611,5.334611,5.334611,data/final/MP/cifs/Nb2.85Sn1Ta0.15-MP-mp-1326-synth_doped.cif,data/source/MP/raw/cifs/mp-1326.cif,mp-1326,0.0,,2011-05-14 09:51:48,8.694218121896231,10.17188/1189484,"@misc{osti_1189484,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Sn (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189484"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668415'}},0.0,6.59372491,520.0,-69.93787048,-8.74223381,{'tags': ['Niobium tin (3/1)']},-69.93787048,-8.74223381,-0.163862066250001,"['xas', 'elasticity', 'bandstructure']",True,"[105230, 645503, 645489, 105231, 645498, 645485, 645474, 645496, 645480, 645488, 645482, 645487, 645500, 645493, 645477, 645484, 645502, 645483, 150878, 645479, 645481, 645486, 645473]",True,2021-05-12 10:56:12.755000,NM,8,9,mp-1326,,Nb3Sn,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Sn_d'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Sn': 1.0}",GGA,mp-1326,"['mp-930046', 'mp-913770', 'mp-930577', 'mp-1326', 'mp-1440651', 'mp-1668415', 'mp-1880085', 'mp-1594093', 'mp-1594507']",0.62023085,"{'Nb': 6.0, 'Sn': 2.0}",151.81275738025872,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0081709977567491,0.62023085,0,1.2404617,MP,data/source/MP/cleaned/cifs/MP-mp-1326.cif,True,,data/final/MP/graphs/Nb2.85Sn1Ta0.15-MP-mp-1326-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
As2Pd1,1,0.0,4.0,False,As8Pd4,As8Pd4,0.0,Other,True,As66.667Pd33.333,As-Pd,2,Supercon,As2Pd1,MP-mp-20465,As8Pd4,As-Pd,As66.667Pd33.333,P a -3,cubic,6.086488,6.086488,6.086488,data/final/MP/cifs/As2Pd1-MP-mp-20465.cif,data/source/MP/raw/cifs/mp-20465.cif,mp-20465,0.0,,2014-02-21 15:42:34,7.549097307115511,10.17188/1195595,"@misc{osti_1195595,
    author = ""Persson, Kristin"",
    title = ""Materials Data on As2Pd (SG:205) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195595"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700341'}},0.0,5.24122963,520.0,-61.86797623,-5.155664685833333,{'tags': ['Palladium arsenide (1/2)']},-61.86797623,-5.155664685833333,-0.3229584791666665,"['xas', 'elasticity', 'bandstructure']",True,"[44043, 43101, 74922, 24154, 611184]",True,2021-05-12 10:56:14.760000,NM,12,8,mp-20465,,As2Pd,"{'functional': 'PBE', 'labels': ['As', 'Pd'], 'pot_type': 'paw'}","{'As': 2.0, 'Pd': 1.0}",GGA,mp-20465,"['mp-908711', 'mp-923720', 'mp-922950', 'mp-20465', 'mp-1437407', 'mp-1700341', 'mp-1785748', 'mp-1600619']",9.025e-06,"{'As': 8.0, 'Pd': 4.0}",225.4759940798934,[],NM,False,205,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.6010573607764474e-07,9.025e-06,0,3.61e-05,MP,data/source/MP/cleaned/cifs/MP-mp-20465.cif,False,,data/final/MP/graphs/As2Pd1-MP-mp-20465.json,0,True,m-3,2,0,0,0,0,0,0,1,0,0,0,1.0,False
Be22W1,1,0.0,2.0,False,Be44W2,Be44W2,4.12,Other,True,Be95.652W4.348,Be-W,2,Supercon,Be22W1,MP-mp-30444,Be44W2,Be-W,Be95.652W4.348,F d -3 m,cubic,8.177199190000001,8.17719919,8.17719919,data/final/MP/cifs/Be22W1-MP-mp-30444.cif,data/source/MP/raw/cifs/mp-30444.cif,mp-30444,0.0,,2014-02-20 05:05:08,3.28221098523202,10.17188/1204852,"@misc{osti_1204852,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Be22W (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1204852"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1729326'}},0.0176191417391304,4.81686506,520.0,-192.3468676,-4.181453643478261,{'tags': ['Beryllium tungsten (22/1)']},-192.3468676,-4.181453643478261,-0.0412271434782611,"['xas', 'elasticity', 'bandstructure']",True,"[616499, 58755]",True,2021-05-12 10:56:18.721000,NM,46,7,mp-30444,,Be22W,"{'functional': 'PBE', 'labels': ['Be_sv', 'W_pv'], 'pot_type': 'paw'}","{'Be': 22.0, 'W': 1.0}",GGA,mp-30444,"['mp-941406', 'mp-941091', 'mp-931990', 'mp-30444', 'mp-1397345', 'mp-1729326', 'mp-1838434']",2.075e-05,"{'Be': 44.0, 'W': 2.0}",386.6328344871442,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.073369778721675e-07,2.075e-05,0,4.15e-05,MP,data/source/MP/cleaned/cifs/MP-mp-30444.cif,False,,data/final/MP/graphs/Be22W1-MP-mp-30444.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ga1Ni0.207V2.793,3,0.1034999999999999,2.0,False,Ga2Ni0.414V5.586,Ga2V6,11.9,Other,True,Ga25Ni5.175V69.825,Ga-Ni-V,3,Supercon,V2.793Ni0.207Ga1,MP-mp-22568,V6Ga2,Ga-V,Ga25V75,P m -3 n,cubic,4.789645,4.789645,4.789645,data/final/MP/cifs/Ga1Ni0.207V2.793-MP-mp-22568-synth_doped.cif,data/source/MP/raw/cifs/mp-22568.cif,mp-22568,0.0,,2014-02-22 11:36:40,6.726541666276222,10.17188/1198793,"@misc{osti_1198793,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Ga (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198793"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686867'}},0.0,5.67452231,520.0,-61.95244347,-7.74405543375,{'tags': ['Gallium vanadium (1/3)']},-61.95244347,-7.74405543375,-0.1741018756249994,"['xas', 'elasticity', 'bandstructure']",True,"[635643, 635628, 635619, 635634, 104021, 635646, 635604, 635610, 635617, 635624, 635626, 635605, 635631, 635625, 635636, 635603, 104020, 635616, 635607]",True,2021-05-12 10:56:16.728000,FM,8,9,mp-22568,,V3Ga,"{'functional': 'PBE', 'labels': ['V_pv', 'Ga_d'], 'pot_type': 'paw'}","{'V': 3.0, 'Ga': 1.0}",GGA,mp-22568,"['mp-941343', 'mp-941663', 'mp-934924', 'mp-22568', 'mp-1440749', 'mp-1686867', 'mp-1804076', 'mp-1593784', 'mp-1595713']",0.09063635,"{'V': 6.0, 'Ga': 2.0}",109.87780534443452,[],FM,True,131,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.0, -0.0, -0.0]",0.0016497662965852,0.09063635,2,0.1812727,MP,data/source/MP/cleaned/cifs/MP-mp-22568.cif,True,,data/final/MP/graphs/Ga1Ni0.207V2.793-MP-mp-22568-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
C2Cu0.25La1Ni0.75,3,0.125,1.0,True,C2Cu0.25La1Ni0.75,C2La1Ni1,3.48,Other,True,C50Cu6.25La25Ni18.75,C-Cu-La-Ni,4,Supercon,La1Ni0.75Cu0.25C2,MP-mp-1018048,La1Ni1C2,C-La-Ni,C50La25Ni25,A m m 2,orthorhombic,3.82731293,3.82731293,3.977635,data/final/MP/cifs/C2Cu0.25La1Ni0.75-MP-mp-1018048-synth_doped.cif,data/source/MP/raw/cifs/mp-1018048.cif,mp-1018048,0.0,,2017-04-06 23:27:44,6.5955568384756855,10.17188/1350127,"@article{osti_1350127,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaNiC2 (SG:38) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1350127"",
    place = ""United States"",
    year = ""2017"",
    month = ""4""
}
",{'GGA': {'task_id': 'mp-1697101'}},0.0,8.87914765,520.0,-30.18892584,-7.54723146,"{'tags': ['LaNiC2', 'Lanthanum nickel carbide (1/1/2)', 'CeNiC2']}",-30.18892584,-7.54723146,-0.2548051637499995,"['bandstructure', 'elasticity']",True,[618179],True,2021-05-12 10:56:08.727000,NM,4,12,mp-1018048,,LaNiC2,"{'functional': 'PBE', 'labels': ['La', 'Ni_pv', 'C'], 'pot_type': 'paw'}","{'La': 1.0, 'Ni': 1.0, 'C': 2.0}",GGA,mp-1018048,"['mp-1018048', 'mp-1018270', 'mp-1018463', 'mp-1067001', 'mp-1067047', 'mp-1067181', 'mp-1115476', 'mp-1412950', 'mp-1697101', 'mp-1783297', 'mp-1594865', 'mp-1067093']",0.005804,"{'La': 1.0, 'Ni': 1.0, 'C': 2.0}",55.79651958097468,[],NM,False,38,0,"[0.0, -0.0, 0.0, 0.0]",0.0001040208250189,0.005804,0,0.005804,MP,data/source/MP/cleaned/cifs/MP-mp-1018048.cif,True,,data/final/MP/graphs/C2Cu0.25La1Ni0.75-MP-mp-1018048-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Rh3V1,1,0.0,2.0,False,Rh6V2,Rh6V2,0.0,Other,True,Rh75V25,Rh-V,2,Supercon,Rh3V1,MP-mp-866161,V2Rh6,Rh-V,Rh75V25,P 63/m m c,hexagonal,4.325929,5.434623998634276,5.43462448,data/final/MP/cifs/Rh3V1-MP-mp-866161.cif,data/source/MP/raw/cifs/mp-866161.cif,mp-866161,0.0,,2014-09-01 18:32:46,10.79492782778709,10.17188/1311415,"@misc{osti_1311415,
    author = ""Persson, Kristin"",
    title = ""Materials Data on VRh3 (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1311415"",
    place = ""United States"",
    year = ""2016"",
    month = ""8"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1751681'}},0.0,6.91728295,520.0,-65.39319864,-8.17414983,{'tags': []},-65.39319864,-8.17414983,-0.3799424099999999,"['bandstructure', 'elasticity']",True,[],True,2021-05-12 10:56:33.121000,NM,8,8,mp-866161,,VRh3,"{'functional': 'PBE', 'labels': ['V_pv', 'Rh_pv'], 'pot_type': 'paw'}","{'V': 1.0, 'Rh': 3.0}",GGA,mp-866161,"['mp-1004864', 'mp-1003249', 'mp-866161', 'mp-1400696', 'mp-1751681', 'mp-1805041', 'mp-1010517', 'mp-1619275']",0.00062295,"{'V': 2.0, 'Rh': 6.0}",110.64940296829224,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.125988904212186e-05,0.00062295,0,0.0012459,MP,data/source/MP/cleaned/cifs/MP-mp-866161.cif,False,,data/final/MP/graphs/Rh3V1-MP-mp-866161.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Co1.95Cu1Rh0.05S4,2,0.0142857142857142,2.0,False,Co3.9Cu2Rh0.1S8,Co4Cu2S8,0.0,Other,True,Co27.857Cu14.286Rh0.714S57.143,Co-Cu-Rh-S,4,Supercon,Cu1Co1.95Rh0.05S4,MP-mp-3925,Co4Cu2S8,Co-Cu-S,Co28.571Cu14.286S57.143,F d -3 m,cubic,6.69987918,6.699879179999999,6.699879179999999,data/final/MP/cifs/Co1.95Cu1Rh0.05S4-MP-mp-3925-synth_doped.cif,data/source/MP/raw/cifs/mp-3925.cif,mp-3925,0.0,,2011-05-15 03:07:38,4.836104359598833,10.17188/1207634,"@misc{osti_1207634,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Co2CuS4 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207634"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698326'}},0.0,5.68331854,520.0,-75.59837827,-5.399884162142857,"{'tags': ['Cobalt copper sulfide (2/1/4)', 'Carrollite', 'Dicobalt(III) copper sulfide']}",-75.59837827,-5.399884162142857,-0.7070782010714284,"['xas', 'bandstructure']",True,"[622571, 31107, 52943]",True,2021-05-12 10:57:08.928000,NM,14,8,mp-3925,,Co2CuS4,"{'functional': 'PBE', 'labels': ['Co', 'Cu_pv', 'S'], 'pot_type': 'paw'}","{'Co': 2.0, 'Cu': 1.0, 'S': 4.0}",GGA,mp-3925,"['mp-931396', 'mp-915858', 'mp-932359', 'mp-3925', 'mp-1425952', 'mp-1698326', 'mp-1833413', 'mp-1599756']",0.00593025,"{'Co': 4.0, 'Cu': 2.0, 'S': 8.0}",212.6600516474575,[],NM,False,227,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",5.5772110972972206e-05,0.00593025,0,0.0118605,MP,data/source/MP/cleaned/cifs/MP-mp-3925.cif,True,,data/final/MP/graphs/Co1.95Cu1Rh0.05S4-MP-mp-3925-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
C1Tc1,1,0.0,1.0,True,C1Tc1,C1Tc1,3.85,Other,True,C50Tc50,C-Tc,2,Supercon,C1Tc1,MP-mp-1009848,Tc1C1,C-Tc,C50Tc50,F -4 3 m,cubic,3.27623785,3.276237849999999,3.27623785,data/final/MP/cifs/C1Tc1-MP-mp-1009848.cif,data/source/MP/raw/cifs/mp-1009848.cif,mp-1009848,0.0,,2016-09-24 09:37:06,7.34636925218763,10.17188/1326320,"@misc{osti_1326320,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TcC (SG:216) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1326320"",
    place = ""United States"",
    year = ""2016"",
    month = ""9"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672862'}},0.5570984700000015,6.37112443,520.0,-18.47320367,-9.236601835,{'tags': ['Technetium carbide (1/1) - ZB-type']},-18.47320367,-9.236601835,0.5570984700000015,"['xas', 'elasticity', 'bandstructure']",True,[183168],True,2021-05-12 10:56:08.727000,FM,2,10,mp-1009848,,TcC,"{'functional': 'PBE', 'labels': ['Tc_pv', 'C'], 'pot_type': 'paw'}","{'Tc': 1.0, 'C': 1.0}",GGA,mp-1009848,"['mp-1009848', 'mp-1009875', 'mp-1060926', 'mp-1060942', 'mp-1061009', 'mp-1504923', 'mp-1672862', 'mp-1795627', 'mp-1609767', 'mp-1060989']",1.0003417,"{'Tc': 1.0, 'C': 1.0}",24.86630590200925,[],FM,True,216,1,"[1.0, 0.0]",0.040228802136596,1.0003417,1,1.0003417,MP,data/source/MP/cleaned/cifs/MP-mp-1009848.cif,False,,data/final/MP/graphs/C1Tc1-MP-mp-1009848.json,0,True,-43m,5,0,0,0,0,0,0,0,0,0,1,1.0,False
B2C1Dy0.7Lu0.3Ni2,3,0.1,1.0,True,B2C1Dy0.7Lu0.3Ni2,B2C1Dy1Ni2,2.0,Other,True,B33.333C16.667Dy11.667Lu5Ni33.333,B-C-Dy-Lu-Ni,5,Supercon,Lu0.3Dy0.7Ni2B2C1,MP-mp-6223,Dy1Ni2B2C1,B-C-Dy-Ni,B33.333C16.667Dy16.667Ni33.333,I 4/m m m,tetragonal,3.5485979995620824,3.548597999562083,5.74460959,data/final/MP/cifs/B2C1Dy0.7Lu0.3Ni2-MP-mp-6223-synth_doped.cif,data/source/MP/raw/cifs/mp-6223.cif,mp-6223,0.0,,2011-05-13 04:15:09,8.00036369104547,10.17188/1278123,"@misc{osti_1278123,
    author = ""Persson, Kristin"",
    title = ""Materials Data on DyNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278123"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687390'}},0.0,6.75219219,520.0,-41.84976027,-6.974960045,{'tags': []},-41.84976027,-6.974960045,-0.5161893047222215,"['xas', 'elasticity', 'bandstructure']",True,"[56596, 56593, 56595, 79573, 56649, 56594]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-6223,,DyNi2B2C,"{'functional': 'PBE', 'labels': ['Dy_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Dy': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6223,"['mp-1007344', 'mp-1000899', 'mp-6223', 'mp-1439353', 'mp-1687390', 'mp-1795426', 'mp-1012086', 'mp-1593735']",0.004911,"{'Dy': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.07346390684725,[],NM,False,139,0,"[0.0, -0.0, -0.0, 0.0, 0.0, 0.0]",7.546855054512086e-05,0.004911,0,0.004911,MP,data/source/MP/cleaned/cifs/MP-mp-6223.cif,True,,data/final/MP/graphs/B2C1Dy0.7Lu0.3Ni2-MP-mp-6223-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Be2W1,1,0.0,4.0,False,Be8W4,Be8W4,0.0,Other,True,Be66.667W33.333,Be-W,2,Supercon,Be2W1,MP-mp-11282,Be8W4,Be-W,Be66.667W33.333,P 63/m m c,hexagonal,4.460439999069455,4.46044056,7.333617,data/final/MP/cifs/Be2W1-MP-mp-11282.cif,data/source/MP/raw/cifs/mp-11282.cif,mp-11282,0.0,,2011-05-29 12:20:34,10.611197878923038,10.17188/1187705,"@misc{osti_1187705,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Be2W (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187705"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699629'}},0.0,5.38159311,520.0,-85.39092774,-7.115910645,"{'tags': ['Tungsten beryllide (1/2)', 'Beryllium tungsten (2/1)']}",-85.39092774,-7.115910645,-0.3035932449999994,"['xas', 'elasticity', 'bandstructure']",True,"[58754, 616501]",True,2021-05-12 10:56:10.715000,NM,12,9,mp-11282,,Be2W,"{'functional': 'PBE', 'labels': ['Be_sv', 'W_pv'], 'pot_type': 'paw'}","{'Be': 2.0, 'W': 1.0}",GGA,mp-11282,"['mp-11282', 'mp-928740', 'mp-928240', 'mp-1102765', 'mp-912170', 'mp-1428453', 'mp-1699629', 'mp-1934315', 'mp-1600851']",2.58e-05,"{'Be': 8.0, 'W': 4.0}",126.3584625981486,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",8.167240869984445e-07,2.58e-05,0,0.0001032,MP,data/source/MP/cleaned/cifs/MP-mp-11282.cif,False,,data/final/MP/graphs/Be2W1-MP-mp-11282.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
N1Se1,1,0.0,16.0,False,N16Se16,N16Se16,0.0,Other,True,N50Se50,N-Se,2,Supercon,N1Se1,MP-mp-542635,Se16N16,N-Se,N50Se50,P 1 21/c 1,monoclinic,7.903606,9.247483,9.659041783926895,data/final/MP/cifs/N1Se1-MP-mp-542635.cif,data/source/MP/raw/cifs/mp-542635.cif,mp-542635,1.8845,,2013-10-01 19:11:51,3.5055148127604587,10.17188/1266613,"@misc{osti_1266613,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SeN (SG:14) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1266613"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1730651'}},0.6339892010156252,0.79519373,520.0,-163.25484801,-5.1017140003125,{'tags': ['Selenium nitride (4/4) - beta']},-163.25484801,-5.1017140003125,0.6339892010156252,"['xas', 'bandstructure']",True,[74838],True,2021-05-12 10:57:15.388000,NM,32,7,mp-542635,,SeN,"{'functional': 'PBE', 'labels': ['Se', 'N'], 'pot_type': 'paw'}","{'Se': 1.0, 'N': 1.0}",GGA,mp-542635,"['mp-660720', 'mp-670374', 'mp-542635', 'mp-1397469', 'mp-1730651', 'mp-1873729', 'mp-1000109']",7.9275e-05,"{'Se': 16.0, 'N': 16.0}",704.6033258496166,[],NM,False,14,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.8001618122800552e-06,7.9275e-05,0,0.0012684,MP,data/source/MP/cleaned/cifs/MP-mp-542635.cif,False,,data/final/MP/graphs/N1Se1-MP-mp-542635.json,0,True,2/m,0,0,3,0,0,0,0,1,0,0,0,1.0,False
Pd2Sn1,1,0.0,4.0,False,Pd8Sn4,Pd8Sn4,0.41,Other,True,Pd66.667Sn33.333,Pd-Sn,2,Supercon,Pd2Sn1,MP-mp-1851,Sn4Pd8,Pd-Sn,Pd66.667Sn33.333,P n m a,orthorhombic,4.330085,5.727989,8.389484,data/final/MP/cifs/Pd2Sn1-MP-mp-1851.cif,data/source/MP/raw/cifs/mp-1851.cif,mp-1851,0.0,,2011-05-15 20:57:04,10.5833771744582,10.17188/1193143,"@misc{osti_1193143,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SnPd2 (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1193143"",
    place = ""United States"",
    year = ""2016"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700126'}},0.0,7.60498228,520.0,-63.96543134,-5.330452611666667,"{'tags': ['Palladium tin (2/1) - nanocrystalline', 'Palladium tin (2/1)', 'Paolovite']}",-63.96543134,-5.330452611666667,-0.5406741200000003,"['xas', 'elasticity', 'bandstructure']",True,"[158363, 185001, 158364, 158365, 42595, 185002]",True,2021-05-12 10:56:14.760000,NM,12,10,mp-1851,,SnPd2,"{'functional': 'PBE', 'labels': ['Sn_d', 'Pd'], 'pot_type': 'paw'}","{'Sn': 1.0, 'Pd': 2.0}",GGA,mp-1851,"['mp-914917', 'mp-930997', 'mp-1851', 'mp-1095645', 'mp-1103245', 'mp-1421467', 'mp-1700126', 'mp-1835925', 'mp-992527', 'mp-1592303']",0.001961325,"{'Sn': 4.0, 'Pd': 8.0}",208.08168071716284,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.770298266027466e-05,0.001961325,0,0.0078453,MP,data/source/MP/cleaned/cifs/MP-mp-1851.cif,False,,data/final/MP/graphs/Pd2Sn1-MP-mp-1851.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ce0.05Cu2Gd0.95Ru1Sr2O8,2,0.0071428571428571,2.0,False,Ce0.1Cu4Gd1.9Ru2Sr4O16,Cu4Gd2Ru2Sr4O16,0.0,Cuprate,True,Ce0.357Cu14.286Gd6.786Ru7.143Sr14.286O57.142857142857146,Ce-Cu-Gd-Ru-Sr-O,6,Supercon,Ru1Sr2Gd0.95Ce0.05Cu2O8,MP-mp-1194240,Sr4Gd2Cu4Ru2O16,Cu-Gd-Ru-Sr-O,Cu14.286Gd7.143Ru7.143Sr14.286O57.142857142857146,P 4/m b m,tetragonal,5.472451,5.472451,11.740702,data/final/MP/cifs/Ce0.05Cu2Gd0.95Ru1Sr2O8-MP-mp-1194240-synth_doped.cif,data/source/MP/raw/cifs/mp-1194240.cif,mp-1194240,0.0,,2019-01-11 23:51:58.932000,6.504561898971391,,,{'GGA': {'task_id': 'mp-1765260'}},0.0213449239285443,3.93502801,520.0,-201.55352223,-7.198340079642857,"{'tags': ['Sr2Cu2GdRuO8 orth', 'Sr2Cu2GdRuO8', 'Ruthenium distrontium gadolinium dicopper octaoxide']}",-201.55352223,-7.198340079642857,-2.268654352380952,['bandstructure'],True,[245741],True,2021-05-12 10:58:35.561000,FiM,28,6,mp-1194240,oxide,Sr2GdCu2RuO8,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Gd', 'Cu_pv', 'Ru_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Gd': 1.0, 'Cu': 2.0, 'Ru': 1.0, 'O': 8.0}",GGA,mp-1194240,"['mp-1194240', 'mp-1396976', 'mp-1659973', 'mp-1765260', 'mp-1841948', 'mp-1638264']",4.23696715,"{'Sr': 4.0, 'Gd': 2.0, 'Cu': 4.0, 'Ru': 2.0, 'O': 16.0}",351.6072554818909,[],FiM,True,127,2,"[-0.0, -0.0, -0.0, -0.0, 6.9, 6.9, 0.0, 0.0, 0.0, 0.0, -1.8, -1.8, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0241005672319991,4.23696715,4,8.4739343,MP,data/source/MP/cleaned/cifs/MP-mp-1194240.cif,True,,data/final/MP/graphs/Ce0.05Cu2Gd0.95Ru1Sr2O8-MP-mp-1194240-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ba0.34Bi1K0.66O3,2,0.0026666666666666,3.0,False,Ba1.02Bi3K1.98O9,Ba1Bi3K2O9,7.0,Oxide,True,Ba6.8Bi20K13.2O60,Ba-Bi-K-O,4,Supercon,Ba0.34K0.66Bi1O3,MP-mp-1223672,K2Ba1Bi3O9,Ba-Bi-K-O,Ba6.667Bi20K13.333O60,P -3 m 1,trigonal,6.104433996276926,6.1044332,7.481113,data/final/MP/cifs/Ba0.34Bi1K0.66O3-MP-mp-1223672-synth_doped.cif,data/source/MP/raw/cifs/mp-1223672.cif,mp-1223672,0.0,,2019-01-13 00:02:05.715000,6.784857598202287,,,{'GGA': {'task_id': 'mp-1736675'}},0.0209399281666646,2.58339382,520.0,-80.80971432,-5.387314288,{'tags': []},-80.80971432,-5.387314288,-1.7767462414000008,[],False,[],True,2021-05-12 11:00:52.054000,NM,15,4,mp-1223672,oxide,K2Ba(BiO3)3,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Bi', 'O'], 'pot_type': 'paw'}","{'K': 2.0, 'Ba': 1.0, 'Bi': 3.0, 'O': 9.0}",GGA,mp-1223672,"['mp-1223672', 'mp-1408017', 'mp-1736675', 'mp-1774751']",0.001083,"{'K': 2.0, 'Ba': 1.0, 'Bi': 3.0, 'O': 9.0}",241.4279662625217,[],NM,False,164,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.485810060721703e-06,0.001083,0,0.001083,MP,data/source/MP/cleaned/cifs/MP-mp-1223672.cif,True,,data/final/MP/graphs/Ba0.34Bi1K0.66O3-MP-mp-1223672-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ce1Ir1Si3,1,0.0,1.0,True,Ce1Ir1Si3,Ce1Ir1Si3,1.53,Heavy_fermion,True,Ce20Ir20Si60,Ce-Ir-Si,3,Supercon,Ce1Ir1Si3,MP-mp-1068906,Ce1Si3Ir1,Ce-Ir-Si,Ce20Ir20Si60,I 4 m m,tetragonal,4.234129999702719,4.234129999702719,5.74890503,data/final/MP/cifs/Ce1Ir1Si3-MP-mp-1068906.cif,data/source/MP/raw/cifs/mp-1068906.cif,mp-1068906,0.0,,2018-03-21 23:52:58,7.8622504627962035,,,{'GGA': {'task_id': 'mp-1697688'}},0.0,9.26380379,520.0,-35.24129872,-7.048259744000001,"{'tags': ['BaNiSn3', 'Cerium iridium silicide (1/1/3)', 'CeIrSi3']}",-35.24129872,-7.048259744000001,-0.8387674170000011,['bandstructure'],True,[621428],True,2021-05-12 10:58:14.654000,FM,5,8,mp-1068906,,CeSi3Ir,"{'functional': 'PBE', 'labels': ['Ce', 'Si', 'Ir'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Si': 3.0, 'Ir': 1.0}",GGA,mp-1068906,"['mp-1069059', 'mp-1068906', 'mp-1068980', 'mp-1436934', 'mp-1697688', 'mp-1798320', 'mp-1590007', 'mp-1069036']",0.3841196,"{'Ce': 1.0, 'Si': 3.0, 'Ir': 1.0}",87.9853857058804,[],FM,True,107,1,"[0.3, 0.0, 0.0, 0.0, 0.0]",0.0043657204763987,0.3841196,1,0.3841196,MP,data/source/MP/cleaned/cifs/MP-mp-1068906.cif,False,,data/final/MP/graphs/Ce1Ir1Si3-MP-mp-1068906.json,0,True,4mm,0,0,0,0,5,0,0,0,0,1,0,1.0,False
Bi1Ca0.25K0.75O3,3,0.1,1.0,True,Bi1Ca0.25K0.75O3,Bi1K1O3,8.7,Oxide,True,Bi20Ca5K15O60,Bi-Ca-K-O,4,Supercon,K0.75Ca0.25Bi1O3,MP-mp-982040,K1Bi1O3,Bi-K-O,Bi20K20O60,P m -3 m,cubic,4.284204,4.284204,4.284204,data/final/MP/cifs/Bi1Ca0.25K0.75O3-MP-mp-982040-synth_doped.cif,data/source/MP/raw/cifs/mp-982040.cif,mp-982040,0.0,,2015-10-12 11:25:13,6.252348761231978,10.17188/1316390,"@misc{osti_1316390,
    author = ""Persson, Kristin"",
    title = ""Materials Data on KBiO3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1316390"",
    place = ""United States"",
    year = ""2016"",
    month = ""9"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1717462'}},0.0928686834999998,1.80216133,520.0,-25.20286901,-5.040573802,{'tags': []},-25.20286901,-5.040573802,-1.4839105476,"['xas', 'elasticity']",False,[],True,2021-05-12 10:56:37.246000,NM,5,9,mp-982040,oxide,KBiO3,"{'functional': 'PBE', 'labels': ['K_sv', 'Bi', 'O'], 'pot_type': 'paw'}","{'K': 1.0, 'Bi': 1.0, 'O': 3.0}",GGA,mp-982040,"['mp-982222', 'mp-1006156', 'mp-982040', 'mp-1006117', 'mp-1431172', 'mp-1717462', 'mp-1798749', 'mp-1011221', 'mp-1585048']",0.0005425,"{'K': 1.0, 'Bi': 1.0, 'O': 3.0}",78.63401066432932,[],NM,False,221,0,"[0, 0, 0, 0, 0]",6.899050365315956e-06,0.0005425,0,0.0005425,MP,data/source/MP/cleaned/cifs/MP-mp-982040.cif,True,,data/final/MP/graphs/Bi1Ca0.25K0.75O3-MP-mp-982040-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Al1Pd2Y1,1,0.0,2.0,False,Al2Pd4Y2,Al2Pd4Y2,0.0,Other,True,Al25Pd50Y25,Al-Pd-Y,3,Supercon,Pd2Al1Y1,MP-mp-1078242,Y2Al2Pd4,Al-Pd-Y,Al25Pd50Y25,P 63/m m c,hexagonal,4.374145995209535,4.37414638,9.190463,data/final/MP/cifs/Al1Pd2Y1-MP-mp-1078242.cif,data/source/MP/raw/cifs/mp-1078242.cif,mp-1078242,0.0,,2018-04-11 01:46:24,7.169029371325574,,,{'GGA': {'task_id': 'mp-1703612'}},0.0,5.16117824,520.0,-48.68920513,-6.08615064125,{'tags': ['Yttrium palladium aluminide (1/2/1)']},-48.68920513,-6.08615064125,-0.9431980004166656,['bandstructure'],True,[430934],True,2021-05-12 10:58:14.654000,NM,8,7,mp-1078242,,YAlPd2,"{'functional': 'PBE', 'labels': ['Y_sv', 'Al', 'Pd'], 'pot_type': 'paw'}","{'Y': 1.0, 'Al': 1.0, 'Pd': 2.0}",GGA,mp-1078242,"['mp-1078242', 'mp-1248502', 'mp-1265508', 'mp-1427233', 'mp-1703612', 'mp-1868743', 'mp-1596152']",0.00011985,"{'Y': 2.0, 'Al': 2.0, 'Pd': 4.0}",152.2841218129275,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.5740314692457431e-06,0.00011985,0,0.0002397,MP,data/source/MP/cleaned/cifs/MP-mp-1078242.cif,False,,data/final/MP/graphs/Al1Pd2Y1-MP-mp-1078242.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
In0.82Te1,3,0.0989010989010989,1.0,True,In0.82Te1,In1Te1,1.04,Other,True,In45.055Te54.945,In-Te,2,Supercon,In0.82Te1,MP-mp-2597,In1Te1,In-Te,In50Te50,F m -3 m,cubic,4.44363296,4.44363296,4.44363296,data/final/MP/cifs/In0.82Te1-MP-mp-2597-synth_doped.cif,data/source/MP/raw/cifs/mp-2597.cif,mp-2597,0.0,,2011-05-12 18:35:42,6.488053472608879,10.17188/1201088,"@misc{osti_1201088,
    author = ""Persson, Kristin"",
    title = ""Materials Data on InTe (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201088"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668520'}},0.0,6.3140604,520.0,-6.47268679,-3.236343395,"{'tags': ['Indium telluride (1/1)', 'Indium tellurium (1/1) - HP, HT', 'High pressure experimental phase', 'Indium telluride  - II']}",-6.47268679,-3.236343395,-0.4998510649999996,"['xas', 'elasticity', 'bandstructure']",True,"[169425, 44653, 169422, 59547, 169428, 640620, 640614, 169431, 169419, 640622]",True,2021-05-12 10:56:18.721000,NM,2,9,mp-2597,,InTe,"{'functional': 'PBE', 'labels': ['In_d', 'Te'], 'pot_type': 'paw'}","{'In': 1.0, 'Te': 1.0}",GGA,mp-2597,"['mp-1000805', 'mp-1007252', 'mp-2597', 'mp-1440879', 'mp-1668520', 'mp-1793575', 'mp-1011993', 'mp-1588148', 'mp-1589064']",0.0001824,"{'In': 1.0, 'Te': 1.0}",62.04396451824765,[],NM,False,225,0,"[0, 0]",2.939850820563773e-06,0.0001824,0,0.0001824,MP,data/source/MP/cleaned/cifs/MP-mp-2597.cif,True,,data/final/MP/graphs/In0.82Te1-MP-mp-2597-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ge2Nb1,1,0.0,3.0,False,Ge6Nb3,Ge6Nb3,0.0,Other,True,Ge66.667Nb33.333,Ge-Nb,2,Supercon,Ge2Nb1,MP-mp-363,Nb3Ge6,Ge-Nb,Ge66.667Nb33.333,P 62 2 2,hexagonal,5.013320002980824,5.01331959,6.841712,data/final/MP/cifs/Ge2Nb1-MP-mp-363.cif,data/source/MP/raw/cifs/mp-363.cif,mp-363,0.0,,2011-05-15 02:03:28,7.967848181519302,10.17188/1207160,"@misc{osti_1207160,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbGe2 (SG:180) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207160"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702460'}},0.0,5.63386616,520.0,-61.13231537,-6.792479485555556,{'tags': ['Niobium germanide (1/2)']},-61.13231537,-6.792479485555556,-0.3433592355555556,"['xas', 'elasticity', 'bandstructure']",True,"[77315, 26572, 637217, 16503, 637199, 637208]",True,2021-05-12 10:56:20.740000,NM,9,9,mp-363,,NbGe2,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Ge_d'], 'pot_type': 'paw'}","{'Nb': 1.0, 'Ge': 2.0}",GGA,mp-363,"['mp-1000581', 'mp-1007056', 'mp-363', 'mp-1116308', 'mp-1416105', 'mp-1702460', 'mp-1875880', 'mp-1011800', 'mp-1594785']",0.0074382999999999,"{'Nb': 3.0, 'Ge': 6.0}",148.9176676481112,[],NM,False,180,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0001498472300327,0.0074382999999999,0,0.0223149,MP,data/source/MP/cleaned/cifs/MP-mp-363.cif,False,,data/final/MP/graphs/Ge2Nb1-MP-mp-363.json,0,True,622,0,4,0,0,0,0,0,1,0,0,0,1.0,False
P1S1Ta1,1,0.0,2.0,False,P2S2Ta2,P2S2Ta2,0.0,Other,True,P33.333S33.333Ta33.333,P-S-Ta,3,Supercon,P1S1Ta1,MP-mp-1077589,Ta2P2S2,P-S-Ta,P33.333S33.333Ta33.333,I m m m,orthorhombic,3.455083997895956,4.744335997581219,6.64898744,data/final/MP/cifs/P1S1Ta1-MP-mp-1077589.cif,data/source/MP/raw/cifs/mp-1077589.cif,mp-1077589,0.0,,2018-04-09 11:08:56,8.285174110472338,,,{'GGA': {'task_id': 'mp-1697873'}},0.0557497909333335,8.18466996,520.0,-47.49384599,-7.915640998333333,"{'tags': ['NbPS', 'TaPS', 'Tantalum phosphorus sulfide (1/1/1)']}",-47.49384599,-7.915640998333333,-0.9474643304861108,['bandstructure'],True,[648183],True,2021-05-12 10:58:14.654000,NM,6,5,mp-1077589,,TaPS,"{'functional': 'PBE', 'labels': ['Ta_pv', 'P', 'S'], 'pot_type': 'paw'}","{'Ta': 1.0, 'P': 1.0, 'S': 1.0}",GGA,mp-1077589,"['mp-1077589', 'mp-1419048', 'mp-1697873', 'mp-1796532', 'mp-1590480']",2.805e-05,"{'Ta': 2.0, 'P': 2.0, 'S': 2.0}",97.80104687418589,[],NM,False,71,0,"[0, 0, 0, 0, 0, 0]",5.73613491808208e-07,2.805e-05,0,5.61e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1077589.cif,False,,data/final/MP/graphs/P1S1Ta1-MP-mp-1077589.json,0,True,mmm,0,0,0,7,0,0,0,0,0,1,0,1.0,False
La0.9Rh1Sr0.1O3,2,0.0399999999999999,4.0,False,La3.6Rh4Sr0.4O12,La4Rh4O12,0.0,Oxide,True,La18Rh20Sr2O60,La-Rh-Sr-O,4,Supercon,La0.9Sr0.1Rh1O3,MP-mp-5163,La4Rh4O12,La-Rh-O,La20Rh20O60,P n m a,orthorhombic,5.52133,5.878627,7.945444,data/final/MP/cifs/La0.9Rh1Sr0.1O3-MP-mp-5163-synth_doped.cif,data/source/MP/raw/cifs/mp-5163.cif,mp-5163,0.5966000000000005,,2011-05-17 17:12:22,7.464202806132534,10.17188/1263117,"@misc{osti_1263117,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaRhO3 (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1263117"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1669959'}},0.0,6.96122652,520.0,-151.23299048,-7.561649524000001,{'tags': ['Lanthanum rhodium trioxide']},-151.23299048,-7.561649524000001,-2.545009926000001,"['xas', 'elasticity', 'bandstructure']",True,"[172347, 172353]",True,2021-05-12 10:56:20.740000,NM,20,8,mp-5163,oxide,LaRhO3,"{'functional': 'PBE', 'labels': ['La', 'Rh_pv', 'O'], 'pot_type': 'paw'}","{'La': 1.0, 'Rh': 1.0, 'O': 3.0}",GGA,mp-5163,"['mp-678721', 'mp-663626', 'mp-5163', 'mp-1418173', 'mp-1669959', 'mp-1864388', 'mp-1603172', 'mp-699951']",0.0001943,"{'La': 4.0, 'Rh': 4.0, 'O': 12.0}",257.8919470133035,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.0136652539984423e-06,0.0001943,0,0.0007772,MP,data/source/MP/cleaned/cifs/MP-mp-5163.cif,True,,data/final/MP/graphs/La0.9Rh1Sr0.1O3-MP-mp-5163-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Al0.35Ga0.65Nb3,3,0.075,2.0,False,Al0.7Ga1.3Nb6,Al1Ga1Nb6,18.1,Other,True,Al8.75Ga16.25Nb75,Al-Ga-Nb,3,Supercon,Nb3Ga0.65Al0.35,MP-mp-1220348,Nb6Al1Ga1,Al-Ga-Nb,Al12.5Ga12.5Nb75,P m -3,cubic,5.200229,5.200229,5.200229,data/final/MP/cifs/Al0.35Ga0.65Nb3-MP-mp-1220348-synth_doped.cif,data/source/MP/raw/cifs/mp-1220348.cif,mp-1220348,0.0,,2019-01-12 21:12:34.707000,7.724213490019127,,,{'GGA': {'task_id': 'mp-1752644'}},0.0490749666875007,5.24232507,520.0,-68.77635789,-8.59704473625,{'tags': []},-68.77635789,-8.59704473625,-0.1743569746875,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,8,5,mp-1220348,,Nb6AlGa,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al', 'Ga_d'], 'pot_type': 'paw'}","{'Nb': 6.0, 'Al': 1.0, 'Ga': 1.0}",GGA,mp-1220348,"['mp-1220348', 'mp-1411514', 'mp-1752644', 'mp-1787843', 'mp-1619126']",0.0457429,"{'Nb': 6.0, 'Al': 1.0, 'Ga': 1.0}",140.62657729809163,[],NM,False,200,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0003252791960017,0.0457429,0,0.0457429,MP,data/source/MP/cleaned/cifs/MP-mp-1220348.cif,True,,data/final/MP/graphs/Al0.35Ga0.65Nb3-MP-mp-1220348-synth_doped.json,0,True,m-3,2,0,0,0,0,0,0,1,0,0,0,1.0,False
Be13La1,1,0.0,2.0,False,Be26La2,Be26La2,0.0,Other,True,Be92.857La7.143,Be-La,2,Supercon,Be13La1,MP-mp-1193251,La2Be26,Be-La,Be92.857La7.143,F m -3 c,cubic,7.34805851,7.348058509999999,7.348058509999999,data/final/MP/cifs/Be13La1-MP-mp-1193251.cif,data/source/MP/raw/cifs/mp-1193251.cif,mp-1193251,0.0,,2019-01-11 23:06:03.013000,3.031269299852123,,,{'GGA': {'task_id': 'mp-1672132'}},0.0,5.01665119,520.0,-110.9166676,-3.961309557142857,"{'tags': ['Beryllium lanthanum (13/1)', 'Be13La', 'NaZn13']}",-110.9166676,-3.961309557142857,-0.1364256750000001,['bandstructure'],True,"[616302, 616304, 616306]",True,2021-05-12 10:58:35.561000,NM,28,7,mp-1193251,,LaBe13,"{'functional': 'PBE', 'labels': ['La', 'Be_sv'], 'pot_type': 'paw'}","{'La': 1.0, 'Be': 13.0}",GGA,mp-1193251,"['mp-1193251', 'mp-1193667', 'mp-1194056', 'mp-1421642', 'mp-1672132', 'mp-1860822', 'mp-1607715']",0.00013385,"{'La': 2.0, 'Be': 26.0}",280.54518497726247,[],NM,False,226,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",9.542134897866683e-07,0.00013385,0,0.0002677,MP,data/source/MP/cleaned/cifs/MP-mp-1193251.cif,False,,data/final/MP/graphs/Be13La1-MP-mp-1193251.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
La1Si2,1,0.0,2.0,False,La2Si4,La2Si4,1.6,Other,True,La33.333Si66.667,La-Si,2,Supercon,La1Si2,MP-mp-2062,La2Si4,La-Si,La33.333Si66.667,I 41/a m d,tetragonal,4.348065997848206,4.348065997848206,7.55718014,data/final/MP/cifs/La1Si2-MP-mp-2062.cif,data/source/MP/raw/cifs/mp-2062.cif,mp-2062,0.0,,2011-05-12 22:29:59,4.963902180282632,10.17188/1195754,"@misc{osti_1195754,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaSi2 (SG:141) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195754"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688253'}},0.0,8.84383904,520.0,-35.54639764,-5.924399606666667,"{'tags': ['Lanthanum silicide (1/2)', 'Lanthanum silicon (1/2)', 'Lanthanum disilicide', 'Lantahnum disilicide']}",-35.54639764,-5.924399606666667,-0.6148545583333339,"['xas', 'elasticity', 'bandstructure']",True,"[641955, 641973, 25663, 641961, 641982, 78028, 174010]",True,2021-05-12 10:56:14.760000,NM,6,23,mp-2062,,LaSi2,"{'functional': 'PBE', 'labels': ['La', 'Si'], 'pot_type': 'paw'}","{'La': 1.0, 'Si': 2.0}",GGA,mp-2062,"['mp-924244', 'mp-923752', 'mp-917425', 'mp-2062', 'mp-1071454', 'mp-1071476', 'mp-1071490', 'mp-1071770', 'mp-1071807', 'mp-1071840', 'mp-1072189', 'mp-1072207', 'mp-1072237', 'mp-1125317', 'mp-1146460', 'mp-1267561', 'mp-1439667', 'mp-1688253', 'mp-1779328', 'mp-1591569', 'mp-1072230', 'mp-1071836', 'mp-1071499']",0.002104,"{'La': 2.0, 'Si': 4.0}",130.51510188743444,[],NM,False,141,0,"[0, 0, 0, 0, 0, 0]",3.2241479638343154e-05,0.002104,0,0.004208,MP,data/source/MP/cleaned/cifs/MP-mp-2062.cif,False,,data/final/MP/graphs/La1Si2-MP-mp-2062.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Fe1Se0.39Te0.61,3,0.1099999999999999,2.0,False,Fe2Se0.78Te1.22,Fe2Se1Te1,14.0,Ferrite,True,Fe50Se19.5Te30.5,Fe-Se-Te,3,Supercon,Fe1Se0.39Te0.61,MP-mp-1225136,Fe2Te1Se1,Fe-Se-Te,Fe50Se25Te25,P 4 m m,tetragonal,3.755398,3.755398,5.937717,data/final/MP/cifs/Fe1Se0.39Te0.61-MP-mp-1225136-synth_doped.cif,data/source/MP/raw/cifs/mp-1225136.cif,mp-1225136,0.0,,2019-01-13 01:17:25.998000,6.310824077785493,,,{'GGA': {'task_id': 'mp-1764167'}},0.0802741556250001,4.86336573,520.0,-24.0729629,-6.018240725,{'tags': []},-24.0729629,-6.018240725,-0.3469333980859375,['bandstructure'],True,[],True,2021-05-12 10:58:45.495000,FM,4,5,mp-1225136,,Fe2TeSe,"{'functional': 'PBE', 'labels': ['Fe_pv', 'Te', 'Se'], 'pot_type': 'paw'}","{'Fe': 2.0, 'Te': 1.0, 'Se': 1.0}",GGA,mp-1225136,"['mp-1225136', 'mp-1425562', 'mp-1764167', 'mp-1784460', 'mp-1615275']",0.1061773,"{'Fe': 2.0, 'Te': 1.0, 'Se': 1.0}",83.73970680084179,[],FM,True,99,1,"[0.1, 0.1, -0.0, -0.0]",0.0012679444920021,0.1061773,2,0.1061773,MP,data/source/MP/cleaned/cifs/MP-mp-1225136.cif,True,,data/final/MP/graphs/Fe1Se0.39Te0.61-MP-mp-1225136-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
B2C2Y1,1,0.0,2.0,False,B4C4Y2,B4C4Y2,1.8,Other,True,B40C40Y20,B-C-Y,3,Supercon,Y1B2C2,MP-mp-1078866,Y2B4C4,B-C-Y,B40C40Y20,P 4/m b m,tetragonal,3.587176,5.352631,5.352631,data/final/MP/cifs/B2C2Y1-MP-mp-1078866.cif,data/source/MP/raw/cifs/mp-1078866.cif,mp-1078866,0.0,,2018-04-13 07:38:52,4.347835248784562,,,{'GGA': {'task_id': 'mp-1702912'}},0.0,6.54358122,520.0,-80.94044279,-8.094044279,{'tags': ['Yttrium diboride dicarbide']},-80.94044279,-8.094044279,-0.4382810679999991,['bandstructure'],True,[427155],True,2021-05-12 10:58:16.596000,NM,10,5,mp-1078866,,Y(BC)2,"{'functional': 'PBE', 'labels': ['Y_sv', 'B', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'B': 2.0, 'C': 2.0}",GGA,mp-1078866,"['mp-1078866', 'mp-1427705', 'mp-1702912', 'mp-1782466', 'mp-1589860']",0.00071615,"{'Y': 2.0, 'B': 4.0, 'C': 4.0}",102.774954993609,[],NM,False,127,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.393627465065849e-05,0.00071615,0,0.0014323,MP,data/source/MP/cleaned/cifs/MP-mp-1078866.cif,False,,data/final/MP/graphs/B2C2Y1-MP-mp-1078866.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Fe0.95Ni0.05Se1,2,0.05,2.0,False,Fe1.9Ni0.1Se2,Fe2Se2,10.0,Ferrite,True,Fe47.5Ni2.5Se50,Fe-Ni-Se,3,Supercon,Fe0.95Ni0.05Se1,MP-mp-20311,Fe2Se2,Fe-Se,Fe50Se50,P 4/n m m,tetragonal,3.688905,3.688905,5.854194,data/final/MP/cifs/Fe0.95Ni0.05Se1-MP-mp-20311-synth_doped.cif,data/source/MP/raw/cifs/mp-20311.cif,mp-20311,0.0,,2013-10-20 07:09:24,5.619828229873189,10.17188/1195438,"@misc{osti_1195438,
    author = ""Persson, Kristin"",
    title = ""Materials Data on FeSe (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195438"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668877'}},0.0,3.48880228,520.0,-25.01949237,-6.2548730925,"{'tags': ['Iron selenide - NN AFM', 'Iron selenide - orthorhombic, LT', 'Iron selenide', 'Iron sulfide', 'Iron selenide (1/1) - nonmagnetic', 'Iron selenide - tetragonal', 'Iron selenide - alpha LT', 'Iron selenide - LT', 'High pressure experimental phase', 'Iron selenide - alpha']}",-25.01949237,-6.2548730925,-0.5079131286718743,"['xas', 'elasticity', 'bandstructure']",True,"[196301, 196298, 196299, 196297, 290701, 165958, 185464, 163561, 169257, 163560, 977900, 169311, 169303, 26889, 166440, 162901, 169283, 165957, 169271, 977903, 169259, 977901, 185465, 165959, 169306, 169267, 163557, 169287, 169297, 169289, 163556, 169299, 163562, 166441, 182544, 163559, 169269, 169263, 169265, 169315, 169255, 166439, 169293, 169313, 163555, 169291, 169301, 165960, 169253, 169295, 169970, 163558, 169285, 169261, 169309]",True,2021-05-12 10:56:14.760000,NM,4,55,mp-20311,,FeSe,"{'functional': 'PBE', 'labels': ['Fe_pv', 'Se'], 'pot_type': 'paw'}","{'Fe': 1.0, 'Se': 1.0}",GGA,mp-20311,"['mp-684656', 'mp-20311', 'mp-1063646', 'mp-1063662', 'mp-1063681', 'mp-1063669', 'mp-1063680', 'mp-1063695', 'mp-1063686', 'mp-1063699', 'mp-1063715', 'mp-1063717', 'mp-1063876', 'mp-1063734', 'mp-1063891', 'mp-1063735', 'mp-1063910', 'mp-1063918', 'mp-1063922', 'mp-1063931', 'mp-1063774', 'mp-1063781', 'mp-1064091', 'mp-1064111', 'mp-1063801', 'mp-1064112', 'mp-1064180', 'mp-1064138', 'mp-1064153', 'mp-1065102', 'mp-1065123', 'mp-1065075', 'mp-1065161', 'mp-1065131', 'mp-1065030', 'mp-1065055', 'mp-1065085', 'mp-1065094', 'mp-1440814', 'mp-1668877', 'mp-1799618', 'mp-1593782', 'mp-1592730', 'mp-1065081', 'mp-1065148', 'mp-1063928', 'mp-1063726', 'mp-1063683', 'mp-1063709', 'mp-1063911', 'mp-1063795', 'mp-1065121', 'mp-1063725', 'mp-1064139', 'mp-1064165']",3.455e-05,"{'Fe': 2.0, 'Se': 2.0}",79.66398961559156,[],NM,False,129,0,"[0, 0, 0, 0]",8.673931638803586e-07,3.455e-05,0,6.91e-05,MP,data/source/MP/cleaned/cifs/MP-mp-20311.cif,True,,data/final/MP/graphs/Fe0.95Ni0.05Se1-MP-mp-20311-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
C2Ni1Th0.3Y0.7,3,0.15,1.0,True,C2Ni1Th0.3Y0.7,C2Ni1Y1,7.445,Other,True,C50Ni25Th7.5Y17.5,C-Ni-Th-Y,4,Supercon,Y0.7Th0.3Ni1C2,MP-mp-1066566,Y1Ni1C2,C-Ni-Y,C50Ni25Y25,A m m 2,orthorhombic,3.602745,3.76432531,3.76432531,data/final/MP/cifs/C2Ni1Th0.3Y0.7-MP-mp-1066566-synth_doped.cif,data/source/MP/raw/cifs/mp-1066566.cif,mp-1066566,0.0,,2018-03-21 19:57:05,5.814059904528103,,,{'GGA': {'task_id': 'mp-1671332'}},0.0,6.53268675,520.0,-32.01396232,-8.00349058,"{'tags': ['YNiC2', 'Yttrium nickel carbide (1/1/2)', 'CeNiC2']}",-32.01396232,-8.00349058,-0.3284482816666658,['bandstructure'],True,"[618597, 618595]",True,2021-05-12 10:58:14.654000,NM,4,12,mp-1066566,,YNiC2,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ni_pv', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ni': 1.0, 'C': 2.0}",GGA,mp-1066566,"['mp-1066566', 'mp-1066591', 'mp-1066663', 'mp-1066963', 'mp-1066912', 'mp-1067057', 'mp-1437809', 'mp-1671332', 'mp-1792644', 'mp-1588942', 'mp-1066615', 'mp-1066986']",0.000243,"{'Y': 1.0, 'Ni': 1.0, 'C': 2.0}",49.0161433903244,[],NM,False,38,0,"[0, 0, 0, 0]",4.957550374066501e-06,0.000243,0,0.000243,MP,data/source/MP/cleaned/cifs/MP-mp-1066566.cif,True,,data/final/MP/graphs/C2Ni1Th0.3Y0.7-MP-mp-1066566-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Ni16Sc6Si7,1,0.0,1.0,True,Ni16Sc6Si7,Ni16Sc6Si7,0.0,Other,True,Ni55.172Sc20.69Si24.138,Ni-Sc-Si,3,Supercon,Sc6Ni16Si7,MP-mp-5382,Sc6Si7Ni16,Ni-Sc-Si,Ni55.172Sc20.69Si24.138,F m -3 m,cubic,8.06636869,8.06636869,8.06636869,data/final/MP/cifs/Ni16Sc6Si7-MP-mp-5382.cif,data/source/MP/raw/cifs/mp-5382.cif,mp-5382,0.0,,2011-05-25 06:09:10,6.28837752138106,10.17188/1263600,"@misc{osti_1263600,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sc6Si7Ni16 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1263600"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1735433'}},0.0,8.05986786,520.0,-190.55243452,-6.570773604137931,"{'tags': ['Scandium nickel silicide (6/16/7)', 'Nickel scandium silicide (16/6/7)']}",-190.55243452,-6.570773604137931,-0.744870167931034,"['xas', 'bandstructure']",True,"[646477, 109117, 646501, 646488, 159262]",True,2021-05-12 10:57:10.838000,NM,29,8,mp-5382,,Sc6Si7Ni16,"{'functional': 'PBE', 'labels': ['Sc_sv', 'Si', 'Ni_pv'], 'pot_type': 'paw'}","{'Sc': 6.0, 'Si': 7.0, 'Ni': 16.0}",GGA,mp-5382,"['mp-914950', 'mp-5382', 'mp-1156928', 'mp-1193981', 'mp-1419586', 'mp-1735433', 'mp-1841168', 'mp-1637764']",0.0035514,"{'Sc': 6.0, 'Si': 7.0, 'Ni': 16.0}",371.12414276639873,[],NM,False,225,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",9.56930469014354e-06,0.0035514,0,0.0035514,MP,data/source/MP/cleaned/cifs/MP-mp-5382.cif,False,,data/final/MP/graphs/Ni16Sc6Si7-MP-mp-5382.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ba2Cu4Pr0.8Y0.2O8,3,0.0266666666666666,1.0,True,Ba2Cu4Pr0.8Y0.2O8,Ba2Cu4Pr1O8,0.0,Cuprate,True,Ba13.333Cu26.667Pr5.333Y1.333O53.333333333333336,Ba-Cu-Pr-Y-O,5,Supercon,Y0.2Pr0.8Ba2Cu4O8,MP-mp-6779,Ba2Pr1Cu4O8,Ba-Cu-Pr-O,Ba13.333Cu26.667Pr6.667O53.333333333333336,C m m m,orthorhombic,3.929110001624248,3.949708,13.95458511,data/final/MP/cifs/Ba2Cu4Pr0.8Y0.2O8-MP-mp-6779-synth_doped.cif,data/source/MP/raw/cifs/mp-6779.cif,mp-6779,0.0,,2011-05-16 04:48:00,6.178482380811956,10.17188/1283406,"@misc{osti_1283406,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Pr(CuO2)4 (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1283406"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1676400'}},0.0,3.2175718,520.0,-89.48122933,-5.965415288666667,"{'tags': ['Praseodymium barium copper oxide (1/2/4/8)', 'Praseodymium dibarium tricopper copper(III) oxide', 'Praseodymium dibarium tetracopper octaoxide']}",-89.48122933,-5.965415288666667,-2.025191587000001,"['xas', 'bandstructure']",True,"[75850, 75815, 90748, 87940, 90757]",True,2021-05-12 10:57:34.594000,NM,15,8,mp-6779,oxide,Ba2Pr(CuO2)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Pr_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Pr': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-6779,"['mp-1000699', 'mp-6779', 'mp-1007159', 'mp-1381422', 'mp-1676400', 'mp-1835392', 'mp-1011903', 'mp-1598918']",0.0021731,"{'Ba': 2.0, 'Pr': 1.0, 'Cu': 4.0, 'O': 8.0}",214.40214033168536,[],NM,False,65,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",1.0135626429093296e-05,0.0021731,0,0.0021731,MP,data/source/MP/cleaned/cifs/MP-mp-6779.cif,True,,data/final/MP/graphs/Ba2Cu4Pr0.8Y0.2O8-MP-mp-6779-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
As2Ba0.81Fe2K0.19,3,0.0573333333333333,3.0,False,As6Ba2.43Fe6K0.57,As6Ba2Fe6K1,12.73333333,Ferrite,True,As40Ba16.2Fe40K3.8,As-Ba-Fe-K,4,Supercon,Ba0.81K0.19Fe2As2,MP-mp-1223567,K1Ba2Fe6As6,As-Ba-Fe-K,As40Ba13.333Fe40K6.667,C 1 2/m 1,monoclinic,5.48060788,7.102799640000001,8.784942288492543,data/final/MP/cifs/As2Ba0.81Fe2K0.19-MP-mp-1223567-synth_doped.cif,data/source/MP/raw/cifs/mp-1223567.cif,mp-1223567,0.0,,2019-01-12 23:56:38.667000,6.101417464045543,,,,0.0186882046666676,4.38014394,520.0,-90.51509253,-6.034339502,{'tags': []},-90.51509253,-6.034339502,-0.4527993862000007,[],False,[],True,2021-05-12 11:00:52.054000,FM,15,4,mp-1223567,,KBa2(FeAs)6,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 2.0, 'Fe': 6.0, 'As': 6.0}",GGA,mp-1223567,"['mp-1223567', 'mp-1374097', 'mp-1656306', 'mp-1808539']",1.3326448,"{'K': 1.0, 'Ba': 2.0, 'Fe': 6.0, 'As': 6.0}",298.92336486922324,[],FM,True,12,2,"[0.0, 0.0, 0.0, 0.3, 0.3, 0.1, 0.3, 0.1, 0.3, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0044581486649028,1.3326448,6,1.3326448,MP,data/source/MP/cleaned/cifs/MP-mp-1223567.cif,True,,data/final/MP/graphs/As2Ba0.81Fe2K0.19-MP-mp-1223567-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
Cu1Nd0.19Sr0.81O2,3,0.0949999999999999,2.0,False,Cu2Nd0.38Sr1.62O4,Cu2Sr2O4,18.0,Cuprate,True,Cu25Nd4.75Sr20.25O50,Cu-Nd-Sr-O,4,Supercon,Sr0.81Nd0.19Cu1O2,MP-mp-5787,Sr2Cu2O4,Cu-Sr-O,Cu25Sr25O50,C m c m,orthorhombic,3.644437999912225,3.974263,8.32909336,data/final/MP/cifs/Cu1Nd0.19Sr0.81O2-MP-mp-5787-synth_doped.cif,data/source/MP/raw/cifs/mp-5787.cif,mp-5787,0.0,,2011-05-13 22:43:08,5.167573150857569,10.17188/1276630,"@misc{osti_1276630,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SrCuO2 (SG:63) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1276630"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703560'}},0.0,3.45760864,520.0,-45.24374469,-5.65546808625,"{'tags': ['Strontium cuprate', 'Strontium copper oxide']}",-45.24374469,-5.65546808625,-2.0778125529166664,"['xas', 'elasticity', 'bandstructure']",True,"[77291, 93653, 202992, 16217, 83051, 77293]",True,2021-05-12 10:56:27.046000,NM,8,8,mp-5787,oxide,SrCuO2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Cu': 1.0, 'O': 2.0}",GGA,mp-5787,"['mp-924142', 'mp-909103', 'mp-5787', 'mp-924940', 'mp-1475985', 'mp-1703560', 'mp-1802910', 'mp-1593696']",4e-07,"{'Sr': 2.0, 'Cu': 2.0, 'O': 4.0}",117.71572347282628,[],NM,False,63,0,"[0, 0, 0, 0, 0, 0, 0, 0]",6.796033498317439e-09,4e-07,0,8e-07,MP,data/source/MP/cleaned/cifs/MP-mp-5787.cif,True,,data/final/MP/graphs/Cu1Nd0.19Sr0.81O2-MP-mp-5787-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
B1.8Be0.2Mg1,3,0.1333333333333333,1.0,True,B1.8Be0.2Mg1,B2Mg1,36.0,Other,True,B60Be6.667Mg33.333,B-Be-Mg,3,Supercon,Mg1B1.8Be0.2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B1.8Be0.2Mg1-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B1.8Be0.2Mg1-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ca0.1Cu1La1.9O4,2,0.0285714285714285,1.0,True,Ca0.1Cu1La1.9O4,Cu1La2O4,20.5,Cuprate,True,Ca1.429Cu14.286La27.143O57.142857142857146,Ca-Cu-La-O,4,Supercon,La1.9Ca0.1Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ca0.1Cu1La1.9O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ca0.1Cu1La1.9O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ce1Si2,1,0.0,2.0,False,Ce2Si4,Ce2Si4,0.0,Heavy_fermion,True,Ce33.333Si66.667,Ce-Si,2,Supercon,Ce1Si2,MP-mp-1898,Ce2Si4,Ce-Si,Ce33.333Si66.667,I 41/a m d,tetragonal,4.094384000377867,4.094384000377867,7.64475075,data/final/MP/cifs/Ce1Si2-MP-mp-1898.cif,data/source/MP/raw/cifs/mp-1898.cif,mp-1898,0.0,,2011-05-12 23:22:37,5.496004682500788,10.17188/1193761,"@misc{osti_1193761,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeSi2 (SG:141) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1193761"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671976'}},0.0,8.79215098,520.0,-37.51902069,-6.253170115,"{'tags': ['Cerium silicon (1/2)', 'Cerium silicide iron (1/2/0.33)', 'Cerium disilicide', 'Cerium silicide (1/2)']}",-37.51902069,-6.253170115,-0.6112643833333328,"['xas', 'elasticity', 'bandstructure']",True,"[31642, 622153, 622175, 622197, 622192, 622204, 622138, 621074, 25664, 622206, 622190]",True,2021-05-12 10:56:14.760000,NM,6,21,mp-1898,,CeSi2,"{'functional': 'PBE', 'labels': ['Ce', 'Si'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Si': 2.0}",GGA,mp-1898,"['mp-1898', 'mp-1072078', 'mp-1072105', 'mp-1072163', 'mp-1072807', 'mp-1072783', 'mp-1072847', 'mp-1077080', 'mp-1077530', 'mp-1077422', 'mp-1077724', 'mp-1080391', 'mp-1138592', 'mp-1146290', 'mp-1261199', 'mp-1442163', 'mp-1671976', 'mp-1804906', 'mp-1588842', 'mp-1072841', 'mp-1072159']",0.0154896,"{'Ce': 2.0, 'Si': 4.0}",118.6106091952615,[],NM,False,141,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0002611840560484,0.0154896,0,0.0309792,MP,data/source/MP/cleaned/cifs/MP-mp-1898.cif,False,,data/final/MP/graphs/Ce1Si2-MP-mp-1898.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Cr0.5Ru0.5,1,0.0,2.0,False,Cr1Ru1,Cr1Ru1,1.3,Other,True,Cr50Ru50,Cr-Ru,2,Supercon,Cr0.5Ru0.5,MP-mp-1226177,Cr1Ru1,Cr-Ru,Cr50Ru50,P -6 m 2,hexagonal,2.66374799887041,2.66374762,4.218014,data/final/MP/cifs/Cr0.5Ru0.5-MP-mp-1226177.cif,data/source/MP/raw/cifs/mp-1226177.cif,mp-1226177,0.0,,2019-01-13 02:11:02.450000,9.806257087092764,,,{'GGA': {'task_id': 'mp-1674965'}},0.1296792925000005,7.32293255,520.0,-18.66807854,-9.33403927,{'tags': []},-18.66807854,-9.33403927,0.1296792925000005,['bandstructure'],True,[],True,2021-05-12 10:58:45.495000,NM,2,5,mp-1226177,,CrRu,"{'functional': 'PBE', 'labels': ['Cr_pv', 'Ru_pv'], 'pot_type': 'paw'}","{'Cr': 1.0, 'Ru': 1.0}",GGA,mp-1226177,"['mp-1226177', 'mp-1421116', 'mp-1674965', 'mp-1782117', 'mp-1612368']",2.9e-05,"{'Cr': 1.0, 'Ru': 1.0}",25.91939376713363,[],NM,False,187,0,"[0, 0]",1.1188533289220924e-06,2.9e-05,0,2.9e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1226177.cif,False,,data/final/MP/graphs/Cr0.5Ru0.5-MP-mp-1226177.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Au1Be1,1,0.0,4.0,False,Au4Be4,Au4Be4,1.775,Other,True,Au50Be50,Au-Be,2,Supercon,Au1Be1,MP-mp-30365,Be4Au4,Au-Be,Au50Be50,P 21 3,cubic,4.723566,4.723566,4.723566,data/final/MP/cifs/Au1Be1-MP-mp-30365.cif,data/source/MP/raw/cifs/mp-30365.cif,mp-30365,0.0,,2014-02-24 04:25:42,12.98140039607364,10.17188/1204780,"@misc{osti_1204780,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BeAu (SG:198) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1204780"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697564'}},0.0,5.49429905,520.0,-29.14272077,-3.64284009625,{'tags': ['Gold beryllium (1/1)']},-29.14272077,-3.64284009625,-0.1361928937500001,"['xas', 'elasticity', 'bandstructure']",True,[58396],True,2021-05-12 10:56:18.721000,NM,8,10,mp-30365,,BeAu,"{'functional': 'PBE', 'labels': ['Be_sv', 'Au'], 'pot_type': 'paw'}","{'Be': 1.0, 'Au': 1.0}",GGA,mp-30365,"['mp-928156', 'mp-912035', 'mp-30365', 'mp-1114852', 'mp-1116195', 'mp-1414300', 'mp-1697564', 'mp-1783087', 'mp-928659', 'mp-1589582']",7.07e-05,"{'Be': 4.0, 'Au': 4.0}",105.39256243214749,[],NM,False,198,0,"[0, 0, 0, 0, 0, 0, 0, 0]",2.683301302044618e-06,7.07e-05,0,0.0002828,MP,data/source/MP/cleaned/cifs/MP-mp-30365.cif,False,,data/final/MP/graphs/Au1Be1-MP-mp-30365.json,0,True,23,1,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Cu3La0.8Y0.2O7,3,0.0307692307692307,1.0,True,Ba2Cu3La0.8Y0.2O7,Ba2Cu3La1O7,81.0,Cuprate,True,Ba15.385Cu23.077La6.154Y1.538O53.84615384615385,Ba-Cu-La-Y-O,5,Supercon,Y0.2La0.8Ba2Cu3O7,MP-mp-622210,Ba2La1Cu3O7,Ba-Cu-La-O,Ba15.385Cu23.077La7.692O53.84615384615385,P m m m,orthorhombic,3.912033,3.978575,11.900925,data/final/MP/cifs/Ba2Cu3La0.8Y0.2O7-MP-mp-622210-synth_doped.cif,data/source/MP/raw/cifs/mp-622210.cif,mp-622210,0.0,,2014-02-16 07:47:08,6.420495647479224,10.17188/1278110,"@misc{osti_1278110,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2LaCu3O7 (SG:47) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278110"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1676618'}},0.0206010060576886,3.9422618,520.0,-79.09444788,-6.084188298461539,{'tags': ['Lanthanum dibarium tricopper heptaoxide']},-79.09444788,-6.084188298461539,-2.1689347746153844,['bandstructure'],True,[81167],True,2021-05-12 10:58:51.532000,NM,13,10,mp-622210,oxide,Ba2LaCu3O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'La': 1.0, 'Cu': 3.0, 'O': 7.0}",GGA,mp-622210,"['mp-932742', 'mp-931665', 'mp-916330', 'mp-622210', 'mp-1228591', 'mp-1236979', 'mp-1381031', 'mp-1676618', 'mp-1832760', 'mp-1598015']",6.1e-06,"{'Ba': 2.0, 'La': 1.0, 'Cu': 3.0, 'O': 7.0}",185.22976563934355,[],NM,False,47,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.293207211565103e-08,6.1e-06,0,6.1e-06,MP,data/source/MP/cleaned/cifs/MP-mp-622210.cif,True,,data/final/MP/graphs/Ba2Cu3La0.8Y0.2O7-MP-mp-622210-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Sb2Ta1,1,0.0,2.0,False,Sb4Ta2,Sb4Ta2,0.0,Other,True,Sb66.667Ta33.333,Sb-Ta,2,Supercon,Sb2Ta1,MP-mp-11697,Ta2Sb4,Sb-Ta,Sb66.667Ta33.333,C 1 2/m 1,monoclinic,3.692436002440548,5.49406945,7.526042975117541,data/final/MP/cifs/Sb2Ta1-MP-mp-11697.cif,data/source/MP/raw/cifs/mp-11697.cif,mp-11697,0.0,,2011-05-28 01:53:47,10.195171926099407,10.17188/1188289,"@misc{osti_1188289,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TaSb2 (SG:12) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188289"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702507'}},0.0,8.25785005,520.0,-41.09378846,-6.848964743333333,{'tags': ['Tantalum antimonide (1/2)']},-41.09378846,-6.848964743333333,-0.2717047066666668,"['xas', 'elasticity', 'bandstructure']",True,"[52311, 651600]",True,2021-05-12 10:56:12.755000,NM,6,8,mp-11697,,TaSb2,"{'functional': 'PBE', 'labels': ['Ta_pv', 'Sb'], 'pot_type': 'paw'}","{'Ta': 1.0, 'Sb': 2.0}",GGA,mp-11697,"['mp-929262', 'mp-912994', 'mp-11697', 'mp-1418335', 'mp-1702507', 'mp-1780692', 'mp-930113', 'mp-1590673']",0.00056625,"{'Ta': 2.0, 'Sb': 4.0}",138.2704484762032,[],NM,False,12,0,"[0, 0, 0, 0, 0, 0]",8.190470288341525e-06,0.00056625,0,0.0011325,MP,data/source/MP/cleaned/cifs/MP-mp-11697.cif,False,,data/final/MP/graphs/Sb2Ta1-MP-mp-11697.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
Ca0.09Cu1La1.91O4,2,0.0257142857142857,1.0,True,Ca0.09Cu1La1.91O4,Cu1La2O4,20.0,Cuprate,True,Ca1.286Cu14.286La27.286O57.142857142857146,Ca-Cu-La-O,4,Supercon,La1.91Ca0.09Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ca0.09Cu1La1.91O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ca0.09Cu1La1.91O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
La1Mo6Se8,1,0.0,1.0,True,La1Mo6Se8,La1Mo6Se8,11.23333333,Chevrel,True,La6.667Mo40Se53.333,La-Mo-Se,3,Supercon,La1Mo6Se8,MP-mp-37784,La1Mo6Se8,La-Mo-Se,La6.667Mo40Se53.333,R -3,trigonal,6.84882661,6.84882661,6.84882641,data/final/MP/cifs/La1Mo6Se8-MP-mp-37784.cif,data/source/MP/raw/cifs/mp-37784.cif,mp-37784,0.0,,2013-11-13 11:12:22,6.964358050864285,,,{'GGA': {'task_id': 'mp-1669492'}},0.0265230636249986,5.68236385,520.0,-109.21685909,-7.281123939333333,"{'tags': ['Lanthanum molybdenum(II/III) selenide (1/6/8)', 'Lanthanum molybdenum selenide (1/6/8)', 'Lanthanum molybdenum(II/III) selenide  (1/6/8)']}",-109.21685909,-7.281123939333333,-1.001046798916666,"['xas', 'bandstructure']",True,"[641459, 641461, 600706, 600656]",True,2021-05-12 10:57:34.594000,FM,15,11,mp-37784,,La(Mo3Se4)2,"{'functional': 'PBE', 'labels': ['La', 'Mo_pv', 'Se'], 'pot_type': 'paw'}","{'La': 1.0, 'Mo': 6.0, 'Se': 8.0}",GGA,mp-37784,"['mp-948248', 'mp-676259', 'mp-949023', 'mp-937946', 'mp-1104045', 'mp-1104421', 'mp-37784', 'mp-1413507', 'mp-1669492', 'mp-1810114', 'mp-1598006']",0.6990221,"{'La': 1.0, 'Mo': 6.0, 'Se': 8.0}",320.98579209458114,[],FM,True,148,1,"[0.0, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0021777353303975,0.6990221,6,0.6990221,MP,data/source/MP/cleaned/cifs/MP-mp-37784.cif,False,,data/final/MP/graphs/La1Mo6Se8-MP-mp-37784.json,0,True,-3,0,0,0,0,0,0,2,1,0,0,0,1.0,False
B4Ru4Y1,1,0.0,4.0,False,B16Ru16Y4,B16Ru16Y4,1.4,Other,True,B44.444Ru44.444Y11.111,B-Ru-Y,3,Supercon,Y1Ru4B4,MP-mp-10138,Y4B16Ru16,B-Ru-Y,B44.444Ru44.444Y11.111,I 41/a c d,tetragonal,7.497655996564225,7.497655996564225,9.20973788,data/final/MP/cifs/B4Ru4Y1-MP-mp-10138.cif,data/source/MP/raw/cifs/mp-10138.cif,mp-10138,0.0,,2011-08-10 13:37:39,8.416549846219914,10.17188/1186669,"@misc{osti_1186669,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Y(BRu)4 (SG:142) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1186669"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1751229'}},0.0,6.96785358,520.0,-298.85735178,-8.301593105,"{'tags': ['Ruthenium yttrium boride (4/1/4)', 'Yttrium ruthenium boride (1/4/4)']}",-298.85735178,-8.301593105,-0.4925267920370355,"['xas', 'bandstructure']",True,"[615406, 44582]",True,2021-05-12 10:56:51.169000,NM,36,8,mp-10138,,Y(BRu)4,"{'functional': 'PBE', 'labels': ['Y_sv', 'B', 'Ru_pv'], 'pot_type': 'paw'}","{'Y': 1.0, 'B': 4.0, 'Ru': 4.0}",GGA,mp-10138,"['mp-926232', 'mp-926793', 'mp-910326', 'mp-10138', 'mp-1404958', 'mp-1751229', 'mp-1816753', 'mp-1622723']",0.008041975,"{'Y': 4.0, 'B': 16.0, 'Ru': 16.0}",423.3386547650245,[],NM,False,142,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",7.59862101840308e-05,0.008041975,0,0.0321679,MP,data/source/MP/cleaned/cifs/MP-mp-10138.cif,False,,data/final/MP/graphs/B4Ru4Y1-MP-mp-10138.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
P2Pd2Y1,1,0.0,1.0,True,P2Pd2Y1,P2Pd2Y1,0.96,Other,True,P40Pd40Y20,P-Pd-Y,3,Supercon,Y1Pd2P2,MP-mp-1207032,Y1P2Pd2,P-Pd-Y,P40Pd40Y20,I 4/m m m,tetragonal,4.103238001466186,4.103238001466186,5.75282047,data/final/MP/cifs/P2Pd2Y1-MP-mp-1207032.cif,data/source/MP/raw/cifs/mp-1207032.cif,mp-1207032,0.0,,2019-01-12 10:13:24.591000,7.220842318171406,,,{'GGA': {'task_id': 'mp-1758764'}},0.0009615873636388,7.04770404,520.0,-32.30806464,-6.461612927999999,"{'tags': ['YPd2P2', 'CeAl2Ga2']}",-32.30806464,-6.461612927999999,-0.9310449786666666,['bandstructure'],True,[],True,2021-05-12 10:58:39.488000,NM,5,5,mp-1207032,,Y(PPd)2,"{'functional': 'PBE', 'labels': ['Y_sv', 'P', 'Pd'], 'pot_type': 'paw'}","{'Y': 1.0, 'P': 2.0, 'Pd': 2.0}",GGA,mp-1207032,"['mp-1207032', 'mp-1391588', 'mp-1758764', 'mp-1799704', 'mp-1585123']",0.0013874,"{'Y': 1.0, 'P': 2.0, 'Pd': 2.0}",83.63664918575623,[],NM,False,139,0,"[0, 0, 0, 0, 0]",1.658842162505336e-05,0.0013874,0,0.0013874,MP,data/source/MP/cleaned/cifs/MP-mp-1207032.cif,False,,data/final/MP/graphs/P2Pd2Y1-MP-mp-1207032.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Al0.95Ga0.05Nb3,2,0.025,2.0,False,Al1.9Ga0.1Nb6,Al2Nb6,19.2,Other,True,Al23.75Ga1.25Nb75,Al-Ga-Nb,3,Supercon,Nb3Al0.95Ga0.05,MP-mp-796,Nb6Al2,Al-Nb,Al25Nb75,P m -3 n,cubic,5.215254,5.215254,5.215254,data/final/MP/cifs/Al0.95Ga0.05Nb3-MP-mp-796-synth_doped.cif,data/source/MP/raw/cifs/mp-796.cif,mp-796,0.0,,2011-05-13 16:07:37,7.157298025966356,,,{'GGA': {'task_id': 'mp-1686893'}},0.0460773865000003,5.52947534,520.0,-69.48918494,-8.6861481175,"{'tags': ['Aluminium niobium (1/3)', 'Niobium aluminide (3/1)', 'Aluminum niobium (1/3)']}",-69.48918494,-8.6861481175,-0.1737753800000003,"['bandstructure', 'elasticity']",True,"[608675, 608654, 608688, 608668, 608669, 608685, 608676, 608683, 58014, 608657, 107856, 608655, 608666, 608691, 608656, 608665, 608673, 608653, 608661]",True,2021-05-12 10:56:31.128000,NM,8,10,mp-796,,Nb3Al,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Al': 1.0}",GGA,mp-796,"['mp-911586', 'mp-927906', 'mp-796', 'mp-927472', 'mp-1260512', 'mp-1440919', 'mp-1686893', 'mp-1927652', 'mp-1591599', 'mp-1587739']",0.16323955,"{'Nb': 6.0, 'Al': 2.0}",141.8490379078192,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0023015954483396,0.16323955,0,0.3264791,MP,data/source/MP/cleaned/cifs/MP-mp-796.cif,True,,data/final/MP/graphs/Al0.95Ga0.05Nb3-MP-mp-796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Bi2K1,1,0.0,2.0,False,Bi4K2,Bi4K2,3.575,Other,True,Bi66.667K33.333,Bi-K,2,Supercon,Bi2K1,MP-mp-23279,K2Bi4,Bi-K,Bi66.667K33.333,F d -3 m,cubic,6.79113697,6.791136969999999,6.791136969999999,data/final/MP/cifs/Bi2K1-MP-mp-23279.cif,data/source/MP/raw/cifs/mp-23279.cif,mp-23279,0.0,,2014-02-21 07:41:24,6.853919236358367,10.17188/1199388,"@misc{osti_1199388,
    author = ""Persson, Kristin"",
    title = ""Materials Data on KBi2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199388"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700781'}},0.0,3.82151112,520.0,-19.78014419,-3.2966906983333337,"{'tags': ['Bismuth potassium (2/1)', 'Potassium bismuthide (1/2)']}",-19.78014419,-3.2966906983333337,-0.3332015093333336,"['xas', 'elasticity', 'bandstructure']",True,"[55068, 58794]",True,2021-05-12 10:56:16.728000,NM,6,8,mp-23279,,KBi2,"{'functional': 'PBE', 'labels': ['K_sv', 'Bi'], 'pot_type': 'paw'}","{'K': 1.0, 'Bi': 2.0}",GGA,mp-23279,"['mp-929630', 'mp-913089', 'mp-930153', 'mp-23279', 'mp-1430425', 'mp-1700781', 'mp-1935645', 'mp-1590524']",0.0009423,"{'K': 2.0, 'Bi': 4.0}",221.4687582745109,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",8.509552384196938e-06,0.0009423,0,0.0018846,MP,data/source/MP/cleaned/cifs/MP-mp-23279.cif,False,,data/final/MP/graphs/Bi2K1-MP-mp-23279.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Fe2Ge2Pr1,1,0.0,1.0,True,Fe2Ge2Pr1,Fe2Ge2Pr1,0.0,Heavy_fermion,True,Fe40Ge40Pr20,Fe-Ge-Pr,3,Supercon,Pr1Fe2Ge2,MP-mp-21221,Pr1Fe2Ge2,Fe-Ge-Pr,Fe40Ge40Pr20,I 4/m m m,tetragonal,4.053984002578074,4.053984002578074,6.12503967,data/final/MP/cifs/Fe2Ge2Pr1-MP-mp-21221.cif,data/source/MP/raw/cifs/mp-21221.cif,mp-21221,0.0,,2014-02-21 14:32:09,7.426946128732558,10.17188/1196494,"@misc{osti_1196494,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Pr(FeGe)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196494"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686880'}},0.0,5.64484649,520.0,-33.09418807,-6.618837614,"{'tags': ['Iron praseodymium germanide (2/1/2)', 'Iron germanium praseodymium (2/2/1)']}",-33.09418807,-6.618837614,-0.4254432630000003,"['xas', 'bandstructure']",True,"[632102, 632105, 658627, 106874, 632098, 632095, 632099, 53472, 632101, 659230, 106643, 632097, 632100, 53473]",True,2021-05-12 10:56:59.077000,FM,5,9,mp-21221,,Pr(FeGe)2,"{'functional': 'PBE', 'labels': ['Pr_3', 'Fe_pv', 'Ge_d'], 'pot_type': 'paw'}","{'Pr': 1.0, 'Fe': 2.0, 'Ge': 2.0}",GGA,mp-21221,"['mp-993643', 'mp-991883', 'mp-21221', 'mp-1440974', 'mp-1686880', 'mp-1783763', 'mp-994973', 'mp-1594396', 'mp-1595152']",4.7089088,"{'Pr': 1.0, 'Fe': 2.0, 'Ge': 2.0}",88.95868774326918,[],FM,True,139,1,"[0.0, 2.4, 2.4, 0.0, 0.0]",0.0529336585268625,4.7089088,2,4.7089088,MP,data/source/MP/cleaned/cifs/MP-mp-21221.cif,False,,data/final/MP/graphs/Fe2Ge2Pr1-MP-mp-21221.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B2C1Pt2Th1,1,0.0,1.0,True,B2C1Pt2Th1,B2C1Pt2Th1,6.6,Other,True,B33.333C16.667Pt33.333Th16.667,B-C-Pt-Th,4,Supercon,Th1Pt2B2C1,MP-mp-1072285,Th1B2Pt2C1,B-C-Pt-Th,B33.333C16.667Pt33.333Th16.667,I 4/m m m,tetragonal,3.8470359991086265,3.8470359991086265,6.10105274,data/final/MP/cifs/B2C1Pt2Th1-MP-mp-1072285.cif,data/source/MP/raw/cifs/mp-1072285.cif,mp-1072285,0.0,,2018-03-22 08:49:12,13.474665746216726,,,{'GGA': {'task_id': 'mp-1701895'}},0.0340594383333234,8.34634958,520.0,-45.96383744,-7.660639573333333,"{'tags': ['ThPt2B2C', 'LuNi2B2C']}",-45.96383744,-7.660639573333333,-0.6370999213888879,['bandstructure'],True,[659011],True,2021-05-12 10:58:14.654000,NM,6,8,mp-1072285,,ThB2Pt2C,"{'functional': 'PBE', 'labels': ['Th', 'B', 'Pt', 'C'], 'pot_type': 'paw'}","{'Th': 1.0, 'B': 2.0, 'Pt': 2.0, 'C': 1.0}",GGA,mp-1072285,"['mp-1072310', 'mp-1072285', 'mp-1072338', 'mp-1435406', 'mp-1701895', 'mp-1799803', 'mp-1590554', 'mp-1072332']",0.0003539,"{'Th': 1.0, 'B': 2.0, 'Pt': 2.0, 'C': 1.0}",80.82173635188481,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",4.378772542811707e-06,0.0003539,0,0.0003539,MP,data/source/MP/cleaned/cifs/MP-mp-1072285.cif,False,,data/final/MP/graphs/B2C1Pt2Th1-MP-mp-1072285.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As1Ni1,1,0.0,2.0,False,As2Ni2,As2Ni2,0.0,Ferrite,True,As50Ni50,As-Ni,2,Supercon,As1Ni1,MP-mp-590,Ni2As2,As-Ni,As50Ni50,P 63/m m c,hexagonal,3.6458039969512,3.6458041,5.045066,data/final/MP/cifs/As1Ni1-MP-mp-590.cif,data/source/MP/raw/cifs/mp-590.cif,mp-590,0.0,,2011-05-12 23:26:54,7.640999562930888,10.17188/1277168,"@misc{osti_1277168,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NiAs (SG:36) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277168"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686631'}},0.0063692096428571,7.34639328,520.0,-22.0198782,-5.50496955,"{'tags': ['Nickel arsenide (1/1)', 'Nickeline']}",-22.0198782,-5.50496955,-0.2853420075000006,"['xas', 'elasticity', 'bandstructure']",True,"[5245, 43361, 611024, 44029, 290385, 66120, 31062, 29303, 611040, 611033, 655881]",True,2021-05-12 10:56:27.046000,NM,4,23,mp-590,,NiAs,"{'functional': 'PBE', 'labels': ['Ni_pv', 'As'], 'pot_type': 'paw'}","{'Ni': 1.0, 'As': 1.0}",GGA,mp-590,"['mp-921385', 'mp-906736', 'mp-923450', 'mp-908269', 'mp-922670', 'mp-920365', 'mp-2346', 'mp-570474', 'mp-590', 'mp-1063754', 'mp-1063769', 'mp-1063782', 'mp-1065149', 'mp-1065188', 'mp-1065118', 'mp-1180059', 'mp-1440679', 'mp-1686631', 'mp-1783476', 'mp-1592474', 'mp-1587615', 'mp-1065176', 'mp-1063777']",0.001163,"{'Ni': 2.0, 'As': 2.0}",58.07432013480035,[],NM,False,194,0,"[-0.0, -0.0, 0.0, 0.0]",4.005212621690549e-05,0.001163,0,0.002326,MP,data/source/MP/cleaned/cifs/MP-mp-590.cif,False,,data/final/MP/graphs/As1Ni1-MP-mp-590.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
La0.3Sr0.7Ti1O3,3,0.12,1.0,True,La0.3Sr0.7Ti1O3,Sr1Ti1O3,0.0,Oxide,True,La6Sr14Ti20O60,La-Sr-Ti-O,4,Supercon,La0.3Sr0.7Ti1O3,MP-mp-551830,Sr2Ti2O6,Sr-Ti-O,Sr20Ti20O60,P m -3 m,cubic,3.942851452350787,3.942851452692745,3.9464989993092807,data/final/MP/cifs/La0.3Sr0.7Ti1O3-MP-mp-551830-synth_doped.cif,data/source/MP/raw/cifs/mp-551830.cif,mp-551830,1.7869999999999997,,2014-02-21 05:23:00,4.966121139868444,,,{'GGA': {'task_id': 'mp-1759822'}},0.0005822479999988,3.22413565,520.0,-80.25240668,-8.025240668,{'tags': []},-80.25240668,-8.025240668,-3.551666971000001,"['bandstructure', 'elasticity']",True,[],True,2021-05-12 10:56:22.739000,NM,10,4,mp-551830,oxide,SrTiO3,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ti_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Ti': 1.0, 'O': 3.0}",GGA,mp-551830,"['mp-551830', 'mp-1406736', 'mp-1759822', 'mp-1627898']",0.00106425,"{'Sr': 2.0, 'Ti': 2.0, 'O': 6.0}",122.70515928291898,[],NM,False,221,0,"[0, 0, 0, 0, 0]",1.7346458881100164e-05,0.00106425,0,0.0021285,MP,data/source/MP/cleaned/cifs/MP-mp-551830.cif,True,,data/final/MP/graphs/La0.3Sr0.7Ti1O3-MP-mp-551830-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Sc0.5Zr0.5,1,0.0,2.0,False,Sc1Zr1,Sc1Zr1,0.0,Other,True,Sc50Zr50,Sc-Zr,2,Supercon,Sc0.5Zr0.5,MP-mp-1215201,Zr1Sc1,Sc-Zr,Sc50Zr50,P -6 m 2,hexagonal,3.270111996347605,3.27011194,5.154199,data/final/MP/cifs/Sc0.5Zr0.5-MP-mp-1215201.cif,data/source/MP/raw/cifs/mp-1215201.cif,mp-1215201,0.0,,2019-01-12 16:55:54.317000,4.737454893620727,,,{'GGA': {'task_id': 'mp-1675934'}},0.0233906685000002,3.90903397,520.0,-14.88408705,-7.442043525,{'tags': []},-14.88408705,-7.442043525,-0.0019586575000003,['bandstructure'],True,[],True,2021-05-12 10:58:39.488000,NM,2,5,mp-1215201,,ZrSc,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Sc_sv'], 'pot_type': 'paw'}","{'Zr': 1.0, 'Sc': 1.0}",GGA,mp-1215201,"['mp-1215201', 'mp-1431631', 'mp-1675934', 'mp-1934486', 'mp-1609536']",0.2519972,"{'Zr': 1.0, 'Sc': 1.0}",47.73281625681562,[],NM,False,187,0,"[0, 0]",0.0052793281386161,0.2519972,0,0.2519972,MP,data/source/MP/cleaned/cifs/MP-mp-1215201.cif,False,,data/final/MP/graphs/Sc0.5Zr0.5-MP-mp-1215201.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
B2Fe0.05Mg0.95,2,0.0333333333333333,1.0,True,B2Fe0.05Mg0.95,B2Mg1,29.5,Other,True,B66.667Fe1.667Mg31.667,B-Fe-Mg,3,Supercon,Mg0.95Fe0.05B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B2Fe0.05Mg0.95-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B2Fe0.05Mg0.95-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Mo0.28Re0.72,3,0.06,8.0,False,Mo2.24Re5.76,Mo2Re6,6.5,Other,True,Mo28Re72,Mo-Re,2,Supercon,Mo0.28Re0.72,MP-mp-974589,Re6Mo2,Mo-Re,Mo25Re75,P 63/m m c,hexagonal,4.549566,5.589982002473007,5.589981640000001,data/final/MP/cifs/Mo0.28Re0.72-MP-mp-974589-synth_doped.cif,data/source/MP/raw/cifs/mp-974589.cif,mp-974589,0.0,,2015-09-17 00:40:39,17.65663080297061,10.17188/1314573,"@misc{osti_1314573,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Re3Mo (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1314573"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1752979'}},0.1333847256249978,7.30876759,520.0,-95.39162484,-11.923953105,{'tags': []},-95.39162484,-11.923953105,0.1208530412499993,"['xas', 'bandstructure']",True,[],True,2021-05-12 10:57:55.580000,NM,8,8,mp-974589,,Re3Mo,"{'functional': 'PBE', 'labels': ['Re_pv', 'Mo_pv'], 'pot_type': 'paw'}","{'Re': 3.0, 'Mo': 1.0}",GGA,mp-974589,"['mp-974701', 'mp-974589', 'mp-974659', 'mp-1411460', 'mp-1752979', 'mp-1805092', 'mp-974741', 'mp-1618655']",0.00043195,"{'Re': 6.0, 'Mo': 2.0}",123.11795201493304,[],NM,False,187,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, 0.0]",7.016848362578489e-06,0.00043195,0,0.0008639,MP,data/source/MP/cleaned/cifs/MP-mp-974589.cif,True,,data/final/MP/graphs/Mo0.28Re0.72-MP-mp-974589-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Au1Pt4U1,1,0.0,1.0,True,Au1Pt4U1,Au1Pt4U1,0.0,Heavy_fermion,True,Au16.667Pt66.667U16.667,Au-Pt-U,3,Supercon,U1Au1Pt4,MP-mp-1077347,U1Pt4Au1,Au-Pt-U,Au16.667Pt66.667U16.667,F -4 3 m,cubic,5.3393548200000005,5.33935482,5.33935482,data/final/MP/cifs/Au1Pt4U1-MP-mp-1077347.cif,data/source/MP/raw/cifs/mp-1077347.cif,mp-1077347,0.0,,2018-04-08 18:50:16,18.74962108844145,,,{'GGA': {'task_id': 'mp-1678375'}},0.0,8.15126133,520.0,-42.07661999,-7.012769998333333,"{'tags': ['MgCu4Sn', 'Friauf-Laves phase', 'Uranium platinum auride (1/4/1)', 'AuUPt4']}",-42.07661999,-7.012769998333333,-0.5379495999999998,['bandstructure'],True,[612276],True,2021-05-12 10:58:14.654000,NM,6,5,mp-1077347,,UPt4Au,"{'functional': 'PBE', 'labels': ['U', 'Pt', 'Au'], 'pot_type': 'paw'}","{'U': 1.0, 'Pt': 4.0, 'Au': 1.0}",GGA,mp-1077347,"['mp-1077347', 'mp-1340268', 'mp-1678375', 'mp-1924598', 'mp-1596838']",0.0089025,"{'U': 1.0, 'Pt': 4.0, 'Au': 1.0}",107.63446313015652,[],NM,False,216,0,"[0, 0, 0, 0, 0, 0]",8.271049755908281e-05,0.0089025,0,0.0089025,MP,data/source/MP/cleaned/cifs/MP-mp-1077347.cif,False,,data/final/MP/graphs/Au1Pt4U1-MP-mp-1077347.json,0,True,-43m,5,0,0,0,0,0,0,0,0,0,1,1.0,False
Mo0.5Re0.5,1,0.0,2.0,False,Mo1Re1,Mo1Re1,7.6,Other,True,Mo50Re50,Mo-Re,2,Supercon,Mo0.5Re0.5,MP-mp-1219485,Re1Mo1,Mo-Re,Mo50Re50,C m m m,orthorhombic,2.71936353,2.71936353,4.457651,data/final/MP/cifs/Mo0.5Re0.5-MP-mp-1219485.cif,data/source/MP/raw/cifs/mp-1219485.cif,mp-1219485,0.0,,2019-01-12 20:28:58.315000,15.093827410702431,,,{'GGA': {'task_id': 'mp-1675676'}},0.1130813237499985,8.320612,520.0,-23.08071648,-11.54035824,{'tags': []},-23.08071648,-11.54035824,0.1047268675000001,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,2,5,mp-1219485,,ReMo,"{'functional': 'PBE', 'labels': ['Re_pv', 'Mo_pv'], 'pot_type': 'paw'}","{'Re': 1.0, 'Mo': 1.0}",GGA,mp-1219485,"['mp-1219485', 'mp-1425249', 'mp-1675676', 'mp-1792472', 'mp-1630224']",0.0007488,"{'Re': 1.0, 'Mo': 1.0}",31.0402460075689,[],NM,False,65,0,"[0, 0]",2.412352014920924e-05,0.0007488,0,0.0007488,MP,data/source/MP/cleaned/cifs/MP-mp-1219485.cif,False,,data/final/MP/graphs/Mo0.5Re0.5-MP-mp-1219485.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Mo0.67Zr0.33,2,0.0066666666666667,6.0,False,Mo4.02Zr1.98,Mo4Zr2,1.56,Other,True,Mo67Zr33,Mo-Zr,2,Supercon,Mo0.67Zr0.33,MP-mp-2049,Zr2Mo4,Mo-Zr,Mo66.667Zr33.333,F d -3 m,cubic,5.394503490000001,5.39450349,5.39450349,data/final/MP/cifs/Mo0.67Zr0.33-MP-mp-2049-synth_doped.cif,data/source/MP/raw/cifs/mp-2049.cif,mp-2049,0.0,,2011-05-13 16:28:26,8.470043894172937,10.17188/1195617,"@misc{osti_1195617,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrMo2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195617"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1673152'}},0.0,6.24392739,520.0,-61.3094724,-10.2182454,"{'tags': ['Molydenum zirconium (2/1)', 'Molybdenum zirconium hydride (2/1/3)', 'Molybdenum zirconium (2/1)']}",-61.3094724,-10.2182454,-0.1385831700000004,"['xas', 'elasticity', 'bandstructure']",True,"[638337, 644509, 105116, 644511, 644517, 644505, 644513, 644514, 644515, 644512, 105115]",True,2021-05-12 10:56:14.760000,NM,6,12,mp-2049,,ZrMo2,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Mo_pv'], 'pot_type': 'paw'}","{'Zr': 1.0, 'Mo': 2.0}",GGA,mp-2049,"['mp-941979', 'mp-941799', 'mp-935151', 'mp-2049', 'mp-1071756', 'mp-1071771', 'mp-1071750', 'mp-1442141', 'mp-1673152', 'mp-1803149', 'mp-1589214', 'mp-1071782']",4.35e-06,"{'Zr': 2.0, 'Mo': 4.0}",111.00420677492372,[],NM,False,166,0,"[0.0, 0.0, 0.0, 0.0, -0.0, 0.0]",7.837540803872818e-08,4.35e-06,0,8.7e-06,MP,data/source/MP/cleaned/cifs/MP-mp-2049.cif,True,,data/final/MP/graphs/Mo0.67Zr0.33-MP-mp-2049-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Mo3Zr1,1,0.0,2.0,False,Mo6Zr2,Mo6Zr2,0.0,Other,True,Mo75Zr25,Mo-Zr,2,Supercon,Mo3Zr1,MP-mp-30790,Zr2Mo6,Mo-Zr,Mo75Zr25,P m -3 n,cubic,5.20606,5.20606,5.20606,data/final/MP/cifs/Mo3Zr1-MP-mp-30790.cif,data/source/MP/raw/cifs/mp-30790.cif,mp-30790,0.0,,2014-02-24 05:33:50,8.921568459941396,10.17188/1205152,"@misc{osti_1205152,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrMo3 (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1205152"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695435'}},0.3315798849999982,6.690555,520.0,-80.34811938,-10.0435149225,{'tags': ['Molybdenum zirconium (3/1)']},-80.34811938,-10.0435149225,0.2276425075000006,"['xas', 'elasticity', 'bandstructure']",True,[105118],True,2021-05-12 10:56:18.721000,NM,8,8,mp-30790,,ZrMo3,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Mo_pv'], 'pot_type': 'paw'}","{'Zr': 1.0, 'Mo': 3.0}",GGA,mp-30790,"['mp-941801', 'mp-935158', 'mp-941981', 'mp-30790', 'mp-1431745', 'mp-1695435', 'mp-1930520', 'mp-1594519']",1.585e-05,"{'Zr': 2.0, 'Mo': 6.0}",141.100160310705,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",2.246631040687413e-07,1.585e-05,0,3.17e-05,MP,data/source/MP/cleaned/cifs/MP-mp-30790.cif,False,,data/final/MP/graphs/Mo3Zr1-MP-mp-30790.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
La0.978Pr0.022Sn3,2,0.011,1.0,True,La0.978Pr0.022Sn3,La1Sn3,0.0,Other,True,La24.45Pr0.55Sn75,La-Pr-Sn,3,Supercon,La0.978Pr0.022Sn3,MP-mp-633,La1Sn3,La-Sn,La25Sn75,P m -3 m,cubic,4.820061,4.820061,4.820061,data/final/MP/cifs/La0.978Pr0.022Sn3-MP-mp-633-synth_doped.cif,data/source/MP/raw/cifs/mp-633.cif,mp-633,0.0,,2011-05-13 04:30:54,7.340536659909055,10.17188/1279358,"@misc{osti_1279358,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaSn3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1279358"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688008'}},0.0,8.68748013,520.0,-19.26482408,-4.81620602,"{'tags': ['Lanthanum stannide (1/3)', 'Lanthanum tin (1/3)']}",-19.26482408,-4.81620602,-0.5750253525,"['xas', 'bandstructure']",True,"[641991, 104721, 641986, 261870, 104720, 151359, 642000, 641998, 191074]",True,2021-05-12 10:57:30.779000,NM,4,12,mp-633,,LaSn3,"{'functional': 'PBE', 'labels': ['La', 'Sn_d'], 'pot_type': 'paw'}","{'La': 1.0, 'Sn': 3.0}",GGA,mp-633,"['mp-991111', 'mp-993073', 'mp-633', 'mp-1066557', 'mp-1066573', 'mp-1066594', 'mp-1442023', 'mp-1688008', 'mp-1787436', 'mp-994393', 'mp-1590336', 'mp-1066601']",0.0055557,"{'La': 1.0, 'Sn': 3.0}",111.98441958300587,[],NM,False,221,0,"[0, 0, 0, 0]",4.961136576577034e-05,0.0055557,0,0.0055557,MP,data/source/MP/cleaned/cifs/MP-mp-633.cif,True,,data/final/MP/graphs/La0.978Pr0.022Sn3-MP-mp-633-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Sb2Yb1,1,0.0,2.0,False,Sb4Yb2,Sb4Yb2,1.3,Heavy_fermion,True,Sb66.667Yb33.333,Sb-Yb,2,Supercon,Sb2Yb1,MP-mp-7138,Yb2Sb4,Sb-Yb,Sb66.667Yb33.333,C m c m,orthorhombic,4.34302,4.59649199914296,8.74575278,data/final/MP/cifs/Sb2Yb1-MP-mp-7138.cif,data/source/MP/raw/cifs/mp-7138.cif,mp-7138,0.0,,2011-05-27 16:54:41,8.212572965068963,10.17188/1286628,"@misc{osti_1286628,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YbSb2 (SG:63) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1286628"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696960'}},0.0,5.98400649,520.0,-23.41825938,-3.90304323,{'tags': ['Ytterbium antimonide (1/2)']},-23.41825938,-3.90304323,-0.7651729766666667,['bandstructure'],True,"[651750, 22235]",True,2021-05-12 10:58:53.520000,NM,6,12,mp-7138,,YbSb2,"{'functional': 'PBE', 'labels': ['Yb_2', 'Sb'], 'pot_type': 'paw'}","{'Yb': 1.0, 'Sb': 2.0}",GGA,mp-7138,"['mp-941455', 'mp-941150', 'mp-934649', 'mp-7138', 'mp-1072755', 'mp-1072771', 'mp-1072799', 'mp-1437295', 'mp-1696960', 'mp-1780943', 'mp-1589391', 'mp-1072790']",1.855e-05,"{'Yb': 2.0, 'Sb': 4.0}",168.45248292465854,[],NM,False,63,0,"[0, 0, 0, 0, 0, 0]",2.202401493636233e-07,1.855e-05,0,3.71e-05,MP,data/source/MP/cleaned/cifs/MP-mp-7138.cif,False,,data/final/MP/graphs/Sb2Yb1-MP-mp-7138.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Hg0.698Tl0.302,3,0.104,4.0,False,Hg2.792Tl1.208,Hg3Tl1,3.888,Other,True,Hg69.8Tl30.2,Hg-Tl,2,Supercon,Hg0.698Tl0.302,MP-mp-11474,Tl1Hg3,Hg-Tl,Hg75Tl25,P m -3 m,cubic,4.882347,4.882347,4.882347,data/final/MP/cifs/Hg0.698Tl0.302-MP-mp-11474-synth_doped.cif,data/source/MP/raw/cifs/mp-11474.cif,mp-11474,0.0,,2011-05-28 03:43:13,11.502197118273612,10.17188/1187866,"@misc{osti_1187866,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TlHg3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187866"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699447'}},0.0,3.01175198,520.0,-3.42042044,-0.85510511,{'tags': ['Mercury thallium (3/1)']},-3.42042044,-0.85510511,-0.0366840495833333,"['xas', 'bandstructure']",True,[104362],True,2021-05-12 10:56:51.169000,NM,4,8,mp-11474,,TlHg3,"{'functional': 'PBE', 'labels': ['Tl_d', 'Hg'], 'pot_type': 'paw'}","{'Tl': 1.0, 'Hg': 3.0}",GGA,mp-11474,"['mp-992171', 'mp-991934', 'mp-11474', 'mp-1440524', 'mp-1699447', 'mp-1785402', 'mp-993811', 'mp-1591331']",0.0003805,"{'Tl': 1.0, 'Hg': 3.0}",116.382029846436,[],NM,False,221,0,"[0, 0, 0, 0]",3.269405083431376e-06,0.0003805,0,0.0003805,MP,data/source/MP/cleaned/cifs/MP-mp-11474.cif,True,,data/final/MP/graphs/Hg0.698Tl0.302-MP-mp-11474-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Mo0.724Zr0.276,3,0.1146666666666666,6.0,False,Mo4.344Zr1.656,Mo4Zr2,0.0,Other,True,Mo72.4Zr27.6,Mo-Zr,2,Supercon,Mo0.724Zr0.276,MP-mp-2049,Zr2Mo4,Mo-Zr,Mo66.667Zr33.333,F d -3 m,cubic,5.394503490000001,5.39450349,5.39450349,data/final/MP/cifs/Mo0.724Zr0.276-MP-mp-2049-synth_doped.cif,data/source/MP/raw/cifs/mp-2049.cif,mp-2049,0.0,,2011-05-13 16:28:26,8.470043894172937,10.17188/1195617,"@misc{osti_1195617,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrMo2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195617"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1673152'}},0.0,6.24392739,520.0,-61.3094724,-10.2182454,"{'tags': ['Molydenum zirconium (2/1)', 'Molybdenum zirconium hydride (2/1/3)', 'Molybdenum zirconium (2/1)']}",-61.3094724,-10.2182454,-0.1385831700000004,"['xas', 'elasticity', 'bandstructure']",True,"[638337, 644509, 105116, 644511, 644517, 644505, 644513, 644514, 644515, 644512, 105115]",True,2021-05-12 10:56:14.760000,NM,6,12,mp-2049,,ZrMo2,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Mo_pv'], 'pot_type': 'paw'}","{'Zr': 1.0, 'Mo': 2.0}",GGA,mp-2049,"['mp-941979', 'mp-941799', 'mp-935151', 'mp-2049', 'mp-1071756', 'mp-1071771', 'mp-1071750', 'mp-1442141', 'mp-1673152', 'mp-1803149', 'mp-1589214', 'mp-1071782']",4.35e-06,"{'Zr': 2.0, 'Mo': 4.0}",111.00420677492372,[],NM,False,166,0,"[0.0, 0.0, 0.0, 0.0, -0.0, 0.0]",7.837540803872818e-08,4.35e-06,0,8.7e-06,MP,data/source/MP/cleaned/cifs/MP-mp-2049.cif,True,,data/final/MP/graphs/Mo0.724Zr0.276-MP-mp-2049-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Nb2.7Sn1V0.3,3,0.1499999999999999,2.0,False,Nb5.4Sn2V0.6,Nb6Sn2,15.9,Other,True,Nb67.5Sn25V7.5,Nb-Sn-V,3,Supercon,Nb2.7V0.3Sn1,MP-mp-1326,Nb6Sn2,Nb-Sn,Nb75Sn25,P m -3 n,cubic,5.334611,5.334611,5.334611,data/final/MP/cifs/Nb2.7Sn1V0.3-MP-mp-1326-synth_doped.cif,data/source/MP/raw/cifs/mp-1326.cif,mp-1326,0.0,,2011-05-14 09:51:48,8.694218121896231,10.17188/1189484,"@misc{osti_1189484,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Sn (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189484"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668415'}},0.0,6.59372491,520.0,-69.93787048,-8.74223381,{'tags': ['Niobium tin (3/1)']},-69.93787048,-8.74223381,-0.163862066250001,"['xas', 'elasticity', 'bandstructure']",True,"[105230, 645503, 645489, 105231, 645498, 645485, 645474, 645496, 645480, 645488, 645482, 645487, 645500, 645493, 645477, 645484, 645502, 645483, 150878, 645479, 645481, 645486, 645473]",True,2021-05-12 10:56:12.755000,NM,8,9,mp-1326,,Nb3Sn,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Sn_d'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Sn': 1.0}",GGA,mp-1326,"['mp-930046', 'mp-913770', 'mp-930577', 'mp-1326', 'mp-1440651', 'mp-1668415', 'mp-1880085', 'mp-1594093', 'mp-1594507']",0.62023085,"{'Nb': 6.0, 'Sn': 2.0}",151.81275738025872,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0081709977567491,0.62023085,0,1.2404617,MP,data/source/MP/cleaned/cifs/MP-mp-1326.cif,True,,data/final/MP/graphs/Nb2.7Sn1V0.3-MP-mp-1326-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
As1Fe1Mg0.1Sr2V0.9O3,2,0.0249999999999999,2.0,False,As2Fe2Mg0.2Sr4V1.8O6,As2Fe2Sr4V2O6,30.0,Ferrite,True,As12.5Fe12.5Mg1.25Sr25V11.25O37.5,As-Fe-Mg-Sr-V-O,6,Supercon,Sr2V0.9Mg0.1Fe1As1O3,MP-mp-1106248,Sr4V2Fe2As2O6,As-Fe-Sr-V-O,As12.5Fe12.5Sr25V12.5O37.5,P 4/n m m,tetragonal,4.014244,4.015757,16.476769,data/final/MP/cifs/As1Fe1Mg0.1Sr2V0.9O3-MP-mp-1106248-synth_doped.cif,data/source/MP/raw/cifs/mp-1106248.cif,mp-1106248,0.0,,2018-07-19 09:49:45,5.063295609126891,,,{'GGA+U': {'task_id': 'mp-1708431'}},0.1360098730625019,3.8462893,520.0,-101.34073511,-6.333795944375,"{'tags': ['Distrontium vanadate(III) iron(II) arsenide', 'Iron distrontium vanadate(III) arsenide', 'Distrontium iron vanadate(III) arsenide']}",-101.34073511,-6.333795944375,-2.0314330885416663,['bandstructure'],True,"[248695, 165984, 184994]",True,2021-05-12 10:58:22.271000,FiM,16,19,mp-1106248,oxide,Sr2VFeAsO3,"{'functional': 'PBE', 'labels': ['Sr_sv', 'V_pv', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'V': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 3.0}",GGA+U,mp-1106248,"['mp-1106248', 'mp-1190233', 'mp-1291490', 'mp-1284904', 'mp-1297196', 'mp-1297348', 'mp-1285256', 'mp-1288721', 'mp-1298909', 'mp-1283380', 'mp-1293419', 'mp-1286747', 'mp-1298992', 'mp-1294577', 'mp-1292404', 'mp-1274716', 'mp-1425554', 'mp-1708431', 'mp-1597928']",1.83902145,"{'Sr': 4.0, 'V': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 6.0}",265.609280174371,[],FiM,True,129,2,"[-0.0, -0.0, -0.0, -0.0, -1.9, -1.9, 3.6, 3.6, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0138475692475254,1.83902145,4,3.6780429,MP,data/source/MP/cleaned/cifs/MP-mp-1106248.cif,True,,data/final/MP/graphs/As1Fe1Mg0.1Sr2V0.9O3-MP-mp-1106248-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ga6Nd1,1,0.0,2.0,False,Ga12Nd2,Ga12Nd2,0.0,Other,True,Ga85.714Nd14.286,Ga-Nd,2,Supercon,Ga6Nd1,MP-mp-1104008,Nd2Ga12,Ga-Nd,Ga85.714Nd14.286,P 4/n b m,tetragonal,6.083046,6.083046,7.665499,data/final/MP/cifs/Ga6Nd1-MP-mp-1104008.cif,data/source/MP/raw/cifs/mp-1104008.cif,mp-1104008,0.0,,2018-07-18 20:57:43,6.586895133208308,,,{'GGA': {'task_id': 'mp-1703499'}},0.0,3.70626688,520.0,-50.68275261,-3.620196615,{'tags': ['Neodymium gallide (1/6)']},-50.68275261,-3.620196615,-0.3435224228571429,['bandstructure'],True,"[634807, 634808, 634810, 634797]",True,2021-05-12 10:58:20.361000,NM,14,8,mp-1104008,,NdGa6,"{'functional': 'PBE', 'labels': ['Nd_3', 'Ga_d'], 'pot_type': 'paw'}","{'Nd': 1.0, 'Ga': 6.0}",GGA,mp-1104008,"['mp-1104008', 'mp-1104280', 'mp-1104523', 'mp-1104643', 'mp-1427283', 'mp-1703499', 'mp-1924548', 'mp-1600261']",0.001539,"{'Nd': 2.0, 'Ga': 12.0}",283.6498985320296,[],NM,False,125,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.0851405256725076e-05,0.001539,0,0.003078,MP,data/source/MP/cleaned/cifs/MP-mp-1104008.cif,False,,data/final/MP/graphs/Ga6Nd1-MP-mp-1104008.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Mo0.5Pb0.5,1,0.0,4.0,False,Mo2Pb2,Mo2Pb2,3.52,Other,True,Mo50Pb50,Mo-Pb,2,Supercon,Mo0.5Pb0.5,MP-mp-1065115,Mo2Pb2,Mo-Pb,Mo50Pb50,I 41/a m d,tetragonal,4.129123997907343,4.129123997907343,5.61654254,data/final/MP/cifs/Mo0.5Pb0.5-MP-mp-1065115.cif,data/source/MP/raw/cifs/mp-1065115.cif,mp-1065115,0.0,,2018-03-21 17:12:48,12.306854328215538,,,{'GGA': {'task_id': 'mp-1697223'}},0.9704075125000003,9.11763827,520.0,-25.23495015,-6.3087375375,"{'tags': ['Lead molybdate', 'Wulfenite']}",-25.23495015,-6.3087375375,0.9704075125000003,['bandstructure'],True,[28951],True,2021-05-12 10:58:14.654000,FM,4,8,mp-1065115,,MoPb,"{'functional': 'PBE', 'labels': ['Mo_pv', 'Pb_d'], 'pot_type': 'paw'}","{'Mo': 1.0, 'Pb': 1.0}",GGA,mp-1065115,"['mp-1065115', 'mp-1065158', 'mp-1065229', 'mp-1438382', 'mp-1697223', 'mp-1799143', 'mp-1587680', 'mp-1065207']",0.10473755,"{'Mo': 2.0, 'Pb': 2.0}",81.80413925840497,[],FM,True,141,1,"[0.1, 0.1, 0.0, 0.0]",0.0025606907168634,0.10473755,2,0.2094751,MP,data/source/MP/cleaned/cifs/MP-mp-1065115.cif,False,,data/final/MP/graphs/Mo0.5Pb0.5-MP-mp-1065115.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B0.9C1Lu1Ni1,2,0.0384615384615384,2.0,False,B1.8C2Lu2Ni2,B2C2Lu2Ni2,2.6,Other,True,B23.077C25.641Lu25.641Ni25.641,B-C-Lu-Ni,4,Supercon,Lu1Ni1B0.9C1,MP-mp-6188,Lu2Ni2B2C2,B-C-Lu-Ni,B25C25Lu25Ni25,P 4/n m m,tetragonal,3.499459,3.499459,7.54108,data/final/MP/cifs/B0.9C1Lu1Ni1-MP-mp-6188-synth_doped.cif,data/source/MP/raw/cifs/mp-6188.cif,mp-6188,0.0,,2011-05-13 11:39:58,9.22360692471969,10.17188/1277950,"@misc{osti_1277950,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LuNiBC (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277950"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701902'}},0.0,5.56637243,520.0,-56.94584528,-7.11823066,{'tags': []},-56.94584528,-7.11823066,-0.5664157422916656,"['xas', 'bandstructure']",True,"[54041, 75610]",True,2021-05-12 10:57:28.836000,NM,8,8,mp-6188,,LuNiBC,"{'functional': 'PBE', 'labels': ['Lu_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Lu': 1.0, 'Ni': 1.0, 'B': 1.0, 'C': 1.0}",GGA,mp-6188,"['mp-6188', 'mp-1007095', 'mp-1000629', 'mp-1426768', 'mp-1701902', 'mp-1796435', 'mp-1011840', 'mp-1591367']",0.0004347,"{'Lu': 2.0, 'Ni': 2.0, 'B': 2.0, 'C': 2.0}",92.34967413717082,[],NM,False,129,0,"[0, 0, 0, 0, 0, 0, 0, 0]",9.414218383798992e-06,0.0004347,0,0.0008694,MP,data/source/MP/cleaned/cifs/MP-mp-6188.cif,True,,data/final/MP/graphs/B0.9C1Lu1Ni1-MP-mp-6188-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Hf0.52Ta0.48,2,0.04,2.0,False,Hf1.04Ta0.96,Hf1Ta1,6.61,Other,True,Hf52Ta48,Hf-Ta,2,Supercon,Hf0.52Ta0.48,MP-mp-1224292,Hf1Ta1,Hf-Ta,Hf50Ta50,C m m m,orthorhombic,2.9481498,2.9481498,4.847555,data/final/MP/cifs/Hf0.52Ta0.48-MP-mp-1224292-synth_doped.cif,data/source/MP/raw/cifs/mp-1224292.cif,mp-1224292,0.0,,2019-01-13 00:33:47.189000,14.9791769406944,,,{'GGA': {'task_id': 'mp-1674442'}},0.15713474,5.05624267,520.0,-21.500697,-10.7503485,{'tags': []},-21.500697,-10.7503485,0.15713474,['bandstructure'],True,[],True,2021-05-12 10:58:45.495000,NM,2,5,mp-1224292,,HfTa,"{'functional': 'PBE', 'labels': ['Hf_pv', 'Ta_pv'], 'pot_type': 'paw'}","{'Hf': 1.0, 'Ta': 1.0}",GGA,mp-1224292,"['mp-1224292', 'mp-1428914', 'mp-1674442', 'mp-1793209', 'mp-1605247']",0.0041787,"{'Hf': 1.0, 'Ta': 1.0}",39.8460238582517,[],NM,False,65,0,"[0, 0]",0.0001048711915363,0.0041787,0,0.0041787,MP,data/source/MP/cleaned/cifs/MP-mp-1224292.cif,True,,data/final/MP/graphs/Hf0.52Ta0.48-MP-mp-1224292-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Au5Ca1,1,0.0,1.0,True,Au5Ca1,Au5Ca1,0.34,Other,True,Au83.333Ca16.667,Au-Ca,2,Supercon,Au5Ca1,MP-mp-568920,Ca1Au5,Au-Ca,Au83.333Ca16.667,F -4 3 m,cubic,5.57974426,5.579744259999999,5.579744259999999,data/final/MP/cifs/Au5Ca1-MP-mp-568920.cif,data/source/MP/raw/cifs/mp-568920.cif,mp-568920,0.0,,2014-02-16 12:46:45,13.855024649668536,10.17188/1274807,"@misc{osti_1274807,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CaAu5 (SG:216) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1274807"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703832'}},0.0,4.56158842,520.0,-20.8185393,-3.46975655,{'tags': ['Gold calcium (5/1)']},-20.8185393,-3.46975655,-0.4072552866666665,"['xas', 'elasticity', 'bandstructure']",True,[58407],True,2021-05-12 10:56:22.739000,NM,6,8,mp-568920,,CaAu5,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Au'], 'pot_type': 'paw'}","{'Ca': 1.0, 'Au': 5.0}",GGA,mp-568920,"['mp-1008053', 'mp-1001565', 'mp-568920', 'mp-1418338', 'mp-1703832', 'mp-1803874', 'mp-1012377', 'mp-1588307']",0.0034111,"{'Ca': 1.0, 'Au': 5.0}",122.8366272120081,[],NM,False,216,0,"[0, 0, 0, 0, 0, 0]",2.77694045938974e-05,0.0034111,0,0.0034111,MP,data/source/MP/cleaned/cifs/MP-mp-568920.cif,False,,data/final/MP/graphs/Au5Ca1-MP-mp-568920.json,0,True,-43m,5,0,0,0,0,0,0,0,0,0,1,1.0,False
Mo8P5,1,0.0,1.0,True,Mo8P5,Mo8P5,5.8,Other,True,Mo61.538P38.462,Mo-P,2,Supercon,Mo8P5,MP-mp-27413,Mo8P5,Mo-P,Mo61.538P38.462,P 1 m 1,monoclinic,3.205908,6.584275999999999,9.47263667,data/final/MP/cifs/Mo8P5-MP-mp-27413.cif,data/source/MP/raw/cifs/mp-27413.cif,mp-27413,0.0,,2014-02-25 21:07:28,8.119927141122533,10.17188/1201635,"@misc{osti_1201635,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Mo8P5 (SG:6) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201635"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1705077'}},0.0216127973076947,9.58150819,520.0,-120.23961209,-9.24920093,{'tags': ['Molybdenum phosphide (8/5)']},-120.23961209,-9.24920093,-0.4929196397435891,"['xas', 'bandstructure']",True,[15058],True,2021-05-12 10:57:03.017000,NM,13,10,mp-27413,,Mo8P5,"{'functional': 'PBE', 'labels': ['Mo_pv', 'P'], 'pot_type': 'paw'}","{'Mo': 8.0, 'P': 5.0}",GGA,mp-27413,"['mp-1000670', 'mp-1007137', 'mp-504534', 'mp-27413', 'mp-1116133', 'mp-1414774', 'mp-1705077', 'mp-1829536', 'mp-1011892', 'mp-1600832']",0.035123,"{'Mo': 8.0, 'P': 5.0}",188.6300981498636,[],NM,False,6,0,"[-0.0, -0.0, 0.0, 0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001862004014443,0.035123,0,0.035123,MP,data/source/MP/cleaned/cifs/MP-mp-27413.cif,False,,data/final/MP/graphs/Mo8P5-MP-mp-27413.json,0,True,m,0,0,5,0,0,0,0,1,0,0,0,1.0,False
P1Rh2,1,0.0,1.0,True,P1Rh2,P1Rh2,0.65,Other,True,P33.333Rh66.667,P-Rh,2,Supercon,P1Rh2,MP-mp-2732,P1Rh2,P-Rh,P33.333Rh66.667,F m -3 m,cubic,3.934046560000001,3.93404656,3.93404656,data/final/MP/cifs/P1Rh2-MP-mp-2732.cif,data/source/MP/raw/cifs/mp-2732.cif,mp-2732,0.0,,2011-05-12 21:14:02,9.132703519907585,10.17188/1201530,"@misc{osti_1201530,
    author = ""Persson, Kristin"",
    title = ""Materials Data on PRh2 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201530"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686476'}},0.0,7.6379248,520.0,-22.37176451,-7.457254836666666,{'tags': ['Rhodium phosphide (2/1)']},-22.37176451,-7.457254836666666,-0.7432820877777774,"['xas', 'elasticity', 'bandstructure']",True,"[603875, 648000, 38356, 647991]",True,2021-05-12 10:56:18.721000,NM,3,8,mp-2732,,PRh2,"{'functional': 'PBE', 'labels': ['P', 'Rh_pv'], 'pot_type': 'paw'}","{'P': 1.0, 'Rh': 2.0}",GGA,mp-2732,"['mp-1000586', 'mp-1007050', 'mp-2732', 'mp-1439929', 'mp-1686476', 'mp-1791933', 'mp-1011785', 'mp-1590535']",0.0043815,"{'P': 1.0, 'Rh': 2.0}",43.053006902009,[],NM,False,225,0,"[0, 0, 0]",0.0001017698951892,0.0043815,0,0.0043815,MP,data/source/MP/cleaned/cifs/MP-mp-2732.cif,False,,data/final/MP/graphs/P1Rh2-MP-mp-2732.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Cd11La1,1,0.0,3.0,False,Cd33La3,Cd33La3,0.0,Other,True,Cd91.667La8.333,Cd-La,2,Supercon,Cd11La1,MP-mp-1201591,La3Cd33,Cd-La,Cd91.667La8.333,P m -3 m,cubic,9.487197,9.487197,9.487197,data/final/MP/cifs/Cd11La1-MP-mp-1201591.cif,data/source/MP/raw/cifs/mp-1201591.cif,mp-1201591,0.0,,2019-01-12 05:46:56.889000,8.024056426801693,,,,0.0,3.24682175,520.0,-51.21778764,-1.4227163233333333,"{'tags': ['Cd11La', 'BaHg11', 'Lanthanum cadmide (1/11)']}",-51.21778764,-1.4227163233333333,-0.1654001179166666,[],False,[620068],True,2021-05-12 11:00:10.451000,NM,36,3,mp-1201591,,LaCd11,"{'functional': 'PBE', 'labels': ['La', 'Cd'], 'pot_type': 'paw'}","{'La': 1.0, 'Cd': 11.0}",GGA,mp-1201591,"['mp-1201591', 'mp-1373830', 'mp-1897096']",0.0078368666666666,"{'La': 3.0, 'Cd': 33.0}",853.9132572804297,[],NM,False,221,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.753277314709613e-05,0.0078368666666666,0,0.0235106,MP,data/source/MP/cleaned/cifs/MP-mp-1201591.cif,False,,data/final/MP/graphs/Cd11La1-MP-mp-1201591.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Bi1Cr1,1,0.0,4.0,False,Bi4Cr4,Bi4Cr4,0.0,Other,True,Bi50Cr50,Bi-Cr,2,Supercon,Bi1Cr1,MP-mp-1079128,Cr4Bi4,Bi-Cr,Bi50Cr50,P 1 21/c 1,monoclinic,4.105555,6.52530822,7.564631,data/final/MP/cifs/Bi1Cr1-MP-mp-1079128.cif,data/source/MP/raw/cifs/mp-1079128.cif,mp-1079128,0.0,,2018-04-14 03:25:01,8.553683581878337,,,{'GGA': {'task_id': 'mp-1700123'}},0.6094364512500006,5.24736397,520.0,-49.29683551,-6.16210443875,{'tags': ['Bismuth hydroxide chromate']},-49.29683551,-6.16210443875,0.6094364512500006,['bandstructure'],True,[109279],True,2021-05-12 10:58:16.596000,FiM,8,5,mp-1079128,,CrBi,"{'functional': 'PBE', 'labels': ['Cr_pv', 'Bi'], 'pot_type': 'paw'}","{'Cr': 1.0, 'Bi': 1.0}",GGA,mp-1079128,"['mp-1079128', 'mp-1432101', 'mp-1700123', 'mp-1786785', 'mp-1601362']",3.754490075,"{'Cr': 4.0, 'Bi': 4.0}",202.654993987688,[],FiM,True,14,2,"[3.6, 3.6, 3.6, 3.6, -0.2, -0.2, -0.2, -0.2]",0.0741060459675244,3.754490075,8,15.0179603,MP,data/source/MP/cleaned/cifs/MP-mp-1079128.cif,False,,data/final/MP/graphs/Bi1Cr1-MP-mp-1079128.json,0,True,2/m,0,0,3,0,0,0,0,1,0,0,0,1.0,False
Ge0.963Te1,2,0.0188487009679062,1.0,True,Ge0.963Te1,Ge1Te1,0.171,Other,True,Ge49.058Te50.942,Ge-Te,2,Supercon,Ge0.963Te1,MP-mp-938,Ge1Te1,Ge-Te,Ge50Te50,R 3 m,trigonal,4.2306661843580935,4.2306661843580935,4.37516386,data/final/MP/cifs/Ge0.963Te1-MP-mp-938-synth_doped.cif,data/source/MP/raw/cifs/mp-938.cif,mp-938,0.8215000000000003,,2011-05-12 18:44:01,5.9096523360046005,10.17188/1272924,"@misc{osti_1272924,
    author = ""Persson, Kristin"",
    title = ""Materials Data on GeTe (SG:160) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1272924"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668824'}},0.0,5.39520466,520.0,-7.95077254,-3.97538627,"{'tags': ['Germanium telluride', 'Germanium telluride (1/1) - alpha', 'Germanium(II) telluride', 'Germanium telluride (1/1)']}",-7.95077254,-3.97538627,-0.3032218774999995,"['piezo', 'xas', 'bandstructure', 'diel', 'elasticity']",True,"[159907, 188458, 56039, 56040, 56041, 659806, 659808, 43202, 655497, 659805, 165414, 56038]",True,2021-05-12 10:56:35.166000,NM,2,20,mp-938,,GeTe,"{'functional': 'PBE', 'labels': ['Ge_d', 'Te'], 'pot_type': 'paw'}","{'Ge': 1.0, 'Te': 1.0}",GGA,mp-938,"['mp-655245', 'mp-655250', 'mp-655231', 'mp-938', 'mp-1057193', 'mp-1057199', 'mp-1057210', 'mp-1060737', 'mp-1060747', 'mp-1060770', 'mp-1141488', 'mp-1119920', 'mp-1440604', 'mp-1668824', 'mp-1790742', 'mp-1863530', 'mp-1595868', 'mp-1596468', 'mp-1057206', 'mp-1060757']",1.27e-05,"{'Ge': 1.0, 'Te': 1.0}",56.264958374993846,[],NM,False,160,0,"[0, 0]",2.257177534080312e-07,1.27e-05,0,1.27e-05,MP,data/source/MP/cleaned/cifs/MP-mp-938.cif,True,,data/final/MP/graphs/Ge0.963Te1-MP-mp-938-synth_doped.json,0,True,3m,0,0,0,0,0,0,5,1,0,0,0,1.0,False
B2C1Gd0.055Lu0.945Ni2,2,0.0183333333333333,1.0,True,B2C1Gd0.055Lu0.945Ni2,B2C1Lu1Ni2,13.28,Other,True,B33.333C16.667Gd0.917Lu15.75Ni33.333,B-C-Gd-Lu-Ni,5,Supercon,Lu0.945Gd0.055Ni2B2C1,MP-mp-6544,Lu1Ni2B2C1,B-C-Lu-Ni,B33.333C16.667Lu16.667Ni33.333,I 4/m m m,tetragonal,3.4660159989239463,3.4660159989239463,5.81490896,data/final/MP/cifs/B2C1Gd0.055Lu0.945Ni2-MP-mp-6544-synth_doped.cif,data/source/MP/raw/cifs/mp-6544.cif,mp-6544,0.0,,2011-05-13 04:17:06,8.54504130524706,10.17188/1281287,"@misc{osti_1281287,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LuNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281287"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702891'}},0.0,6.71335166,520.0,-41.78223818,-6.963706363333333,{'tags': []},-41.78223818,-6.963706363333333,-0.5192416763888884,"['xas', 'bandstructure']",True,"[75609, 83230, 79564]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6544,,LuNi2B2C,"{'functional': 'PBE', 'labels': ['Lu_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Lu': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6544,"['mp-1000584', 'mp-1007055', 'mp-6544', 'mp-1441469', 'mp-1702891', 'mp-1783160', 'mp-1011794', 'mp-1588498']",0.0023161,"{'Lu': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",63.34823894903922,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",3.656139520884231e-05,0.0023161,0,0.0023161,MP,data/source/MP/cleaned/cifs/MP-mp-6544.cif,True,,data/final/MP/graphs/B2C1Gd0.055Lu0.945Ni2-MP-mp-6544-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
K1Ni2S2,3,0.1333333333333333,3.0,False,K3Ni6S6,K4Ni6S8,0.46,Ferrite,True,K20Ni40S40,K-Ni-S,3,Supercon,K1Ni2S2,MP-mp-17228,K4Ni6S8,K-Ni-S,K22.222Ni33.333S44.444,F d d d,orthorhombic,5.757716001448116,5.814097335549345,13.44704172188929,data/final/MP/cifs/K1Ni2S2-MP-mp-17228-synth_doped.cif,data/source/MP/raw/cifs/mp-17228.cif,mp-17228,0.7795000000000001,,2014-02-16 11:48:14,3.3255068811008663,10.17188/1192399,"@misc{osti_1192399,
    author = ""Persson, Kristin"",
    title = ""Materials Data on K2Ni3S4 (SG:70) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1192399"",
    place = ""United States"",
    year = ""2016"",
    month = ""5"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1673975'}},0.0,3.37947076,700.0,-85.28564686,-4.738091492222222,"{'tags': ['Potassium nickel sulfide (2/3/4)', 'Dipotassium phyllo-tetrathiotriniccolate']}",-85.28564686,-4.738091492222222,-0.9497573365000002,"['diel', 'xas', 'bandstructure']",True,"[641275, 81731]",True,2021-05-12 10:56:45.290000,NM,18,8,mp-17228,,K2Ni3S4,"{'functional': 'PBE', 'labels': ['K_sv', 'Ni_pv', 'S'], 'pot_type': 'paw'}","{'K': 2.0, 'Ni': 3.0, 'S': 4.0}",GGA,mp-17228,"['mp-17228', 'mp-1105682', 'mp-1430623', 'mp-1543292', 'mp-1541650', 'mp-1673975', 'mp-1840252', 'mp-1608359']",0.0001582,"{'K': 4.0, 'Ni': 6.0, 'S': 8.0}",382.0273561435965,[],NM,False,70,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",8.282129405441622e-07,0.0001582,0,0.0003164,MP,data/source/MP/cleaned/cifs/MP-mp-17228.cif,True,,data/final/MP/graphs/K1Ni2S2-MP-mp-17228-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,0,0,1,1.0,False
Ba2Cu3Er0.85Pr0.15O7,2,0.023076923076923,1.0,True,Ba2Cu3Er0.85Pr0.15O7,Ba2Cu3Er1O7,82.9,Cuprate,True,Ba15.385Cu23.077Er6.538Pr1.154O53.84615384615385,Ba-Cu-Er-Pr-O,5,Supercon,Er0.85Pr0.15Ba2Cu3O7,MP-mp-622110,Ba2Er1Cu3O7,Ba-Cu-Er-O,Ba15.385Cu23.077Er7.692O53.84615384615385,P m m m,orthorhombic,3.834762,3.933125,11.788769,data/final/MP/cifs/Ba2Cu3Er0.85Pr0.15O7-MP-mp-622110-synth_doped.cif,data/source/MP/raw/cifs/mp-622110.cif,mp-622110,0.0,,2014-02-15 20:42:48,6.953388209207566,10.17188/1278094,"@misc{osti_1278094,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2ErCu3O7 (SG:47) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278094"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1676776'}},0.0334336014102625,3.20253361,520.0,-79.04238944,-6.080183803076922,"{'tags': ['Erbium barium copper oxide (1/2/3/7)', 'Erbium dibarium tricopper heptaoxide']}",-79.04238944,-6.080183803076922,-2.1932601480769227,['bandstructure'],True,"[63405, 81176]",True,2021-05-12 10:58:51.532000,NM,13,8,mp-622110,oxide,Ba2ErCu3O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Er_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Er': 1.0, 'Cu': 3.0, 'O': 7.0}",GGA,mp-622110,"['mp-932741', 'mp-622110', 'mp-931664', 'mp-916329', 'mp-1380960', 'mp-1676776', 'mp-1835850', 'mp-1598909']",0.0002229,"{'Ba': 2.0, 'Er': 1.0, 'Cu': 3.0, 'O': 7.0}",177.80526717534096,[],NM,False,47,0,"[0.0, 0.0, 0.0, 0.0, 0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",1.2536186556284031e-06,0.0002229,0,0.0002229,MP,data/source/MP/cleaned/cifs/MP-mp-622110.cif,True,,data/final/MP/graphs/Ba2Cu3Er0.85Pr0.15O7-MP-mp-622110-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Pb3Sr1,1,0.0,1.0,True,Pb3Sr1,Pb3Sr1,1.85,Other,True,Pb75Sr25,Pb-Sr,2,Supercon,Pb3Sr1,MP-mp-21162,Sr1Pb3,Pb-Sr,Pb75Sr25,P m -3 m,cubic,5.051975,5.051975,5.051975,data/final/MP/cifs/Pb3Sr1-MP-mp-21162.cif,data/source/MP/raw/cifs/mp-21162.cif,mp-21162,0.0,,2014-02-21 08:42:42,9.133694752070644,10.17188/1196429,"@misc{osti_1196429,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SrPb3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196429"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696441'}},0.0,5.95694755,520.0,-14.11951311,-3.5298782775,{'tags': ['Lead strontium (3/1)']},-14.11951311,-3.5298782775,-0.3230196116666661,"['xas', 'bandstructure']",True,"[105626, 105625, 648572]",True,2021-05-12 10:56:57.051000,NM,4,8,mp-21162,,SrPb3,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Pb_d'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Pb': 3.0}",GGA,mp-21162,"['mp-930579', 'mp-930953', 'mp-913792', 'mp-21162', 'mp-1441340', 'mp-1696441', 'mp-1803772', 'mp-1591715']",0.0019031,"{'Sr': 1.0, 'Pb': 3.0}",128.93878641467248,[],NM,False,221,0,"[0, 0, 0, 0]",1.4759717017031256e-05,0.0019031,0,0.0019031,MP,data/source/MP/cleaned/cifs/MP-mp-21162.cif,False,,data/final/MP/graphs/Pb3Sr1-MP-mp-21162.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Cu1La1.85Na0.15O4,2,0.0428571428571428,1.0,True,Cu1La1.85Na0.15O4,Cu1La2O4,0.0,Cuprate,True,Cu14.286La26.429Na2.143O57.142857142857146,Cu-La-Na-O,4,Supercon,La1.85Na0.15Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La1.85Na0.15O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La1.85Na0.15O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ba2Ca1Cu2Hg1O6.22,2,0.0180032733224222,0.9647260450160772,True,Ba1.929Ca0.965Cu1.929Hg0.965O6,Ba2Ca1Cu2Hg1O6,127.0,Cuprate,True,Ba16.367Ca8.183Cu16.367Hg8.183O50.90016366612111,Ba-Ca-Cu-Hg-O,5,Supercon,Hg1Ba2Ca1Cu2O6.22,MP-mp-6879,Ba2Ca1Cu2Hg1O6,Ba-Ca-Cu-Hg-O,Ba16.667Ca8.333Cu16.667Hg8.333O50,P 4/m m m,tetragonal,3.904834,3.904834,13.058604,data/final/MP/cifs/Ba2Ca1Cu2Hg1O6.22-MP-mp-6879-synth_doped.cif,data/source/MP/raw/cifs/mp-6879.cif,mp-6879,0.0,,2011-05-14 23:17:39,6.158075338837193,10.17188/1284432,"@misc{osti_1284432,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2CaCu2HgO6 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1284432"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698891'}},0.017586347638888,3.04291167,520.0,-64.08791228,-5.3406593566666665,"{'tags': ['High pressure experimental phase', 'Mercury dibarium calcium dicopper oxide', 'Mercury barium calcium copper oxide (1/2/1/2/6)']}",-64.08791228,-5.3406593566666665,-2.0147092504166664,"['bandstructure', 'elasticity']",True,"[83087, 75729, 75727, 75726, 75725, 75728]",True,2021-05-12 10:56:27.046000,NM,12,12,mp-6879,oxide,Ba2CaCu2HgO6,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ca_sv', 'Cu_pv', 'Hg', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Hg': 1.0, 'O': 6.0}",GGA,mp-6879,"['mp-917434', 'mp-924375', 'mp-6879', 'mp-923788', 'mvc-16307', 'mp-1045026', 'mp-1045039', 'mp-1422313', 'mp-1698891', 'mp-1833979', 'mp-1592102', 'mp-1045044']",0.0305618,"{'Ba': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Hg': 1.0, 'O': 6.0}",199.11404926320108,[],NM,False,123,0,"[0.0, 0.0, 0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001534889181004,0.0305618,0,0.0305618,MP,data/source/MP/cleaned/cifs/MP-mp-6879.cif,True,,data/final/MP/graphs/Ba2Ca1Cu2Hg1O6.22-MP-mp-6879-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Cu2Gd1Ru0.975Sn0.025Sr2O8,2,0.0035714285714285,2.0,False,Cu4Gd2Ru1.95Sn0.05Sr4O16,Cu4Gd2Ru2Sr4O16,36.9,Cuprate,True,Cu14.286Gd7.143Ru6.964Sn0.179Sr14.286O57.142857142857146,Cu-Gd-Ru-Sn-Sr-O,6,Supercon,Ru0.975Sn0.025Sr2Gd1Cu2O8,MP-mp-1194240,Sr4Gd2Cu4Ru2O16,Cu-Gd-Ru-Sr-O,Cu14.286Gd7.143Ru7.143Sr14.286O57.142857142857146,P 4/m b m,tetragonal,5.472451,5.472451,11.740702,data/final/MP/cifs/Cu2Gd1Ru0.975Sn0.025Sr2O8-MP-mp-1194240-synth_doped.cif,data/source/MP/raw/cifs/mp-1194240.cif,mp-1194240,0.0,,2019-01-11 23:51:58.932000,6.504561898971391,,,{'GGA': {'task_id': 'mp-1765260'}},0.0213449239285443,3.93502801,520.0,-201.55352223,-7.198340079642857,"{'tags': ['Sr2Cu2GdRuO8 orth', 'Sr2Cu2GdRuO8', 'Ruthenium distrontium gadolinium dicopper octaoxide']}",-201.55352223,-7.198340079642857,-2.268654352380952,['bandstructure'],True,[245741],True,2021-05-12 10:58:35.561000,FiM,28,6,mp-1194240,oxide,Sr2GdCu2RuO8,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Gd', 'Cu_pv', 'Ru_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Gd': 1.0, 'Cu': 2.0, 'Ru': 1.0, 'O': 8.0}",GGA,mp-1194240,"['mp-1194240', 'mp-1396976', 'mp-1659973', 'mp-1765260', 'mp-1841948', 'mp-1638264']",4.23696715,"{'Sr': 4.0, 'Gd': 2.0, 'Cu': 4.0, 'Ru': 2.0, 'O': 16.0}",351.6072554818909,[],FiM,True,127,2,"[-0.0, -0.0, -0.0, -0.0, 6.9, 6.9, 0.0, 0.0, 0.0, 0.0, -1.8, -1.8, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0241005672319991,4.23696715,4,8.4739343,MP,data/source/MP/cleaned/cifs/MP-mp-1194240.cif,True,,data/final/MP/graphs/Cu2Gd1Ru0.975Sn0.025Sr2O8-MP-mp-1194240-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
C2Pt0.9Rh0.1U2,2,0.0399999999999999,1.0,True,C2Pt0.9Rh0.1U2,C2Pt1U2,1.09,Heavy_fermion,True,C40Pt18Rh2U40,C-Pt-Rh-U,4,Supercon,U2Pt0.9Rh0.1C2,MP-mp-1068685,U2Pt1C2,C-Pt-U,C40Pt20U40,I 4/m m m,tetragonal,3.523293998450595,3.523293998450595,6.73411484,data/final/MP/cifs/C2Pt0.9Rh0.1U2-MP-mp-1068685-synth_doped.cif,data/source/MP/raw/cifs/mp-1068685.cif,mp-1068685,0.0,,2018-03-21 23:31:09,14.863441200395862,,,{'GGA': {'task_id': 'mp-1678129'}},0.0,10.58963566,520.0,-48.59510218,-9.719020436,"{'tags': ['U2PtC2', 'Platinum uranium carbide (1/2/2)', 'Uranium platinum carbide (2/1/2)', 'Na2HgO2']}",-48.59510218,-9.719020436,-0.2975626099999999,['bandstructure'],True,"[618656, 618660, 618659]",True,2021-05-12 10:58:14.654000,FM,5,16,mp-1068685,,U2PtC2,"{'functional': 'PBE', 'labels': ['U', 'Pt', 'C'], 'pot_type': 'paw'}","{'U': 2.0, 'Pt': 1.0, 'C': 2.0}",GGA,mp-1068685,"['mp-1068685', 'mp-1068739', 'mp-1068893', 'mp-1070007', 'mp-1070048', 'mp-1070082', 'mp-1070138', 'mp-1070185', 'mp-1070251', 'mp-1437934', 'mp-1678129', 'mp-1798891', 'mp-1591066', 'mp-1070208', 'mp-1070148', 'mp-1068837']",2.8448974,"{'U': 2.0, 'Pt': 1.0, 'C': 2.0}",77.66342053028113,[],FM,True,139,1,"[1.3, 1.3, 0.0, 0.0, 0.0]",0.0366311112821868,2.8448974,2,2.8448974,MP,data/source/MP/cleaned/cifs/MP-mp-1068685.cif,True,,data/final/MP/graphs/C2Pt0.9Rh0.1U2-MP-mp-1068685-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Mo0.52Re0.48,2,0.04,2.0,False,Mo1.04Re0.96,Mo1Re1,11.1,Other,True,Mo52Re48,Mo-Re,2,Supercon,Mo0.52Re0.48,MP-mp-1219485,Re1Mo1,Mo-Re,Mo50Re50,C m m m,orthorhombic,2.71936353,2.71936353,4.457651,data/final/MP/cifs/Mo0.52Re0.48-MP-mp-1219485-synth_doped.cif,data/source/MP/raw/cifs/mp-1219485.cif,mp-1219485,0.0,,2019-01-12 20:28:58.315000,15.093827410702431,,,{'GGA': {'task_id': 'mp-1675676'}},0.1130813237499985,8.320612,520.0,-23.08071648,-11.54035824,{'tags': []},-23.08071648,-11.54035824,0.1047268675000001,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,2,5,mp-1219485,,ReMo,"{'functional': 'PBE', 'labels': ['Re_pv', 'Mo_pv'], 'pot_type': 'paw'}","{'Re': 1.0, 'Mo': 1.0}",GGA,mp-1219485,"['mp-1219485', 'mp-1425249', 'mp-1675676', 'mp-1792472', 'mp-1630224']",0.0007488,"{'Re': 1.0, 'Mo': 1.0}",31.0402460075689,[],NM,False,65,0,"[0, 0]",2.412352014920924e-05,0.0007488,0,0.0007488,MP,data/source/MP/cleaned/cifs/MP-mp-1219485.cif,True,,data/final/MP/graphs/Mo0.52Re0.48-MP-mp-1219485-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Al28Ca24O66,1,0.0,0.5,False,Al14Ca12O33,Al14Ca12O33,0.195,Oxide,True,Al23.729Ca20.339O55.932203389830505,Al-Ca-O,3,Supercon,Ca24Al28O66,MP-mp-532016,Ca12Al14O33,Al-Ca-O,Al23.729Ca20.339O55.932203389830505,P 1,triclinic,10.449521,10.460289189999996,10.46896361,data/final/MP/cifs/Al28Ca24O66-MP-mp-532016.cif,data/source/MP/raw/cifs/mp-532016.cif,mp-532016,2.0490000000000004,,2014-02-20 14:29:43,2.611766291946113,10.17188/1263366,"@misc{osti_1263366,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ca12Al14O33 (SG:1) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1263366"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",,0.006342488305072,2.89140101,520.0,-419.87557098,-7.116535101355932,{'tags': []},-419.87557098,-7.116535101355932,-3.436586400593221,['xas'],False,[],True,2021-05-12 10:57:10.838000,NM,59,7,mp-532016,oxide,Ca12Al14O33,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Al', 'O'], 'pot_type': 'paw'}","{'Ca': 12.0, 'Al': 14.0, 'O': 33.0}",GGA,mp-532016,"['mp-730358', 'mp-532016', 'mp-1253583', 'mp-1254746', 'mp-1267798', 'mp-1364938', 'mp-1898056']",0.0007896,"{'Ca': 12.0, 'Al': 14.0, 'O': 33.0}",881.6253418378175,[],NM,False,1,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",8.956185383169869e-07,0.0007896,0,0.0007896,MP,data/source/MP/cleaned/cifs/MP-mp-532016.cif,False,,data/final/MP/graphs/Al28Ca24O66-MP-mp-532016.json,0,True,1,0,0,0,0,0,1,0,1,0,0,0,1.0,False
Bi1K1O3,1,0.0,12.0,False,Bi12K12O36,Bi12K12O36,9.6,Oxide,True,Bi20K20O60,Bi-K-O,3,Supercon,K1Bi1O3,MP-mp-29799,K12Bi12O36,Bi-K-O,Bi20K20O60,P n -3,cubic,10.215236,10.215236,10.215236,data/final/MP/cifs/Bi1K1O3-MP-mp-29799.cif,data/source/MP/raw/cifs/mp-29799.cif,mp-29799,1.0911000000000002,,2014-02-18 00:47:35,5.534643536603829,10.17188/1204255,"@misc{osti_1204255,
    author = ""Persson, Kristin"",
    title = ""Materials Data on KBiO3 (SG:201) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1204255"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1684553'}},0.0,1.3133405,520.0,-308.00654913,-5.1334424855,"{'tags': ['Potassium catena-bismutate', 'Potassium catena-bismuthate 0.25-hydrate']}",-308.00654913,-5.1334424855,-1.5767792311000008,"['xas', 'bandstructure']",True,"[41204, 76976]",True,2021-05-12 10:57:04.957000,NM,60,7,mp-29799,oxide,KBiO3,"{'functional': 'PBE', 'labels': ['K_sv', 'Bi', 'O'], 'pot_type': 'paw'}","{'K': 1.0, 'Bi': 1.0, 'O': 3.0}",GGA,mp-29799,"['mp-723384', 'mp-722643', 'mp-29799', 'mp-1238417', 'mp-1362086', 'mp-1684553', 'mp-734738']",0.0001604833333333,"{'K': 12.0, 'Bi': 12.0, 'O': 36.0}",1065.9705672091172,[],NM,False,201,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.8066164857084704e-06,0.0001604833333333,0,0.0019258,MP,data/source/MP/cleaned/cifs/MP-mp-29799.cif,False,,data/final/MP/graphs/Bi1K1O3-MP-mp-29799.json,0,True,m-3,2,0,0,0,0,0,0,1,0,0,0,1.0,False
Al0.9Nb3Se0.1,2,0.0499999999999999,2.0,False,Al1.8Nb6Se0.2,Al2Nb6,17.6,Other,True,Al22.5Nb75Se2.5,Al-Nb-Se,3,Supercon,Nb3Al0.9Se0.1,MP-mp-796,Nb6Al2,Al-Nb,Al25Nb75,P m -3 n,cubic,5.215254,5.215254,5.215254,data/final/MP/cifs/Al0.9Nb3Se0.1-MP-mp-796-synth_doped.cif,data/source/MP/raw/cifs/mp-796.cif,mp-796,0.0,,2011-05-13 16:07:37,7.157298025966356,,,{'GGA': {'task_id': 'mp-1686893'}},0.0460773865000003,5.52947534,520.0,-69.48918494,-8.6861481175,"{'tags': ['Aluminium niobium (1/3)', 'Niobium aluminide (3/1)', 'Aluminum niobium (1/3)']}",-69.48918494,-8.6861481175,-0.1737753800000003,"['bandstructure', 'elasticity']",True,"[608675, 608654, 608688, 608668, 608669, 608685, 608676, 608683, 58014, 608657, 107856, 608655, 608666, 608691, 608656, 608665, 608673, 608653, 608661]",True,2021-05-12 10:56:31.128000,NM,8,10,mp-796,,Nb3Al,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Al': 1.0}",GGA,mp-796,"['mp-911586', 'mp-927906', 'mp-796', 'mp-927472', 'mp-1260512', 'mp-1440919', 'mp-1686893', 'mp-1927652', 'mp-1591599', 'mp-1587739']",0.16323955,"{'Nb': 6.0, 'Al': 2.0}",141.8490379078192,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0023015954483396,0.16323955,0,0.3264791,MP,data/source/MP/cleaned/cifs/MP-mp-796.cif,True,,data/final/MP/graphs/Al0.9Nb3Se0.1-MP-mp-796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ga3Pd2U1,1,0.0,1.0,True,Ga3Pd2U1,Ga3Pd2U1,0.0,Heavy_fermion,True,Ga50Pd33.333U16.667,Ga-Pd-U,3,Supercon,U1Pd2Ga3,MP-mp-20899,U1Ga3Pd2,Ga-Pd-U,Ga50Pd33.333U16.667,P 6/m m m,hexagonal,4.307727,5.335528004688491,5.33552732,data/final/MP/cifs/Ga3Pd2U1-MP-mp-20899.cif,data/source/MP/raw/cifs/mp-20899.cif,mp-20899,0.0,,2014-02-22 16:47:26,10.320112735627264,10.17188/1196093,"@misc{osti_1196093,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UGa3Pd2 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196093"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1694975'}},0.0415313735606055,6.61536964,520.0,-33.48471722,-5.580786203333333,{'tags': ['Uranium palladium gallide (1/2/3)']},-33.48471722,-5.580786203333333,-0.45820925375,"['xas', 'bandstructure']",True,[246595],True,2021-05-12 10:56:57.051000,FM,6,9,mp-20899,,UGa3Pd2,"{'functional': 'PBE', 'labels': ['U', 'Ga_d', 'Pd'], 'pot_type': 'paw'}","{'U': 1.0, 'Ga': 3.0, 'Pd': 2.0}",GGA,mp-20899,"['mp-992967', 'mp-990980', 'mp-20899', 'mp-1178869', 'mp-1413591', 'mp-1694975', 'mp-1795689', 'mp-994326', 'mp-1594545']",2.294485,"{'U': 1.0, 'Ga': 3.0, 'Pd': 2.0}",106.20220564144816,[],FM,True,191,1,"[2.3, 0.0, 0.0, 0.0, 0.0, 0.0]",0.021604871444445,2.294485,1,2.294485,MP,data/source/MP/cleaned/cifs/MP-mp-20899.cif,False,,data/final/MP/graphs/Ga3Pd2U1-MP-mp-20899.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Bi2Ca0.2Cu2Pr0.8Sr2O8,3,0.0266666666666666,1.0,True,Bi2Ca0.2Cu2Pr0.8Sr2O8,Bi2Cu2Pr1Sr2O8,0.0,Cuprate,True,Bi13.333Ca1.333Cu13.333Pr5.333Sr13.333O53.333333333333336,Bi-Ca-Cu-Pr-Sr-O,6,Supercon,Bi2Sr2Ca0.2Pr0.8Cu2O8,MP-mp-1208752,Sr2Pr1Cu2Bi2O8,Bi-Cu-Pr-Sr-O,Bi13.333Cu13.333Pr6.667Sr13.333O53.333333333333336,I 4/m m m,tetragonal,3.834136000030565,3.834136000030565,15.612086169999998,data/final/MP/cifs/Bi2Ca0.2Cu2Pr0.8Sr2O8-MP-mp-1208752-synth_doped.cif,data/source/MP/raw/cifs/mp-1208752.cif,mp-1208752,0.0,,2019-01-12 11:36:34.547000,7.267491513783425,,,{'GGA': {'task_id': 'mp-1737201'}},0.1119466963333302,5.05599766,520.0,-89.97734715,-5.99848981,"{'tags': ['Ba2CaCu2Tl2O8', 'high-Tc cuprate family', 'Sr2Cu2PrBi2O8']}",-89.97734715,-5.99848981,-2.1167527398888883,[],False,[],True,2021-05-12 11:00:21.818000,NM,15,4,mp-1208752,oxide,Sr2PrCu2(BiO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Pr_3', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Pr': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",GGA,mp-1208752,"['mp-1208752', 'mp-1390177', 'mp-1737201', 'mp-1934574']",0.0020197,"{'Sr': 2.0, 'Pr': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",226.019943500512,[],NM,False,139,0,"[0.0, 0.0, 0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",8.935937106786441e-06,0.0020197,0,0.0020197,MP,data/source/MP/cleaned/cifs/MP-mp-1208752.cif,True,,data/final/MP/graphs/Bi2Ca0.2Cu2Pr0.8Sr2O8-MP-mp-1208752-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Hf0.2V2Zr0.8,3,0.1333333333333333,4.0,False,Hf0.8V8Zr3.2,V8Zr4,8.85,Other,True,Hf6.667V66.667Zr26.667,Hf-V-Zr,3,Supercon,Hf0.2Zr0.8V2,MP-mp-1103264,Zr4V8,V-Zr,V66.667Zr33.333,P 63/m m c,hexagonal,5.208193229598517,5.20819373,8.45714,data/final/MP/cifs/Hf0.2V2Zr0.8-MP-mp-1103264-synth_doped.cif,data/source/MP/raw/cifs/mp-1103264.cif,mp-1103264,0.0,,2018-07-18 17:51:18,6.456226553557358,,,,0.0325666608333339,4.94123829,520.0,-106.47125115,-8.8726042625,{'tags': ['Vanadium zirconium (2/1)']},-106.47125115,-8.8726042625,0.0325666608333321,[],False,[653414],True,2021-05-12 10:59:31.014000,FM,12,3,mp-1103264,,ZrV2,"{'functional': 'PBE', 'labels': ['Zr_sv', 'V_pv'], 'pot_type': 'paw'}","{'Zr': 1.0, 'V': 2.0}",GGA,mp-1103264,"['mp-1103264', 'mp-1834547', 'mp-1986833']",0.158094725,"{'Zr': 4.0, 'V': 8.0}",198.6681941061952,[],FM,True,194,2,"[0.0, 0.0, 0.0, 0.0, -0.0, -0.0, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1]",0.0031830907954092,0.158094725,6,0.6323789,MP,data/source/MP/cleaned/cifs/MP-mp-1103264.cif,True,,data/final/MP/graphs/Hf0.2V2Zr0.8-MP-mp-1103264-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ga2La1Ni1,1,0.0,2.0,False,Ga4La2Ni2,Ga4La2Ni2,1.97,Other,True,Ga50La25Ni25,Ga-La-Ni,3,Supercon,La1Ni1Ga2,MP-mp-1079217,La2Ga4Ni2,Ga-La-Ni,Ga50La25Ni25,C m m m,orthorhombic,4.224991,4.294625997085715,9.05551195,data/final/MP/cifs/Ga2La1Ni1-MP-mp-1079217.cif,data/source/MP/raw/cifs/mp-1079217.cif,mp-1079217,0.0,,2018-04-14 10:00:46,7.012445255914795,,,{'GGA': {'task_id': 'mp-1671829'}},0.0,6.17280058,520.0,-38.53697289,-4.81712161125,"{'tags': ['NdNiGa2', 'LaNiGa2', 'Lanthanum nickel gallide (1/1/2)']}",-38.53697289,-4.81712161125,-0.6240376537499994,['bandstructure'],True,"[634496, 634508]",True,2021-05-12 10:58:16.596000,NM,8,6,mp-1079217,,LaGa2Ni,"{'functional': 'PBE', 'labels': ['La', 'Ga_d', 'Ni_pv'], 'pot_type': 'paw'}","{'La': 1.0, 'Ga': 2.0, 'Ni': 1.0}",GGA,mp-1079217,"['mp-1079217', 'mp-1080185', 'mp-1300892', 'mp-1671829', 'mp-1786816', 'mp-1591143']",0.0006983,"{'La': 2.0, 'Ga': 4.0, 'Ni': 2.0}",159.62368429473233,[],NM,False,65,0,"[0, 0, 0, 0, 0, 0, 0, 0]",8.749328185041075e-06,0.0006983,0,0.0013966,MP,data/source/MP/cleaned/cifs/MP-mp-1079217.cif,False,,data/final/MP/graphs/Ga2La1Ni1-MP-mp-1079217.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Al2Y3,1,0.0,4.0,False,Al8Y12,Al8Y12,0.0,Other,True,Al40Y60,Al-Y,2,Supercon,Al2Y3,MP-mp-16723,Y12Al8,Al-Y,Al40Y60,P 42/m n m,tetragonal,7.640163,8.253504,8.253504,data/final/MP/cifs/Al2Y3-MP-mp-16723.cif,data/source/MP/raw/cifs/mp-16723.cif,mp-16723,0.0,,2011-06-06 13:45:07,4.09262974869367,10.17188/1192121,"@misc{osti_1192121,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Y3Al2 (SG:136) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1192121"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671400'}},0.0035013125000009,4.08219334,520.0,-114.65279227,-5.7326396135,"{'tags': ['Yttrium aluminium hydride (3/2/6.5)', 'Aluminum yttrium (2/3)', 'Yttrium aluminium (3/2)', 'Yttrium aluminide (3/2)', 'Yttrium aluminium hydride (3/2/2.2)']}",-114.65279227,-5.7326396135,-0.3545266135000006,"['xas', 'elasticity', 'bandstructure']",True,"[609651, 163945, 247100, 163947, 58215]",True,2021-05-12 10:56:14.760000,NM,20,11,mp-16723,,Y3Al2,"{'functional': 'PBE', 'labels': ['Y_sv', 'Al'], 'pot_type': 'paw'}","{'Y': 3.0, 'Al': 2.0}",GGA,mp-16723,"['mp-940823', 'mp-932049', 'mp-940969', 'mp-16723', 'mp-1178758', 'mp-1189734', 'mp-1202526', 'mp-1433816', 'mp-1671400', 'mp-1825088', 'mp-1606610']",0.017667775,"{'Y': 12.0, 'Al': 8.0}",520.4504116575515,[],NM,False,136,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0001357883448971,0.017667775,0,0.0706711,MP,data/source/MP/cleaned/cifs/MP-mp-16723.cif,False,,data/final/MP/graphs/Al2Y3-MP-mp-16723.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Bi1K0.6Sr0.4O3,2,0.0399999999999999,2.0,False,Bi2K1.2Sr0.8O6,Bi2K1Sr1O6,11.42166667,Oxide,True,Bi20K12Sr8O60,Bi-K-Sr-O,4,Supercon,Sr0.4K0.6Bi1O3,MP-mp-1223282,K1Sr1Bi2O6,Bi-K-Sr-O,Bi20K10Sr10O60,I -4 2 m,tetragonal,5.991507995332216,6.07880892,5.991507995332216,data/final/MP/cifs/Bi1K0.6Sr0.4O3-MP-mp-1223282-synth_doped.cif,data/source/MP/raw/cifs/mp-1223282.cif,mp-1223282,0.0,,2019-01-12 23:41:54.254000,6.798384772143532,,,{'GGA': {'task_id': 'mp-1731139'}},0.0200349067500003,3.32593805,520.0,-55.13530195,-5.513530195,{'tags': []},-55.13530195,-5.513530195,-1.8989574899666664,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,10,5,mp-1223282,oxide,KSr(BiO3)2,"{'functional': 'PBE', 'labels': ['K_sv', 'Sr_sv', 'Bi', 'O'], 'pot_type': 'paw'}","{'K': 1.0, 'Sr': 1.0, 'Bi': 2.0, 'O': 6.0}",GGA,mp-1223282,"['mp-1223282', 'mp-1407280', 'mp-1731139', 'mp-1779288', 'mp-1623468']",0.0002262,"{'K': 1.0, 'Sr': 1.0, 'Bi': 2.0, 'O': 6.0}",156.4881559988625,[],NM,False,121,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.4454768065747048e-06,0.0002262,0,0.0002262,MP,data/source/MP/cleaned/cifs/MP-mp-1223282.cif,True,,data/final/MP/graphs/Bi1K0.6Sr0.4O3-MP-mp-1223282-synth_doped.json,0,True,-42m,0,0,0,0,6,0,0,0,0,1,0,1.0,False
Na3Sb1,1,0.0,2.0,False,Na6Sb2,Na6Sb2,0.0,Other,True,Na75Sb25,Na-Sb,2,Supercon,Na3Sb1,MP-mp-7956,Na6Sb2,Na-Sb,Na75Sb25,P 63/m m c,hexagonal,5.3759160018502925,5.37591702,9.56053,data/final/MP/cifs/Na3Sb1-MP-mp-7956.cif,data/source/MP/raw/cifs/mp-7956.cif,mp-7956,0.3945000000000001,,2011-05-28 05:41:28,2.647151928840332,10.17188/1307864,"@misc{osti_1307864,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Na3Sb (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1307864"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702897'}},0.0,1.69051769,520.0,-19.61912869,-2.45239108625,{'tags': ['Sodium antimonide']},-19.61912869,-2.45239108625,-0.4762468061637932,"['diel', 'bandstructure', 'elasticity', 'phonons']",True,[26882],True,2021-05-12 10:56:31.128000,NM,8,9,mp-7956,,Na3Sb,"{'functional': 'PBE', 'labels': ['Na_pv', 'Sb'], 'pot_type': 'paw'}","{'Na': 3.0, 'Sb': 1.0}",GGA,mp-7956,"['mp-914247', 'mp-931001', 'mp-7956', 'mp-930913', 'mp-1141334', 'mp-1431059', 'mp-1702897', 'mp-1866143', 'mp-1609033']",0.0017357,"{'Na': 6.0, 'Sb': 2.0}",239.2862029287785,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.4507313658335878e-05,0.0017357,0,0.0034714,MP,data/source/MP/cleaned/cifs/MP-mp-7956.cif,False,,data/final/MP/graphs/Na3Sb1-MP-mp-7956.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
As1F0.085Fe1Sm1O0.915,2,0.0424999999999999,2.0,False,As2F0.17Fe2Sm2O1.83,As2Fe2Sm2O2,14.0,Ferrite,True,As25F2.125Fe25Sm25O22.875,As-F-Fe-Sm-O,5,Supercon,Sm1Fe1As1F0.085O0.915,MP-mp-20349,Sm2Fe2As2O2,As-Fe-Sm-O,As25Fe25Sm25O25,P 4/n m m,tetragonal,4.026492,4.026492,9.046755,data/final/MP/cifs/As1F0.085Fe1Sm1O0.915-MP-mp-20349-synth_doped.cif,data/source/MP/raw/cifs/mp-20349.cif,mp-20349,0.0,,2014-02-19 11:24:42,6.727802583283198,,,{'GGA+U': {'task_id': 'mp-1695938'}},0.3015723809374986,3.77685593,520.0,-52.73407138,-6.5917589225,{'tags': ['Samarium iron arsenic oxide (1/1/1/1)']},-52.73407138,-6.5917589225,-1.6285904237499995,"['xas', 'elasticity', 'bandstructure']",True,"[236652, 236653, 422002, 163457, 163458]",True,2021-05-12 10:56:16.728000,FM,8,10,mp-20349,oxide,SmFeAsO,"{'functional': 'PBE', 'labels': ['Sm_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Sm': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-20349,"['mp-24944', 'mp-1078897', 'mp-1079866', 'mp-1173321', 'mp-20349', 'mp-1425472', 'mp-1695938', 'mp-1772503', 'mp-1789694', 'mp-1588381']",3.75729895,"{'Sm': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",146.67176231613362,[],FM,True,129,1,"[0.0, 0.0, 3.5, 3.5, -0.0, -0.0, -0.0, -0.0]",0.0512341147425717,3.75729895,2,7.5145979,MP,data/source/MP/cleaned/cifs/MP-mp-20349.cif,True,,data/final/MP/graphs/As1F0.085Fe1Sm1O0.915-MP-mp-20349-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
La3Te4,1,0.0,2.0,False,La6Te8,La6Te8,4.0275,Other,True,La42.857Te57.143,La-Te,2,Supercon,La3Te4,MP-mp-879,La6Te8,La-Te,La42.857Te57.143,I -4 3 d,cubic,8.388446771859588,8.38844677,8.38844677,data/final/MP/cifs/La3Te4-MP-mp-879.cif,data/source/MP/raw/cifs/mp-879.cif,mp-879,0.0,,2011-05-15 00:37:18,6.776268301603385,10.17188/1312714,"@misc{osti_1312714,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La3Te4 (SG:220) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1312714"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1709246'}},0.0,8.58054873,520.0,-77.22082487,-5.515773205,{'tags': ['Lanthanum telluride (3/4)']},-77.22082487,-5.515773205,-1.8453124857142864,"['xas', 'elasticity', 'bandstructure']",True,"[642013, 642048, 642018, 642029, 642044, 642055]",True,2021-05-12 10:56:33.121000,NM,14,8,mp-879,,La3Te4,"{'functional': 'PBE', 'labels': ['La', 'Te'], 'pot_type': 'paw'}","{'La': 3.0, 'Te': 4.0}",GGA,mp-879,"['mp-944515', 'mp-933710', 'mp-943860', 'mp-879', 'mp-1424887', 'mp-1709246', 'mp-1820181', 'mp-1603912']",0.0270629,"{'La': 6.0, 'Te': 8.0}",454.3837255460109,[],NM,False,220,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0001191191430436,0.0270629,0,0.0541258,MP,data/source/MP/cleaned/cifs/MP-mp-879.cif,False,,data/final/MP/graphs/La3Te4-MP-mp-879.json,0,True,-43m,5,0,0,0,0,0,0,0,0,1,0,1.0,False
Ir0.95Te2,2,0.0225988700564971,4.0,False,Ir3.8Te8,Ir4Te8,4.68,Other,True,Ir32.203Te67.797,Ir-Te,2,Supercon,Ir0.95Te2,MP-mp-569322,Te8Ir4,Ir-Te,Ir33.333Te66.667,P n m a,orthorhombic,4.049805,5.441863,13.587474,data/final/MP/cifs/Ir0.95Te2-MP-mp-569322-synth_doped.cif,data/source/MP/raw/cifs/mp-569322.cif,mp-569322,0.0,,2014-02-16 04:48:25,9.924328423353325,10.17188/1275037,"@misc{osti_1275037,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Te2Ir (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1275037"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1746248'}},0.0123894575000003,7.60847828,520.0,-63.94410921,-5.3286757675,{'tags': ['Iridium telluride (1/2)']},-63.94410921,-5.3286757675,-0.5683316741666667,"['xas', 'bandstructure']",True,[93894],True,2021-05-12 10:57:24.969000,NM,12,7,mp-569322,,Te2Ir,"{'functional': 'PBE', 'labels': ['Te', 'Ir'], 'pot_type': 'paw'}","{'Te': 2.0, 'Ir': 1.0}",GGA,mp-569322,"['mp-927873', 'mp-927408', 'mp-569322', 'mp-911451', 'mp-1392626', 'mp-1746248', 'mp-1810340']",0.000153075,"{'Te': 8.0, 'Ir': 4.0}",299.44732816890644,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.0447669503153013e-06,0.000153075,0,0.0006123,MP,data/source/MP/cleaned/cifs/MP-mp-569322.cif,True,,data/final/MP/graphs/Ir0.95Te2-MP-mp-569322-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ba2.2Cu4Y1O8,3,0.0789473684210526,0.75,False,Ba1.65Cu3Y0.75O6,Ba2Cu3Y1O6,80.0,Cuprate,True,Ba14.474Cu26.316Y6.579O52.631578947368425,Ba-Cu-Y-O,4,Supercon,Y1Ba2.2Cu4O8,MP-mp-22215,Ba2Y1Cu3O6,Ba-Cu-Y-O,Ba16.667Cu25Y8.333O50,P 4/m m m,tetragonal,3.890574,3.890574,12.12302,data/final/MP/cifs/Ba2.2Cu4Y1O8-MP-mp-22215-synth_doped.cif,data/source/MP/raw/cifs/mp-22215.cif,mp-22215,0.0,,2014-02-22 10:32:14,5.883747679108356,10.17188/1197430,"@misc{osti_1197430,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Y(CuO2)3 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197430"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697120'}},0.0102308603749952,3.24358281,520.0,-74.96347692,-6.24695641,"{'tags': ['Dibarium yttrium dicopper copper(I) hexaoxide', 'Yttrium dibarium copper(I) dicopper oxide', 'Yttrium dibarium copper oxide (1/2/3/6)', 'Dibarium yttrium tricopper hexaoxide', 'Yttrium barium copper oxide (1/2/3/6)']}",-74.96347692,-6.24695641,-2.232973175555556,"['xas', 'bandstructure']",True,"[68290, 72254, 63424, 66903, 68046, 68008, 67016, 84739, 203116, 63269]",True,2021-05-12 10:56:59.077000,NM,12,11,mp-22215,oxide,Ba2Y(CuO2)3,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Cu': 3.0, 'O': 6.0}",GGA,mp-22215,"['mp-917350', 'mp-923178', 'mp-922392', 'mp-610585', 'mp-22215', 'mp-1182689', 'mp-1236883', 'mp-1432999', 'mp-1697120', 'mp-1830265', 'mp-1587968']",0.1132814,"{'Ba': 2.0, 'Y': 1.0, 'Cu': 3.0, 'O': 6.0}",183.5008929491185,[],NM,False,123,0,"[0.0, 0.0, 0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0006173343256232,0.1132814,0,0.1132814,MP,data/source/MP/cleaned/cifs/MP-mp-22215.cif,True,,data/final/MP/graphs/Ba2.2Cu4Y1O8-MP-mp-22215-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ni0.5Si1.5Sr1,1,0.0,2.0,False,Ni1Si3Sr2,Ni1Si3Sr2,0.0,Other,True,Ni16.667Si50Sr33.333,Ni-Si-Sr,3,Supercon,Sr1Si1.5Ni0.5,MP-mp-1218730,Sr2Si3Ni1,Ni-Si-Sr,Ni16.667Si50Sr33.333,P -6 m 2,hexagonal,4.082625998908194,4.08262528,9.330108,data/final/MP/cifs/Ni0.5Si1.5Sr1-MP-mp-1218730.cif,data/source/MP/raw/cifs/mp-1218730.cif,mp-1218730,0.0,,2019-01-12 19:51:03.009000,3.923187754197879,,,{'GGA': {'task_id': 'mp-1759782'}},0.0569383545833312,4.89604882,520.0,-27.74168035,-4.623613391666667,{'tags': []},-27.74168035,-4.623613391666667,-0.384435783888889,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,6,5,mp-1218730,,Sr2Si3Ni,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Si', 'Ni_pv'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Si': 3.0, 'Ni': 1.0}",GGA,mp-1218730,"['mp-1218730', 'mp-1410985', 'mp-1759782', 'mp-1779148', 'mp-1625557']",0.0090881,"{'Sr': 2.0, 'Si': 3.0, 'Ni': 1.0}",134.67791822662215,[],NM,False,187,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",6.748025303381569e-05,0.0090881,0,0.0090881,MP,data/source/MP/cleaned/cifs/MP-mp-1218730.cif,False,,data/final/MP/graphs/Ni0.5Si1.5Sr1-MP-mp-1218730.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
As2Fe1.7Ru0.3Sr1,3,0.12,1.0,True,As2Fe1.7Ru0.3Sr1,As2Fe2Sr1,0.0,Ferrite,True,As40Fe34Ru6Sr20,As-Fe-Ru-Sr,4,Supercon,Sr1Fe1.7Ru0.3As2,MP-mp-4488,Sr1Fe2As2,As-Fe-Sr,As40Fe40Sr20,I 4/m m m,tetragonal,3.9729799997357778,3.9729799997357778,6.45523327,data/final/MP/cifs/As2Fe1.7Ru0.3Sr1-MP-mp-4488-synth_doped.cif,data/source/MP/raw/cifs/mp-4488.cif,mp-4488,0.0,,2011-05-13 03:37:13,6.319998834487784,10.17188/1208187,"@misc{osti_1208187,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr(FeAs)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208187"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672865'}},0.0,5.13397273,520.0,-30.61898897,-6.123797794,"{'tags': ['Strontium diiron arsenide - HT', 'Strontium diiron arsenide', 'Strontium diiron diarsenide', 'Iron strontium arsenide (2/1/2)', 'Strontium diiron arsenide - LT']}",-30.61898897,-6.123797794,-0.5342483613333335,"['xas', 'elasticity', 'bandstructure']",True,"[182330, 181993, 610527, 163209, 163208, 163869]",True,2021-05-12 10:56:20.740000,NM,5,8,mp-4488,,Sr(FeAs)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Fe': 2.0, 'As': 2.0}",GGA,mp-4488,"['mp-906356', 'mp-920135', 'mp-919110', 'mp-4488', 'mp-1439153', 'mp-1672865', 'mp-1873948', 'mp-1592272']",0.0029206,"{'Sr': 1.0, 'Fe': 2.0, 'As': 2.0}",91.7377588211838,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",3.183640016422098e-05,0.0029206,0,0.0029206,MP,data/source/MP/cleaned/cifs/MP-mp-4488.cif,True,,data/final/MP/graphs/As2Fe1.7Ru0.3Sr1-MP-mp-4488-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ca1Ir2,1,0.0,2.0,False,Ca2Ir4,Ca2Ir4,5.075,Other,True,Ca33.333Ir66.667,Ca-Ir,2,Supercon,Ca1Ir2,MP-mp-570436,Ca2Ir4,Ca-Ir,Ca33.333Ir66.667,F d -3 m,cubic,5.36902361,5.369023609999999,5.369023609999999,data/final/MP/cifs/Ca1Ir2-MP-mp-570436.cif,data/source/MP/raw/cifs/mp-570436.cif,mp-570436,0.0,,2015-02-18 17:42:40,12.88243980992693,10.17188/1275701,"@misc{osti_1275701,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CaIr2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1275701"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696041'}},0.0,6.25213972,520.0,-42.20350294,-7.033917156666667,{'tags': ['Calcium iridium (1/2)']},-42.20350294,-7.033917156666667,-0.4730969166666661,"['xas', 'elasticity', 'bandstructure']",True,[108146],True,2021-05-12 10:56:27.046000,NM,6,8,mp-570436,,CaIr2,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Ir'], 'pot_type': 'paw'}","{'Ca': 1.0, 'Ir': 2.0}",GGA,mp-570436,"['mp-944112', 'mp-934060', 'mp-944750', 'mp-1504247', 'mp-1696041', 'mp-1805301', 'mp-1596188', 'mp-570436']",0.00162045,"{'Ca': 2.0, 'Ir': 4.0}",109.43870425807135,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",2.9613837462453107e-05,0.00162045,0,0.0032409,MP,data/source/MP/cleaned/cifs/MP-mp-570436.cif,False,,data/final/MP/graphs/Ca1Ir2-MP-mp-570436.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ag5Ba1,1,0.0,1.0,True,Ag5Ba1,Ag5Ba1,0.0,Other,True,Ag83.333Ba16.667,Ag-Ba,2,Supercon,Ag5Ba1,MP-mp-1814,Ba1Ag5,Ag-Ba,Ag83.333Ba16.667,P 6/m m m,hexagonal,4.583813,5.989591998829151,5.98959128,data/final/MP/cifs/Ag5Ba1-MP-mp-1814.cif,data/source/MP/raw/cifs/mp-1814.cif,mp-1814,0.0,,2011-05-13 11:35:11,7.889923678275579,10.17188/1192927,"@misc{osti_1192927,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BaAg5 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1192927"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695503'}},0.0,2.7830638,520.0,-17.06366766,-2.84394461,{'tags': ['Silver barium (5/1)']},-17.06366766,-2.84394461,-0.1636528022222219,"['xas', 'elasticity', 'bandstructure']",True,"[604800, 57344]",True,2021-05-12 10:56:14.760000,NM,6,8,mp-1814,,BaAg5,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ag'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Ag': 5.0}",GGA,mp-1814,"['mp-993553', 'mp-991636', 'mp-1814', 'mp-1434368', 'mp-1695503', 'mp-1930674', 'mp-994857', 'mp-1588573']",0.0221171,"{'Ba': 1.0, 'Ag': 5.0}",142.41375391398842,[],NM,False,191,0,"[0, 0, 0, 0, 0, 0]",0.0001553017134381,0.0221171,0,0.0221171,MP,data/source/MP/cleaned/cifs/MP-mp-1814.cif,False,,data/final/MP/graphs/Ag5Ba1-MP-mp-1814.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Cu0.995La2Li0.005O4,2,0.0014285714285714,1.0,True,Cu0.995La2Li0.005O4,Cu1La2O4,0.0,Cuprate,True,Cu14.214La28.571Li0.071O57.142857142857146,Cu-La-Li-O,4,Supercon,La2Cu0.995Li0.005O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu0.995La2Li0.005O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu0.995La2Li0.005O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Re0.4W0.6,3,0.1333333333333333,3.0,False,Re1.2W1.8,Re1W2,5.08,Other,True,Re40W60,Re-W,2,Supercon,Re0.4W0.6,MP-mp-1219490,Re1W2,Re-W,Re33.333W66.667,F m m m,orthorhombic,2.7433461908291847,2.74334619,6.91553091,data/final/MP/cifs/Re0.4W0.6-MP-mp-1219490-synth_doped.cif,data/source/MP/raw/cifs/mp-1219490.cif,mp-1219490,0.0,,2019-01-12 20:29:13.511000,19.29240960912995,,,{'GGA': {'task_id': 'mp-1735711'}},0.0646764416666645,7.58580073,520.0,-38.1667508,-12.722250266666668,{'tags': []},-38.1667508,-12.722250266666668,0.0646764416666651,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,3,5,mp-1219490,,ReW2,"{'functional': 'PBE', 'labels': ['Re_pv', 'W_pv'], 'pot_type': 'paw'}","{'Re': 1.0, 'W': 2.0}",GGA,mp-1219490,"['mp-1219490', 'mp-1430360', 'mp-1735711', 'mp-1793084', 'mp-1612596']",0.0014807,"{'Re': 1.0, 'W': 2.0}",47.67424187109373,[],NM,False,69,0,"[0, 0, 0]",3.105870050338003e-05,0.0014807,0,0.0014807,MP,data/source/MP/cleaned/cifs/MP-mp-1219490.cif,True,,data/final/MP/graphs/Re0.4W0.6-MP-mp-1219490-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,0,0,1,1.0,False
Ce0.15La0.85Ru2,3,0.1,2.0,False,Ce0.3La1.7Ru4,La2Ru4,2.444,Other,True,Ce5La28.333Ru66.667,Ce-La-Ru,3,Supercon,La0.85Ce0.15Ru2,MP-mp-2019,La2Ru4,La-Ru,La33.333Ru66.667,F d -3 m,cubic,5.46409128,5.464091279999999,5.464091279999999,data/final/MP/cifs/Ce0.15La0.85Ru2-MP-mp-2019-synth_doped.cif,data/source/MP/raw/cifs/mp-2019.cif,mp-2019,0.0,,2011-05-13 21:42:56,9.818667150990734,10.17188/1195329,"@misc{osti_1195329,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaRu2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195329"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686817'}},0.0017745359523804,8.6251779,520.0,-47.76122776,-7.960204626666666,"{'tags': ['Lanthanum ruthenium hydride (1/2/4)', 'Lanthanum ruthenium (1/2)']}",-47.76122776,-7.960204626666666,-0.1319424883333321,"['xas', 'elasticity', 'bandstructure']",True,"[104712, 641760, 641778, 638256, 641771, 641766, 641774, 638255, 641762, 104713, 641761, 641775, 641777]",True,2021-05-12 10:56:14.760000,NM,6,14,mp-2019,,LaRu2,"{'functional': 'PBE', 'labels': ['La', 'Ru_pv'], 'pot_type': 'paw'}","{'La': 1.0, 'Ru': 2.0}",GGA,mp-2019,"['mp-935098', 'mp-941760', 'mp-941909', 'mp-2019', 'mp-1072861', 'mp-1072969', 'mp-1072939', 'mp-1077306', 'mp-1442150', 'mp-1686817', 'mp-1803378', 'mp-1590466', 'mp-1596026', 'mp-1072974']",0.000191,"{'La': 2.0, 'Ru': 4.0}",115.35564200581236,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",3.311498192526659e-06,0.000191,0,0.000382,MP,data/source/MP/cleaned/cifs/MP-mp-2019.cif,True,,data/final/MP/graphs/Ce0.15La0.85Ru2-MP-mp-2019-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Nb3Pd0.05Rh0.95,2,0.025,2.0,False,Nb6Pd0.1Rh1.9,Nb6Rh2,2.49,Other,True,Nb75Pd1.25Rh23.75,Nb-Pd-Rh,3,Supercon,Nb3Rh0.95Pd0.05,MP-mp-1545,Nb6Rh2,Nb-Rh,Nb75Rh25,P m -3 n,cubic,5.186072,5.186072,5.186072,data/final/MP/cifs/Nb3Pd0.05Rh0.95-MP-mp-1545-synth_doped.cif,data/source/MP/raw/cifs/mp-1545.cif,mp-1545,0.0,,2011-05-14 11:20:25,9.086567873234834,10.17188/1191190,"@misc{osti_1191190,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Rh (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191190"",
    place = ""United States"",
    year = ""2015"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700041'}},0.0,5.48706495,520.0,-77.37430008,-9.67178751,{'tags': ['Niobium rhodium (3/1)']},-77.37430008,-9.67178751,-0.2547317625000005,"['xas', 'elasticity', 'bandstructure']",True,"[105216, 645269]",True,2021-05-12 10:56:12.755000,NM,8,8,mp-1545,,Nb3Rh,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Rh_pv'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Rh': 1.0}",GGA,mp-1545,"['mp-942004', 'mp-943019', 'mp-935201', 'mp-1545', 'mp-1433570', 'mp-1700041', 'mp-1786474', 'mp-1591392']",0.00021655,"{'Nb': 6.0, 'Rh': 2.0}",139.48118416938905,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",3.1050783127424102e-06,0.00021655,0,0.0004331,MP,data/source/MP/cleaned/cifs/MP-mp-1545.cif,True,,data/final/MP/graphs/Nb3Pd0.05Rh0.95-MP-mp-1545-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba1.8Cu4Ho1Sr0.2O8,3,0.0266666666666666,1.0,True,Ba1.8Cu4Ho1Sr0.2O8,Ba2Cu4Ho1O8,68.8,Cuprate,True,Ba12Cu26.667Ho6.667Sr1.333O53.333333333333336,Ba-Cu-Ho-Sr-O,5,Supercon,Ho1Sr0.2Ba1.8Cu4O8,MP-mp-6205,Ba2Ho1Cu4O8,Ba-Cu-Ho-O,Ba13.333Cu26.667Ho6.667O53.333333333333336,C m m m,orthorhombic,3.87946,3.894348001774656,13.87398175,data/final/MP/cifs/Ba1.8Cu4Ho1Sr0.2O8-MP-mp-6205-synth_doped.cif,data/source/MP/raw/cifs/mp-6205.cif,mp-6205,0.0,,2011-05-16 02:52:11,6.575196061130729,10.17188/1278028,"@misc{osti_1278028,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Ho(CuO2)4 (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278028"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678300'}},0.0,3.29099269,520.0,-89.84060384,-5.989373589333334,"{'tags': ['Holmium dibarium tricopper copper(III) oxide', 'Holmium dibarium tetracopper octaoxide', 'Holmium barium copper oxide (1/2/4/8)']}",-89.84060384,-5.989373589333334,-2.0623825726666665,"['xas', 'bandstructure']",True,"[67638, 75688, 74126, 78624, 67639]",True,2021-05-12 10:57:28.836000,NM,15,7,mp-6205,oxide,Ba2Ho(CuO2)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ho_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Ho': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-6205,"['mp-1001291', 'mp-1007620', 'mp-6205', 'mp-1381302', 'mp-1678300', 'mp-1832236', 'mp-1599331']",0.0019325,"{'Ba': 2.0, 'Ho': 1.0, 'Cu': 4.0, 'O': 8.0}",207.53304019835824,[],NM,False,65,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",9.31177030005889e-06,0.0019325,0,0.0019325,MP,data/source/MP/cleaned/cifs/MP-mp-6205.cif,True,,data/final/MP/graphs/Ba1.8Cu4Ho1Sr0.2O8-MP-mp-6205-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
As1Co0.03Fe0.97Na1,2,0.02,2.0,False,As2Co0.06Fe1.94Na2,As2Fe2Na2,21.13333333,Ferrite,True,As33.333Co1Fe32.333Na33.333,As-Co-Fe-Na,4,Supercon,Na1Fe0.97Co0.03As1,MP-mp-22152,Na2Fe2As2,As-Fe-Na,As33.333Fe33.333Na33.333,P 4/n m m,tetragonal,3.923688,3.923688,6.918844,data/final/MP/cifs/As1Co0.03Fe0.97Na1-MP-mp-22152-synth_doped.cif,data/source/MP/raw/cifs/mp-22152.cif,mp-22152,0.0,,2014-02-21 10:51:39,4.793908463406792,10.17188/1197381,"@misc{osti_1197381,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NaFeAs (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197381"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704688'}},0.0,4.10723066,520.0,-30.57538864,-5.095898106666667,{'tags': ['Sodium iron arsenide']},-30.57538864,-5.095898106666667,-0.2786807238505749,"['xas', 'elasticity', 'bandstructure']",True,"[163144, 163143]",True,2021-05-12 10:56:16.728000,FM,6,8,mp-22152,,NaFeAs,"{'functional': 'PBE', 'labels': ['Na_pv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Na': 1.0, 'Fe': 1.0, 'As': 1.0}",GGA,mp-22152,"['mp-906352', 'mp-920130', 'mp-919102', 'mp-22152', 'mp-1413190', 'mp-1704688', 'mp-1797758', 'mp-1594769']",0.0693226,"{'Na': 2.0, 'Fe': 2.0, 'As': 2.0}",106.5178694490858,[],FM,True,129,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.0]",0.0013016144682303,0.0693226,2,0.1386452,MP,data/source/MP/cleaned/cifs/MP-mp-22152.cif,True,,data/final/MP/graphs/As1Co0.03Fe0.97Na1-MP-mp-22152-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Fe1Zr2,1,0.0,2.0,False,Fe2Zr4,Fe2Zr4,0.17,Other,True,Fe33.333Zr66.667,Fe-Zr,2,Supercon,Fe1Zr2,MP-mp-1159,Zr4Fe2,Fe-Zr,Fe33.333Zr66.667,I 4/m c m,tetragonal,5.284995779990666,5.28499578,5.28499578,data/final/MP/cifs/Fe1Zr2-MP-mp-1159.cif,data/source/MP/raw/cifs/mp-1159.cif,mp-1159,0.0,,2011-05-13 20:27:53,7.00133973662212,10.17188/1188091,"@misc{osti_1188091,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Zr2Fe (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188091"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-928933'}},0.0060293753333322,4.42743038,520.0,-51.95663803,-8.659439671666666,"{'tags': ['Iron zirconium (1/2)', 'Iron zirconium hydride (2/4/9)']}",-51.95663803,-8.659439671666666,-0.137636435000001,"['xas', 'elasticity', 'bandstructure']",True,"[634192, 634145, 656524, 634183, 634154, 103712]",True,2021-05-12 10:56:12.755000,NM,6,14,mp-1159,,Zr2Fe,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Fe_pv'], 'pot_type': 'paw'}","{'Zr': 2.0, 'Fe': 1.0}",GGA,mp-1159,"['mp-929296', 'mp-912432', 'mp-928933', 'mp-1159', 'mp-1072488', 'mp-1072511', 'mp-1072571', 'mp-1077264', 'mp-1077149', 'mp-1077406', 'mp-1439576', 'mp-1803785', 'mp-1590449', 'mp-1072552']",0.00302495,"{'Zr': 4.0, 'Fe': 2.0}",113.03403368002292,[],NM,False,140,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",5.352281788975234e-05,0.00302495,0,0.0060499,MP,data/source/MP/cleaned/cifs/MP-mp-1159.cif,False,,data/final/MP/graphs/Fe1Zr2-MP-mp-1159.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B6Ca1,1,0.0,1.0,True,B6Ca1,B6Ca1,0.0,Other,True,B85.714Ca14.286,B-Ca,2,Supercon,B6Ca1,MP-mp-865,Ca1B6,B-Ca,B85.714Ca14.286,P m -3 m,cubic,4.150094,4.150094,4.150094,data/final/MP/cifs/B6Ca1-MP-mp-865.cif,data/source/MP/raw/cifs/mp-865.cif,mp-865,0.1835000000000004,,2011-05-12 19:57:13,2.4379955586864224,10.17188/1310320,"@misc{osti_1310320,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CaB6 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1310320"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1673047'}},0.0,4.64649863,520.0,-44.93660105,-6.4195144357142855,"{'tags': ['Calcium hexaboride', 'Calcium boride (1/6)', 'Calcium octahedro-hexaboride (1/1)']}",-44.93660105,-6.4195144357142855,-0.4078072207142855,"['xas', 'elasticity', 'bandstructure']",True,"[196516, 194632, 612684, 612687, 26753, 44985, 655040, 612689, 612682, 26893]",True,2021-05-12 10:56:33.121000,NM,7,10,mp-865,,CaB6,"{'functional': 'PBE', 'labels': ['Ca_sv', 'B'], 'pot_type': 'paw'}","{'Ca': 1.0, 'B': 6.0}",GGA,mp-865,"['mp-663265', 'mp-678393', 'mp-865', 'mp-1077845', 'mp-1080402', 'mp-1442070', 'mp-1673047', 'mp-1800181', 'mp-1593646', 'mp-698016']",1.7e-05,"{'Ca': 1.0, 'B': 6.0}",71.47823185500904,[],NM,False,221,0,"[0, 0, 0, 0, 0, 0, 0]",2.378346464205197e-07,1.7e-05,0,1.7e-05,MP,data/source/MP/cleaned/cifs/MP-mp-865.cif,False,,data/final/MP/graphs/B6Ca1-MP-mp-865.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
B0.06C0.94Cu1Sr2O5,2,0.0133333333333333,4.0,False,B0.24C3.76Cu4Sr8O20,C4Cu4Sr8O20,21.0,Cuprate,True,B0.667C10.444Cu11.111Sr22.222O55.55555555555556,B-C-Cu-Sr-O,5,Supercon,Sr2Cu1C0.94B0.06O5,MP-mp-1198030,Sr8Cu4C4O20,C-Cu-Sr-O,C11.111Cu11.111Sr22.222O55.55555555555556,I -4,tetragonal,7.877744002100394,7.877744002100395,9.46755054,data/final/MP/cifs/B0.06C0.94Cu1Sr2O5-MP-mp-1198030-synth_doped.cif,data/source/MP/raw/cifs/mp-1198030.cif,mp-1198030,0.0,,2019-01-12 02:53:33.853000,4.624821022244182,,,{'GGA': {'task_id': 'mp-1742814'}},0.0386187874999981,3.47889523,520.0,-237.90163358,-6.608378710555556,"{'tags': ['Distrontium copper dioxide carbonate - LT', 'Distrontium copper dioxide carbonate']}",-237.90163358,-6.608378710555556,-2.385069899259259,['bandstructure'],True,"[78650, 83095]",True,2021-05-12 10:58:37.524000,NM,36,6,mp-1198030,oxide,Sr2CuCO5,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Cu_pv', 'C', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Cu': 1.0, 'C': 1.0, 'O': 5.0}",GGA,mp-1198030,"['mp-1198030', 'mp-1200477', 'mp-1399692', 'mp-1742814', 'mp-1929945', 'mp-1655225']",0.000743875,"{'Sr': 8.0, 'Cu': 4.0, 'C': 4.0, 'O': 20.0}",475.08507610840775,[],NM,False,82,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.263088759540475e-06,0.000743875,0,0.0029755,MP,data/source/MP/cleaned/cifs/MP-mp-1198030.cif,True,,data/final/MP/graphs/B0.06C0.94Cu1Sr2O5-MP-mp-1198030-synth_doped.json,0,True,-4,0,0,0,0,2,0,0,0,0,1,0,1.0,False
Pb0.5Sn0.5Te1,1,0.0,2.0,False,Pb1Sn1Te2,Pb1Sn1Te2,1.485,Other,True,Pb25Sn25Te50,Pb-Sn-Te,3,Supercon,Pb0.5Sn0.5Te1,MP-mp-1218924,Sn1Te2Pb1,Pb-Sn-Te,Pb25Sn25Te50,R -3 m,trigonal,4.589095216730232,4.589095216730231,7.94525293,data/final/MP/cifs/Pb0.5Sn0.5Te1-MP-mp-1218924.cif,data/source/MP/raw/cifs/mp-1218924.cif,mp-1218924,0.4260000000000001,,2019-01-12 20:00:48.659000,7.06339771799006,,,{'GGA': {'task_id': 'mp-1734519'}},0.0034030574999999,5.68425108,520.0,-15.37902348,-3.84475587,{'tags': []},-15.37902348,-3.84475587,-0.5535506737500002,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,4,5,mp-1218924,,SnTe2Pb,"{'functional': 'PBE', 'labels': ['Sn_d', 'Te', 'Pb_d'], 'pot_type': 'paw'}","{'Sn': 1.0, 'Te': 2.0, 'Pb': 1.0}",GGA,mp-1218924,"['mp-1218924', 'mp-1398841', 'mp-1734519', 'mp-1872180', 'mp-1624050']",0.0005556,"{'Sn': 1.0, 'Te': 2.0, 'Pb': 1.0}",136.61355278554396,[],NM,False,166,0,"[0, 0, 0, 0]",4.066946424211522e-06,0.0005556,0,0.0005556,MP,data/source/MP/cleaned/cifs/MP-mp-1218924.cif,False,,data/final/MP/graphs/Pb0.5Sn0.5Te1-MP-mp-1218924.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Rh23Zr77,2,0.04,0.1558351214003387,False,Rh3.584Zr12,Rh4Zr12,3.66,Other,True,Rh23Zr77,Rh-Zr,2,Supercon,Rh23Zr77,MP-mp-1188413,Zr12Rh4,Rh-Zr,Rh25Zr75,I -4 2 m,tetragonal,5.750105997369286,8.133162878649543,8.13316288,data/final/MP/cifs/Rh23Zr77-MP-mp-1188413-synth_doped.cif,data/source/MP/raw/cifs/mp-1188413.cif,mp-1188413,0.0,,2019-01-11 19:25:26.786000,7.515208089275875,,,{'GGA': {'task_id': 'mp-1708881'}},0.0,4.73652502,520.0,-138.70039462,-8.66877466375,{'tags': []},-138.70039462,-8.66877466375,-0.4169222237500012,['bandstructure'],True,[],True,2021-05-12 10:58:31.620000,NM,16,5,mp-1188413,,Zr3Rh,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Rh_pv'], 'pot_type': 'paw'}","{'Zr': 3.0, 'Rh': 1.0}",GGA,mp-1188413,"['mp-1188413', 'mp-1426452', 'mp-1708881', 'mp-1811428', 'mp-1604423']",0.05184475,"{'Zr': 12.0, 'Rh': 4.0}",332.82998576972955,[],NM,False,121,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0006230778741897,0.05184475,0,0.207379,MP,data/source/MP/cleaned/cifs/MP-mp-1188413.cif,True,,data/final/MP/graphs/Rh23Zr77-MP-mp-1188413-synth_doped.json,0,True,-42m,0,0,0,0,6,0,0,0,0,1,0,1.0,False
K1Ni2Se2,3,0.1333333333333333,3.0,False,K3Ni6Se6,K4Ni6Se8,0.8,Ferrite,True,K20Ni40Se40,K-Ni-Se,3,Supercon,K1Ni2Se2,MP-mp-1188089,K4Ni6Se8,K-Ni-Se,K22.222Ni33.333Se44.444,F d d d,orthorhombic,6.076997999999088,6.0998002206001525,13.675954775354874,data/final/MP/cifs/K1Ni2Se2-MP-mp-1188089-synth_doped.cif,data/source/MP/raw/cifs/mp-1188089.cif,mp-1188089,0.4155999999999999,,2019-01-11 19:10:43.946000,4.41777039935207,,,{'GGA': {'task_id': 'mp-1673252'}},0.0,2.98413279,700.0,-78.4339524,-4.3574418,{'tags': ['Potassium nickel selenide (2/3/4)']},-78.4339524,-4.3574418,-0.840013595041666,"['diel', 'bandstructure']",True,[641277],True,2021-05-12 10:56:43.348000,NM,18,7,mp-1188089,,K2Ni3Se4,"{'functional': 'PBE', 'labels': ['K_sv', 'Ni_pv', 'Se'], 'pot_type': 'paw'}","{'K': 2.0, 'Ni': 3.0, 'Se': 4.0}",GGA,mp-1188089,"['mp-1188089', 'mp-1416632', 'mp-1543110', 'mp-1540211', 'mp-1673252', 'mp-1815536', 'mp-1585082']",0.0001077,"{'K': 4.0, 'Ni': 6.0, 'Se': 8.0}",428.58778675497774,[],NM,False,70,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.02580816945079e-07,0.0001077,0,0.0002154,MP,data/source/MP/cleaned/cifs/MP-mp-1188089.cif,True,,data/final/MP/graphs/K1Ni2Se2-MP-mp-1188089-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,0,0,1,1.0,False
B2Dy1Os1,1,0.0,4.0,False,B8Dy4Os4,B8Dy4Os4,0.0,Other,True,B50Dy25Os25,B-Dy-Os,3,Supercon,Dy1Os1B2,MP-mp-1189918,Dy4B8Os4,B-Dy-Os,B50Dy25Os25,P n m a,orthorhombic,5.310458,5.909365,6.381498,data/final/MP/cifs/B2Dy1Os1-MP-mp-1189918.cif,data/source/MP/raw/cifs/mp-1189918.cif,mp-1189918,0.0,,2019-01-11 20:33:25.431000,12.416346249114792,,,,0.0,6.35798382,520.0,-125.9519013,-7.87199383125,"{'tags': ['Dysprosium osmium boride (1/1/2)', 'DyOsB2', 'LuRuB2']}",-125.9519013,-7.87199383125,-0.5737596720833338,[],False,[613666],True,2021-05-12 10:59:54.607000,NM,16,3,mp-1189918,,DyB2Os,"{'functional': 'PBE', 'labels': ['Dy_3', 'B', 'Os_pv'], 'pot_type': 'paw'}","{'Dy': 1.0, 'B': 2.0, 'Os': 1.0}",GGA,mp-1189918,"['mp-1189918', 'mp-1829492', 'mp-1984349']",0.000279225,"{'Dy': 4.0, 'B': 8.0, 'Os': 4.0}",200.26056238699405,[],NM,False,62,0,"[-0.0, -0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",5.577233913093901e-06,0.000279225,0,0.0011169,MP,data/source/MP/cleaned/cifs/MP-mp-1189918.cif,False,,data/final/MP/graphs/B2Dy1Os1-MP-mp-1189918.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
B5Mo1.8Sc0.2,3,0.0571428571428571,1.0,True,B5Mo1.8Sc0.2,B5Mo2,8.8,Other,True,B71.429Mo25.714Sc2.857,B-Mo-Sc,3,Supercon,B5Mo1.8Sc0.2,MP-mp-7229,B5Mo2,B-Mo,B71.429Mo28.571,R -3 m,trigonal,3.086062143206312,3.086062143206312,7.38317517,data/final/MP/cifs/B5Mo1.8Sc0.2-MP-mp-7229-synth_doped.cif,data/source/MP/raw/cifs/mp-7229.cif,mp-7229,0.0,,2011-05-27 17:15:57,6.910597742884047,10.17188/1287525,"@misc{osti_1287525,
    author = ""Persson, Kristin"",
    title = ""Materials Data on B5Mo2 (SG:166) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1287525"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678538'}},0.4354736101190504,10.26159619,520.0,-54.63026953,-7.804324218571429,"{'tags': ['Molybdenum boride (2/5)', 'Molybdenum boride (1/2.5) - epsilon']}",-54.63026953,-7.804324218571429,0.0654250548809522,['bandstructure'],True,"[157530, 614795, 614810, 24282]",True,2021-05-12 10:58:55.498000,NM,7,11,mp-7229,,B5Mo2,"{'functional': 'PBE', 'labels': ['B', 'Mo_pv'], 'pot_type': 'paw'}","{'B': 5.0, 'Mo': 2.0}",GGA,mp-7229,"['mp-1001204', 'mp-7229', 'mp-1007569', 'mp-1077992', 'mp-1078025', 'mp-1078031', 'mp-1441558', 'mp-1678538', 'mp-1793658', 'mp-1012321', 'mp-1593525']",0.0189101,"{'B': 5.0, 'Mo': 2.0}",59.09541989544843,[],NM,False,166,0,"[0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0]",0.0003199926497426,0.0189101,0,0.0189101,MP,data/source/MP/cleaned/cifs/MP-mp-7229.cif,True,,data/final/MP/graphs/B5Mo1.8Sc0.2-MP-mp-7229-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
As12Pr1Ru4,1,0.0,1.0,True,As12Pr1Ru4,As12Pr1Ru4,2.3825,Heavy_fermion,True,As70.588Pr5.882Ru23.529,As-Pr-Ru,3,Supercon,Pr1Ru4As12,MP-mp-1179919,Pr1As12Ru4,As-Pr-Ru,As70.588Pr5.882Ru23.529,I m -3,cubic,7.453780191652386,7.45378019,7.45378019,data/final/MP/cifs/As12Pr1Ru4-MP-mp-1179919.cif,data/source/MP/raw/cifs/mp-1179919.cif,mp-1179919,0.0,,2019-01-11 09:16:06.089000,7.522854684296768,,,{'GGA': {'task_id': 'mp-1671643'}},0.0,5.77804874,520.0,-105.63548645,-6.213852144117647,"{'tags': ['Praseodymium ruthenium arsenide (1/4/12)', 'LaFe4P12', 'PrRu4As12']}",-105.63548645,-6.213852144117647,-0.461623989705883,['bandstructure'],True,[611222],True,2021-05-12 10:58:25.879000,NM,17,5,mp-1179919,,Pr(As3Ru)4,"{'functional': 'PBE', 'labels': ['Pr_3', 'As', 'Ru_pv'], 'pot_type': 'paw'}","{'Pr': 1.0, 'As': 12.0, 'Ru': 4.0}",GGA,mp-1179919,"['mp-1179919', 'mp-1435566', 'mp-1671643', 'mp-1806650', 'mp-1603916']",0.0005825,"{'Pr': 1.0, 'As': 12.0, 'Ru': 4.0}",318.79232244709704,[],NM,False,204,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.8272083704169657e-06,0.0005825,0,0.0005825,MP,data/source/MP/cleaned/cifs/MP-mp-1179919.cif,False,,data/final/MP/graphs/As12Pr1Ru4-MP-mp-1179919.json,0,True,m-3,2,0,0,0,0,0,0,0,0,1,0,1.0,False
C0.4Mo0.6,3,0.1333333333333333,12.0,False,C4.8Mo7.2,C4Mo8,8.75,Other,True,C40Mo60,C-Mo,2,Supercon,C0.4Mo0.6,MP-mp-1552,Mo8C4,C-Mo,C33.333Mo66.667,P b c n,orthorhombic,4.754105,5.241481,6.076485,data/final/MP/cifs/C0.4Mo0.6-MP-mp-1552-synth_doped.cif,data/source/MP/raw/cifs/mp-1552.cif,mp-1552,0.0,,2011-05-14 21:55:32,8.943989697207083,10.17188/1191211,"@misc{osti_1191211,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Mo2C (SG:60) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191211"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702638'}},0.0,8.69218846,520.0,-125.0304508,-10.419204233333334,"{'tags': ['Molybdenum carbide (2/1) - zeta', 'Molybdenum carbide (2/1) - alpha', 'Molybdenum carbide (2/1)']}",-125.0304508,-10.419204233333334,-0.113181979999999,"['xas', 'elasticity', 'bandstructure']",True,"[43322, 600624, 246147, 65701, 246148, 246146]",True,2021-05-12 10:56:12.755000,NM,12,8,mp-1552,,Mo2C,"{'functional': 'PBE', 'labels': ['Mo_pv', 'C'], 'pot_type': 'paw'}","{'Mo': 2.0, 'C': 1.0}",GGA,mp-1552,"['mp-906641', 'mp-920312', 'mp-921336', 'mp-1552', 'mp-1504087', 'mp-1702638', 'mp-1779813', 'mp-1589885']",0.000982725,"{'Mo': 8.0, 'C': 4.0}",151.41720155252168,[],NM,False,60,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.596072282207976e-05,0.000982725,0,0.0039309,MP,data/source/MP/cleaned/cifs/MP-mp-1552.cif,True,,data/final/MP/graphs/C0.4Mo0.6-MP-mp-1552-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
La1Sb2,1,0.0,4.0,False,La4Sb8,La4Sb8,0.8,Other,True,La33.333Sb66.667,La-Sb,2,Supercon,La1Sb2,MP-mp-1101942,La4Sb8,La-Sb,La33.333Sb66.667,C m c a,orthorhombic,4.48334442,4.48334442,18.671478,data/final/MP/cifs/La1Sb2-MP-mp-1101942.cif,data/source/MP/raw/cifs/mp-1101942.cif,mp-1101942,0.0,,2018-07-18 13:04:17,6.768344286479337,,,{'GGA': {'task_id': 'mp-1669319'}},0.0,7.30091435,520.0,-63.28919386,-5.274099488333333,"{'tags': ['Lanthanum antimonide (1/2)', 'LaSb2', 'SmSb2']}",-63.28919386,-5.274099488333333,-1.0040962933333333,['bandstructure'],True,"[641899, 641892]",True,2021-05-12 10:58:18.470000,NM,12,6,mp-1101942,,LaSb2,"{'functional': 'PBE', 'labels': ['La', 'Sb'], 'pot_type': 'paw'}","{'La': 1.0, 'Sb': 2.0}",GGA,mp-1101942,"['mp-1101942', 'mp-1101999', 'mp-1433071', 'mp-1669319', 'mp-1839752', 'mp-1603605']",0.00344535,"{'La': 4.0, 'Sb': 8.0}",375.2955855194468,[],NM,False,64,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.6721455118970176e-05,0.00344535,0,0.0137814,MP,data/source/MP/cleaned/cifs/MP-mp-1101942.cif,False,,data/final/MP/graphs/La1Sb2-MP-mp-1101942.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ce1Ru3Si2,1,0.0,1.0,True,Ce1Ru3Si2,Ce1Ru3Si2,1.25,Heavy_fermion,True,Ce16.667Ru50Si33.333,Ce-Ru-Si,3,Supercon,Ce1Ru3Si2,MP-mp-30043,Ce1Si2Ru3,Ce-Ru-Si,Ce16.667Ru50Si33.333,P 6/m m m,hexagonal,3.600809,5.629794002386897,5.62979433,data/final/MP/cifs/Ce1Ru3Si2-MP-mp-30043.cif,data/source/MP/raw/cifs/mp-30043.cif,mp-30043,0.0,,2014-02-24 01:15:53,8.392014453077607,10.17188/1204473,"@misc{osti_1204473,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeSi2Ru3 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1204473"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699127'}},0.0288908791666635,8.39982791,520.0,-48.72212745,-8.120354575,{'tags': ['Cerium ruthenium silicide (1/3/2)']},-48.72212745,-8.120354575,-0.6858735483333334,"['xas', 'elasticity', 'bandstructure']",True,[52898],True,2021-05-12 10:56:18.721000,NM,6,7,mp-30043,,CeSi2Ru3,"{'functional': 'PBE', 'labels': ['Ce', 'Si', 'Ru_pv'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Si': 2.0, 'Ru': 3.0}",GGA,mp-30043,"['mp-996596', 'mp-30043', 'mp-1143840', 'mp-1427670', 'mp-1699127', 'mp-1798093', 'mp-1596288']",0.0749666,"{'Ce': 1.0, 'Si': 2.0, 'Ru': 3.0}",98.83613604184409,[],NM,False,191,0,"[0.0, 0.0, 0.0, -0.0, -0.0, -0.0]",0.0007584938363865,0.0749666,0,0.0749666,MP,data/source/MP/cleaned/cifs/MP-mp-30043.cif,False,,data/final/MP/graphs/Ce1Ru3Si2-MP-mp-30043.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Bi2Cu2Sr2Y1O8,1,0.0,2.0,False,Bi4Cu4Sr4Y2O16,Bi4Cu4Sr4Y2O16,0.0,Cuprate,True,Bi13.333Cu13.333Sr13.333Y6.667O53.333333333333336,Bi-Cu-Sr-Y-O,5,Supercon,Bi2Sr2Y1Cu2O8,MP-mp-1208863,Sr4Y2Cu4Bi4O16,Bi-Cu-Sr-Y-O,Bi13.333Cu13.333Sr13.333Y6.667O53.333333333333336,C c c m,orthorhombic,5.350205,5.505885998177413,15.59802851,data/final/MP/cifs/Bi2Cu2Sr2Y1O8-MP-mp-1208863.cif,data/source/MP/raw/cifs/mp-1208863.cif,mp-1208863,0.0,,2019-01-12 11:41:58.514000,6.881971262733002,,,{'GGA': {'task_id': 'mp-1680775'}},0.0913935707916726,5.2812548,520.0,-185.05210166,-6.1684033886666665,"{'tags': ['high-Tc cuprate family', 'Sr2(Sr0.4Y0.6)Cu2Bi2O8.7', 'Sr2.4Cu2Y0.6Bi2O8.7']}",-185.05210166,-6.1684033886666665,-2.174294854,[],False,[],True,2021-05-12 11:00:21.818000,FM,30,4,mp-1208863,oxide,Sr2YCu2(BiO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Y_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Y': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",GGA,mp-1208863,"['mp-1208863', 'mp-1359079', 'mp-1680775', 'mp-1819085']",0.1409948,"{'Sr': 4.0, 'Y': 2.0, 'Cu': 4.0, 'Bi': 4.0, 'O': 16.0}",452.2677998757687,[],FM,True,66,1,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.1, 0.1, 0.1, 0.1, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0006235013858547,0.1409948,4,0.2819896,MP,data/source/MP/cleaned/cifs/MP-mp-1208863.cif,False,,data/final/MP/graphs/Bi2Cu2Sr2Y1O8-MP-mp-1208863.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Cu0.825Ge0.175,3,0.1499999999999999,8.0,False,Cu6.6Ge1.4,Cu6Ge2,0.145,Other,True,Cu82.5Ge17.5,Cu-Ge,2,Supercon,Cu0.825Ge0.175,MP-mp-1184021,Cu6Ge2,Cu-Ge,Cu75Ge25,P 63/m m c,hexagonal,4.213635,5.291476003465905,5.29147545,data/final/MP/cifs/Cu0.825Ge0.175-MP-mp-1184021-synth_doped.cif,data/source/MP/raw/cifs/mp-1184021.cif,mp-1184021,0.0,,2019-01-11 12:28:15.987000,8.557610547331103,,,{'GGA': {'task_id': 'mp-1754560'}},0.003112765,7.74811247,520.0,-33.8620493,-4.2327561625,{'tags': []},-33.8620493,-4.2327561625,-0.0025941962500004,['bandstructure'],True,[],True,2021-05-12 10:58:27.755000,NM,8,5,mp-1184021,,Cu3Ge,"{'functional': 'PBE', 'labels': ['Cu_pv', 'Ge_d'], 'pot_type': 'paw'}","{'Cu': 3.0, 'Ge': 1.0}",GGA,mp-1184021,"['mp-1184021', 'mp-1388052', 'mp-1754560', 'mp-1921698', 'mp-1621911']",0.00074355,"{'Cu': 6.0, 'Ge': 2.0}",102.17417629799968,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.4554558244372302e-05,0.00074355,0,0.0014871,MP,data/source/MP/cleaned/cifs/MP-mp-1184021.cif,True,,data/final/MP/graphs/Cu0.825Ge0.175-MP-mp-1184021-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ca3Ge13Rh4,1,0.0,2.0,False,Ca6Ge26Rh8,Ca6Ge26Rh8,2.1,Other,True,Ca15Ge65Rh20,Ca-Ge-Rh,3,Supercon,Ca3Rh4Ge13,MP-mp-1201179,Ca6Ge26Rh8,Ca-Ge-Rh,Ca15Ge65Rh20,P m -3 n,cubic,9.058127,9.058127,9.058127,data/final/MP/cifs/Ca3Ge13Rh4-MP-mp-1201179.cif,data/source/MP/raw/cifs/mp-1201179.cif,mp-1201179,0.0,,2019-01-12 05:26:48.922000,6.596324572753466,,,,0.0219449240000004,4.61600032,520.0,-209.13106097,-5.22827652425,"{'tags': ['Ca3Rh4Ge13', 'Yb3Rh4Sn13', 'Calcium rhodium germanide (3/4/13)']}",-209.13106097,-5.22827652425,-0.4496068624999992,[],False,[619329],True,2021-05-12 11:00:10.451000,NM,40,3,mp-1201179,,Ca3Ge13Rh4,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Ge_d', 'Rh_pv'], 'pot_type': 'paw'}","{'Ca': 3.0, 'Ge': 13.0, 'Rh': 4.0}",GGA,mp-1201179,"['mp-1201179', 'mp-1343486', 'mp-1884257']",7.075e-05,"{'Ca': 6.0, 'Ge': 26.0, 'Rh': 8.0}",743.2162835959757,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.9038872414819384e-07,7.075e-05,0,0.0001415,MP,data/source/MP/cleaned/cifs/MP-mp-1201179.cif,False,,data/final/MP/graphs/Ca3Ge13Rh4-MP-mp-1201179.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Hf0.8Mo0.2,1,0.0,10.0,False,Hf8Mo2,Hf8Mo2,2.89,Other,True,Hf80Mo20,Hf-Mo,2,Supercon,Hf0.8Mo0.2,MP-mp-1212251,Hf8Mo2,Hf-Mo,Hf80Mo20,F d -3 m,cubic,6.9826229,6.982622899999999,6.9826229,data/final/MP/cifs/Hf0.8Mo0.2-MP-mp-1212251.cif,data/source/MP/raw/cifs/mp-1212251.cif,mp-1212251,0.0,,2019-01-12 14:28:20.330000,11.172998117034384,,,,1.0408028685,4.35760682,520.0,-91.45346281,-9.145346281,"{'tags': ['MgCu2', 'HfMo2 rt', 'Friauf-Laves phase, Frank-Kasper phase']}",-91.45346281,-9.145346281,0.9895334049999988,[],False,[],True,2021-05-12 11:00:28.874000,NM,10,2,mp-1212251,,Hf4Mo,"{'functional': 'PBE', 'labels': ['Hf_pv', 'Mo_pv'], 'pot_type': 'paw'}","{'Hf': 4.0, 'Mo': 1.0}",GGA,mp-1212251,"['mp-1212251', 'mp-1867039']",0.002263,"{'Hf': 8.0, 'Mo': 2.0}",240.73584832864984,[],NM,False,227,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0]",1.8800689766075704e-05,0.002263,0,0.004526,MP,data/source/MP/cleaned/cifs/MP-mp-1212251.cif,False,,data/final/MP/graphs/Hf0.8Mo0.2-MP-mp-1212251.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
In3Th1,1,0.0,1.0,True,In3Th1,In3Th1,0.0,Other,True,In75Th25,In-Th,2,Supercon,In3Th1,MP-mp-20206,Th1In3,In-Th,In75Th25,P m -3 m,cubic,4.749948,4.749948,4.749948,data/final/MP/cifs/In3Th1-MP-mp-20206.cif,data/source/MP/raw/cifs/mp-20206.cif,mp-20206,0.0,,2014-02-21 10:47:56,8.932558353045389,10.17188/1195345,"@misc{osti_1195345,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ThIn3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195345"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687434'}},0.0,7.94644858,520.0,-17.03996131,-4.2599903275,{'tags': ['Indium thorium (3/1)']},-17.03996131,-4.2599903275,-0.3427629674999997,"['xas', 'elasticity', 'bandstructure']",True,"[59550, 640646, 59551, 640645, 640648]",True,2021-05-12 10:56:14.760000,NM,4,8,mp-20206,,ThIn3,"{'functional': 'PBE', 'labels': ['Th', 'In_d'], 'pot_type': 'paw'}","{'Th': 1.0, 'In': 3.0}",GGA,mp-20206,"['mp-993606', 'mp-991698', 'mp-20206', 'mp-1439468', 'mp-1687434', 'mp-1934057', 'mp-994919', 'mp-1592094']",0.0001679,"{'Th': 1.0, 'In': 3.0}",107.16835528853186,[],NM,False,221,0,"[0, 0, 0, 0]",1.5666938206521777e-06,0.0001679,0,0.0001679,MP,data/source/MP/cleaned/cifs/MP-mp-20206.cif,False,,data/final/MP/graphs/In3Th1-MP-mp-20206.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Si3Zr5,2,0.0499999999999999,1.2,True,Si3.6Zr6,Si4Zr6,0.0,Other,True,Si37.5Zr62.5,Si-Zr,2,Supercon,Si3Zr5,MP-mp-1207024,Zr6Si4,Si-Zr,Si40Zr60,P 4/m b m,tetragonal,3.699711,7.13737,7.13737,data/final/MP/cifs/Si3Zr5-MP-mp-1207024-synth_doped.cif,data/source/MP/raw/cifs/mp-1207024.cif,mp-1207024,0.0,,2019-01-12 10:13:01.719000,5.812221303625078,,,{'GGA': {'task_id': 'mp-1730975'}},0.0,5.91294193,520.0,-81.81941026,-8.181941026,"{'tags': ['Zr3Si2', 'U3Si2']}",-81.81941026,-8.181941026,-0.8547950399999991,['bandstructure'],True,[],True,2021-05-12 10:58:39.488000,NM,10,5,mp-1207024,,Zr3Si2,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Si'], 'pot_type': 'paw'}","{'Zr': 3.0, 'Si': 2.0}",GGA,mp-1207024,"['mp-1207024', 'mp-1446697', 'mp-1730975', 'mp-1785728', 'mp-1622725']",0.00040375,"{'Zr': 6.0, 'Si': 4.0}",188.4708646599306,[],NM,False,127,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.284481855893329e-06,0.00040375,0,0.0008075,MP,data/source/MP/cleaned/cifs/MP-mp-1207024.cif,True,,data/final/MP/graphs/Si3Zr5-MP-mp-1207024-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Nb3Pd0.1Rh0.9,2,0.0499999999999999,2.0,False,Nb6Pd0.2Rh1.8,Nb6Rh2,2.55,Other,True,Nb75Pd2.5Rh22.5,Nb-Pd-Rh,3,Supercon,Nb3Rh0.9Pd0.1,MP-mp-1545,Nb6Rh2,Nb-Rh,Nb75Rh25,P m -3 n,cubic,5.186072,5.186072,5.186072,data/final/MP/cifs/Nb3Pd0.1Rh0.9-MP-mp-1545-synth_doped.cif,data/source/MP/raw/cifs/mp-1545.cif,mp-1545,0.0,,2011-05-14 11:20:25,9.086567873234834,10.17188/1191190,"@misc{osti_1191190,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Rh (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191190"",
    place = ""United States"",
    year = ""2015"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700041'}},0.0,5.48706495,520.0,-77.37430008,-9.67178751,{'tags': ['Niobium rhodium (3/1)']},-77.37430008,-9.67178751,-0.2547317625000005,"['xas', 'elasticity', 'bandstructure']",True,"[105216, 645269]",True,2021-05-12 10:56:12.755000,NM,8,8,mp-1545,,Nb3Rh,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Rh_pv'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Rh': 1.0}",GGA,mp-1545,"['mp-942004', 'mp-943019', 'mp-935201', 'mp-1545', 'mp-1433570', 'mp-1700041', 'mp-1786474', 'mp-1591392']",0.00021655,"{'Nb': 6.0, 'Rh': 2.0}",139.48118416938905,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",3.1050783127424102e-06,0.00021655,0,0.0004331,MP,data/source/MP/cleaned/cifs/MP-mp-1545.cif,True,,data/final/MP/graphs/Nb3Pd0.1Rh0.9-MP-mp-1545-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
V0.26Zr0.74,2,0.02,8.0,False,V2.08Zr5.92,V2Zr6,5.9,Other,True,V26Zr74,V-Zr,2,Supercon,V0.26Zr0.74,MP-mp-1188058,Zr6V2,V-Zr,V25Zr75,P 63/m m c,hexagonal,4.919627,6.336115995290159,6.3361165,data/final/MP/cifs/V0.26Zr0.74-MP-mp-1188058-synth_doped.cif,data/source/MP/raw/cifs/mp-1188058.cif,mp-1188058,0.0,,2019-01-11 15:33:28.020000,6.30284427387328,,,{'GGA': {'task_id': 'mp-1752749'}},0.1789071549999992,4.4429804,520.0,-68.02275868,-8.502844835,{'tags': []},-68.02275868,-8.502844835,0.1789071549999992,['bandstructure'],True,[],True,2021-05-12 10:58:31.620000,FM,8,5,mp-1188058,,Zr3V,"{'functional': 'PBE', 'labels': ['Zr_sv', 'V_pv'], 'pot_type': 'paw'}","{'Zr': 3.0, 'V': 1.0}",GGA,mp-1188058,"['mp-1188058', 'mp-1401270', 'mp-1752749', 'mp-1778623', 'mp-1619272']",1.61703675,"{'Zr': 6.0, 'V': 2.0}",171.04449193840148,[],FM,True,194,1,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 1.7, 1.7]",0.0189077909691748,1.61703675,2,3.2340735,MP,data/source/MP/cleaned/cifs/MP-mp-1188058.cif,True,,data/final/MP/graphs/V0.26Zr0.74-MP-mp-1188058-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ga0.8In0.2V3,3,0.0999999999999999,2.0,False,Ga1.6In0.4V6,Ga2V6,12.7,Other,True,Ga20In5V75,Ga-In-V,3,Supercon,Ga0.8In0.2V3,MP-mp-22568,V6Ga2,Ga-V,Ga25V75,P m -3 n,cubic,4.789645,4.789645,4.789645,data/final/MP/cifs/Ga0.8In0.2V3-MP-mp-22568-synth_doped.cif,data/source/MP/raw/cifs/mp-22568.cif,mp-22568,0.0,,2014-02-22 11:36:40,6.726541666276222,10.17188/1198793,"@misc{osti_1198793,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Ga (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198793"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686867'}},0.0,5.67452231,520.0,-61.95244347,-7.74405543375,{'tags': ['Gallium vanadium (1/3)']},-61.95244347,-7.74405543375,-0.1741018756249994,"['xas', 'elasticity', 'bandstructure']",True,"[635643, 635628, 635619, 635634, 104021, 635646, 635604, 635610, 635617, 635624, 635626, 635605, 635631, 635625, 635636, 635603, 104020, 635616, 635607]",True,2021-05-12 10:56:16.728000,FM,8,9,mp-22568,,V3Ga,"{'functional': 'PBE', 'labels': ['V_pv', 'Ga_d'], 'pot_type': 'paw'}","{'V': 3.0, 'Ga': 1.0}",GGA,mp-22568,"['mp-941343', 'mp-941663', 'mp-934924', 'mp-22568', 'mp-1440749', 'mp-1686867', 'mp-1804076', 'mp-1593784', 'mp-1595713']",0.09063635,"{'V': 6.0, 'Ga': 2.0}",109.87780534443452,[],FM,True,131,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.0, -0.0, -0.0]",0.0016497662965852,0.09063635,2,0.1812727,MP,data/source/MP/cleaned/cifs/MP-mp-22568.cif,True,,data/final/MP/graphs/Ga0.8In0.2V3-MP-mp-22568-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ca1.85Cl2Cu1O2,2,0.0312825860271115,1.0,True,Ca1.85Cl2Cu1O2,Ca2Cl2Cu1O2,30.0,Cuprate,True,Ca27.007Cl29.197Cu14.599O29.197080291970803,Ca-Cl-Cu-O,4,Supercon,Ca1.85Cu1Cl2O2,MP-mp-23143,Ca2Cu1Cl2O2,Ca-Cl-Cu-O,Ca28.571Cl28.571Cu14.286O28.571428571428573,I 4/m m m,tetragonal,3.88024600076171,3.880246000761709,8.12907187,data/final/MP/cifs/Ca1.85Cl2Cu1O2-MP-mp-23143-synth_doped.cif,data/source/MP/raw/cifs/mp-23143.cif,mp-23143,0.0,,2014-02-21 09:50:06,3.554337150605878,10.17188/1199263,"@misc{osti_1199263,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ca2Cu(ClO)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199263"",
    place = ""United States"",
    year = ""2016"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700223'}},0.0191527683333321,4.19679796,520.0,-35.95348475,-5.136212107142858,"{'tags': ['Dicalcium copper dioxide dichloride', 'Dicalcium dichlorodioxocuprate']}",-35.95348475,-5.136212107142858,-2.407440427142858,"['xas', 'elasticity', 'bandstructure']",True,"[1027, 83117, 41581]",True,2021-05-12 10:56:16.728000,NM,7,8,mp-23143,oxide,Ca2Cu(ClO)2,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Cu_pv', 'Cl', 'O'], 'pot_type': 'paw'}","{'Ca': 2.0, 'Cu': 1.0, 'Cl': 2.0, 'O': 2.0}",GGA,mp-23143,"['mp-992231', 'mp-990553', 'mp-23143', 'mp-1436301', 'mp-1700223', 'mp-1803462', 'mp-993865', 'mp-1592909']",0.0134962,"{'Ca': 2.0, 'Cu': 1.0, 'Cl': 2.0, 'O': 2.0}",115.21141865211318,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001171429026557,0.0134962,0,0.0134962,MP,data/source/MP/cleaned/cifs/MP-mp-23143.cif,True,,data/final/MP/graphs/Ca1.85Cl2Cu1O2-MP-mp-23143-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Cr0.8Os0.2,3,0.1,8.0,False,Cr6.4Os1.6,Cr6Os2,2.5,Other,True,Cr80Os20,Cr-Os,2,Supercon,Cr0.8Os0.2,MP-mp-416,Cr6Os2,Cr-Os,Cr75Os25,P m -3 n,cubic,4.64823,4.64823,4.64823,data/final/MP/cifs/Cr0.8Os0.2-MP-mp-416-synth_doped.cif,data/source/MP/raw/cifs/mp-416.cif,mp-416,0.0,,2011-05-14 14:17:35,11.448966502877054,10.17188/1207906,"@misc{osti_1207906,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Cr3Os (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207906"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696824'}},0.025919120000001,7.36022876,520.0,-80.16566437,-10.02070804625,{'tags': ['Chromium osmium (3/1)']},-80.16566437,-10.02070804625,0.025919120000001,"['xas', 'elasticity', 'bandstructure']",True,"[102829, 626494, 102828]",True,2021-05-12 10:56:20.740000,NM,8,8,mp-416,,Cr3Os,"{'functional': 'PBE', 'labels': ['Cr_pv', 'Os_pv'], 'pot_type': 'paw'}","{'Cr': 3.0, 'Os': 1.0}",GGA,mp-416,"['mp-912340', 'mp-928362', 'mp-928855', 'mp-416', 'mp-1426830', 'mp-1696824', 'mp-1796269', 'mp-1593089']",0.1637436,"{'Cr': 6.0, 'Os': 2.0}",100.42985322340976,[],NM,False,223,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0032608551092023,0.1637436,0,0.3274872,MP,data/source/MP/cleaned/cifs/MP-mp-416.cif,True,,data/final/MP/graphs/Cr0.8Os0.2-MP-mp-416-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Te1Ti1,1,0.0,2.0,False,Te2Ti2,Te2Ti2,0.0,Other,True,Te50Ti50,Te-Ti,2,Supercon,Te1Ti1,MP-mp-567832,Ti2Te2,Te-Ti,Te50Ti50,P 63/m m c,hexagonal,3.670909996856846,3.67091059,7.302053,data/final/MP/cifs/Te1Ti1-MP-mp-567832.cif,data/source/MP/raw/cifs/mp-567832.cif,mp-567832,0.0,,2015-02-15 05:06:01,6.838350612027851,10.17188/1274072,"@misc{osti_1274072,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TiTe (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1274072"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671106'}},0.0939842525000003,8.51760617,520.0,-24.50608866,-6.126522165,"{'tags': ['Titanium(II) telluride', 'Titanium telluride (1/1)']}",-24.50608866,-6.126522165,-0.8181256916666673,"['xas', 'elasticity', 'bandstructure']",True,"[52503, 653072, 653081, 653080, 104194]",True,2021-05-12 10:56:22.739000,NM,4,11,mp-567832,,TiTe,"{'functional': 'PBE', 'labels': ['Ti_pv', 'Te'], 'pot_type': 'paw'}","{'Ti': 1.0, 'Te': 1.0}",GGA,mp-567832,"['mp-933833', 'mp-943925', 'mp-944593', 'mp-567832', 'mp-1065939', 'mp-1065959', 'mp-1439167', 'mp-1671106', 'mp-1800695', 'mp-1590921', 'mp-1065958']",0.00618215,"{'Ti': 2.0, 'Te': 2.0}",85.21639937168975,[],NM,False,194,0,"[0, 0, 0, 0]",0.000145092964396,0.00618215,0,0.0123643,MP,data/source/MP/cleaned/cifs/MP-mp-567832.cif,False,,data/final/MP/graphs/Te1Ti1-MP-mp-567832.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Fe2K0.85Se1.8,3,0.0602150537634408,1.0,True,Fe2K0.85Se1.8,Fe2K1Se2,32.6,Ferrite,True,Fe43.011K18.28Se38.71,Fe-K-Se,3,Supercon,K0.85Fe2Se1.8,MP-mp-1070735,K1Fe2Se2,Fe-K-Se,Fe40K20Se40,I 4/m m m,tetragonal,3.783558000712664,3.783558000712664,7.91886339,data/final/MP/cifs/Fe2K0.85Se1.8-MP-mp-1070735-synth_doped.cif,data/source/MP/raw/cifs/mp-1070735.cif,mp-1070735,0.0,,2018-03-22 03:52:22,4.804538531009527,,,{'GGA': {'task_id': 'mp-1761650'}},0.0327827750000011,3.42423866,520.0,-27.50456218,-5.500912436,{'tags': ['Potassium iron selenide (1/2/2)']},-27.50456218,-5.500912436,-0.6812646755374999,['bandstructure'],True,[186573],True,2021-05-12 10:58:14.654000,FM,5,8,mp-1070735,,K(FeSe)2,"{'functional': 'PBE', 'labels': ['K_sv', 'Fe_pv', 'Se'], 'pot_type': 'paw'}","{'K': 1.0, 'Fe': 2.0, 'Se': 2.0}",GGA,mp-1070735,"['mp-1070735', 'mp-1070765', 'mp-1070841', 'mp-1416829', 'mp-1761650', 'mp-1797161', 'mp-1585994', 'mp-1070830']",6.0503851,"{'K': 1.0, 'Fe': 2.0, 'Se': 2.0}",106.69540665041993,[],FM,True,139,1,"[0.0, 2.8, 2.8, 0.0, 0.0]",0.0567070813069176,6.0503851,2,6.0503851,MP,data/source/MP/cleaned/cifs/MP-mp-1070735.cif,True,,data/final/MP/graphs/Fe2K0.85Se1.8-MP-mp-1070735-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ge13Lu3Ru4,1,0.0,2.0,False,Ge26Lu6Ru8,Ge26Lu6Ru8,2.3,Other,True,Ge65Lu15Ru20,Ge-Lu-Ru,3,Supercon,Lu3Ru4Ge13,MP-mp-1203006,Lu6Ge26Ru8,Ge-Lu-Ru,Ge65Lu15Ru20,P m -3 n,cubic,8.979954,8.979954,8.979954,data/final/MP/cifs/Ge13Lu3Ru4-MP-mp-1203006.cif,data/source/MP/raw/cifs/mp-1203006.cif,mp-1203006,0.0,,2019-01-12 06:56:31.281000,8.592324817553937,,,,0.0286979534374989,4.81404847,520.0,-238.0316876,-5.95079219,"{'tags': ['Lutetium ruthenium germanide (3/4/13)', 'Lu3Ru4Ge13', 'Yb3Rh4Sn13']}",-238.0316876,-5.95079219,-0.4128035752499997,[],False,[636939],True,2021-05-12 11:00:12.709000,NM,40,3,mp-1203006,,Lu3Ge13Ru4,"{'functional': 'PBE', 'labels': ['Lu_3', 'Ge_d', 'Ru_pv'], 'pot_type': 'paw'}","{'Lu': 3.0, 'Ge': 13.0, 'Ru': 4.0}",GGA,mp-1203006,"['mp-1203006', 'mp-1332930', 'mp-1891964']",0.00272545,"{'Lu': 6.0, 'Ge': 26.0, 'Ru': 8.0}",724.1396636818048,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",7.527415322460761e-06,0.00272545,0,0.0054509,MP,data/source/MP/cleaned/cifs/MP-mp-1203006.cif,False,,data/final/MP/graphs/Ge13Lu3Ru4-MP-mp-1203006.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ag0.92Se2Sn1.08,2,0.04,1.0,True,Ag0.92Se2Sn1.08,Ag1Se2Sn1,5.57,Other,True,Ag23Se50Sn27,Ag-Se-Sn,3,Supercon,Ag0.92Sn1.08Se2,MP-mp-1229011,Ag1Sn1Se2,Ag-Se-Sn,Ag25Se50Sn25,R -3 m,trigonal,4.0598026973764,4.0598026973764,7.0325229,data/final/MP/cifs/Ag0.92Se2Sn1.08-MP-mp-1229011-synth_doped.cif,data/source/MP/raw/cifs/mp-1229011.cif,mp-1229011,0.0,,2019-01-13 04:39:21.201000,6.746249424080593,,,{'GGA': {'task_id': 'mp-1766738'}},0.0,4.6965768,520.0,-14.98910359,-3.7472758975,{'tags': []},-14.98910359,-3.7472758975,-0.5247881940885413,['bandstructure'],True,[],True,2021-05-12 10:58:49.477000,NM,4,5,mp-1229011,,AgSnSe2,"{'functional': 'PBE', 'labels': ['Ag', 'Sn_d', 'Se'], 'pot_type': 'paw'}","{'Ag': 1.0, 'Sn': 1.0, 'Se': 2.0}",GGA,mp-1229011,"['mp-1229011', 'mp-1422543', 'mp-1766738', 'mp-1796245', 'mp-1612963']",0.0080447,"{'Ag': 1.0, 'Sn': 1.0, 'Se': 2.0}",94.64136915222257,[],NM,False,166,0,"[0, 0, 0, 0]",8.50019401881305e-05,0.0080447,0,0.0080447,MP,data/source/MP/cleaned/cifs/MP-mp-1229011.cif,True,,data/final/MP/graphs/Ag0.92Se2Sn1.08-MP-mp-1229011-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Hg4Pt1,1,0.0,1.0,True,Hg4Pt1,Hg4Pt1,0.0,Other,True,Hg80Pt20,Hg-Pt,2,Supercon,Hg4Pt1,MP-mp-936,Hg4Pt1,Hg-Pt,Hg80Pt20,I m -3 m,cubic,5.530796761226092,5.53079676,5.53079676,data/final/MP/cifs/Hg4Pt1-MP-mp-936.cif,data/source/MP/raw/cifs/mp-936.cif,mp-936,0.0,,2011-05-13 07:18:03,12.717343750372809,,,{'GGA': {'task_id': 'mp-1687409'}},0.0,2.38621962,520.0,-7.7566809,-1.55133618,"{'tags': ['Mercury platinum (4/1) - beta', 'Mercury platinum (4/1)', 'Platinum mercury (1/4)']}",-7.7566809,-1.55133618,-0.094210346,"['xas', 'elasticity', 'bandstructure']",True,"[639148, 108762, 659824, 655081, 639150, 150772]",True,2021-05-12 10:56:35.166000,NM,5,17,mp-936,,Hg4Pt,"{'functional': 'PBE', 'labels': ['Hg', 'Pt'], 'pot_type': 'paw'}","{'Hg': 4.0, 'Pt': 1.0}",GGA,mp-936,"['mp-905399', 'mp-919589', 'mp-918590', 'mp-936', 'mp-2312', 'mp-1070373', 'mp-1070439', 'mp-1070404', 'mp-1070645', 'mp-1070688', 'mp-1070664', 'mp-1437641', 'mp-1687409', 'mp-1780994', 'mp-1588391', 'mp-1070703', 'mp-1070450']",0.0002601,"{'Hg': 4.0, 'Pt': 1.0}",130.23904686835377,[],NM,False,229,0,"[0, 0, 0, 0, 0]",1.997096924879297e-06,0.0002601,0,0.0002601,MP,data/source/MP/cleaned/cifs/MP-mp-936.cif,False,,data/final/MP/graphs/Hg4Pt1-MP-mp-936.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,1,0,1.0,False
Ir0.75Os0.25,1,0.0,4.0,False,Ir3Os1,Ir3Os1,0.4,Other,True,Ir75Os25,Ir-Os,2,Supercon,Ir0.75Os0.25,MP-mp-1184761,Ir3Os1,Ir-Os,Ir75Os25,P m -3 m,cubic,3.869663,3.869663,3.869663,data/final/MP/cifs/Ir0.75Os0.25-MP-mp-1184761.cif,data/source/MP/raw/cifs/mp-1184761.cif,mp-1184761,0.0,,2019-01-11 13:02:26.527000,21.976455121748085,,,{'GGA': {'task_id': 'mp-1766725'}},0.0216742762499979,9.66588868,520.0,-37.65596041,-9.4139901025,{'tags': []},-37.65596041,-9.4139901025,0.0216742762499997,['bandstructure'],True,[],True,2021-05-12 10:58:27.755000,NM,4,5,mp-1184761,,Ir3Os,"{'functional': 'PBE', 'labels': ['Ir', 'Os_pv'], 'pot_type': 'paw'}","{'Ir': 3.0, 'Os': 1.0}",GGA,mp-1184761,"['mp-1184761', 'mp-1422574', 'mp-1766725', 'mp-1783126', 'mp-1585018']",0.001613,"{'Ir': 3.0, 'Os': 1.0}",57.94546267259782,[],NM,False,221,0,"[0, 0, 0, 0]",2.783651947200313e-05,0.001613,0,0.001613,MP,data/source/MP/cleaned/cifs/MP-mp-1184761.cif,False,,data/final/MP/graphs/Ir0.75Os0.25-MP-mp-1184761.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Cu3Gd0.97Pr0.03O7,2,0.0046153846153846,1.0,True,Ba2Cu3Gd0.97Pr0.03O7,Ba2Cu3Gd1O7,93.1,Cuprate,True,Ba15.385Cu23.077Gd7.462Pr0.231O53.84615384615385,Ba-Cu-Gd-Pr-O,5,Supercon,Gd0.97Pr0.03Ba2Cu3O7,MP-mp-19813,Ba2Gd1Cu3O7,Ba-Cu-Gd-O,Ba15.385Cu23.077Gd7.692O53.84615384615385,P m m m,orthorhombic,3.866027,3.930015,11.83802,data/final/MP/cifs/Ba2Cu3Gd0.97Pr0.03O7-MP-mp-19813-synth_doped.cif,data/source/MP/raw/cifs/mp-19813.cif,mp-19813,0.0,,2014-02-22 19:20:06,6.781489399734723,10.17188/1195011,"@misc{osti_1195011,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2GdCu3O7 (SG:47) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195011"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702590'}},0.0282650169230738,3.15888808,520.0,-88.25301217,-6.788693243846154,"{'tags': ['Gadolinium dibarium tricopper heptaoxide', 'Gadolinium barium copper oxide (1/2/3/7)', 'Dibarium gadolinium dicopper copper(III) oxide']}",-88.25301217,-6.788693243846154,-2.170353940384615,['bandstructure'],True,"[56514, 86959, 81172]",True,2021-05-12 10:58:49.477000,FM,13,5,mp-19813,oxide,Ba2GdCu3O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Gd', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Gd': 1.0, 'Cu': 3.0, 'O': 7.0}",GGA,mp-19813,"['mp-19813', 'mp-1432948', 'mp-1702590', 'mp-1829895', 'mp-1597575']",6.9263247,"{'Ba': 2.0, 'Gd': 1.0, 'Cu': 3.0, 'O': 7.0}",179.8614789314764,[],FM,True,47,1,"[0.0, 0.0, 6.9, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0385092168770545,6.9263247,1,6.9263247,MP,data/source/MP/cleaned/cifs/MP-mp-19813.cif,True,,data/final/MP/graphs/Ba2Cu3Gd0.97Pr0.03O7-MP-mp-19813-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
B2C1Ni2Tb0.75Y0.25,3,0.0833333333333333,1.0,True,B2C1Ni2Tb0.75Y0.25,B2C1Ni2Tb1,0.0,Other,True,B33.333C16.667Ni33.333Tb12.5Y4.167,B-C-Ni-Tb-Y,5,Supercon,Y0.25Tb0.75Ni2B2C1,MP-mp-6092,Tb1Ni2B2C1,B-C-Ni-Tb,B33.333C16.667Ni33.333Tb16.667,I 4/m m m,tetragonal,3.5665140003823987,3.5665140003823987,5.7333997100000005,data/final/MP/cifs/B2C1Ni2Tb0.75Y0.25-MP-mp-6092-synth_doped.cif,data/source/MP/raw/cifs/mp-6092.cif,mp-6092,0.0,,2011-05-13 04:21:03,7.858244682564482,10.17188/1277657,"@misc{osti_1277657,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TbNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277657"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686417'}},0.0,6.76233636,520.0,-41.85355222,-6.975592036666666,{'tags': []},-41.85355222,-6.975592036666666,-0.5122247530555543,"['xas', 'elasticity', 'bandstructure']",True,"[89159, 89157, 79572, 56648, 89155, 89156, 89160, 89158]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-6092,,TbNi2B2C,"{'functional': 'PBE', 'labels': ['Tb_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Tb': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6092,"['mp-1007320', 'mp-1000865', 'mp-6092', 'mp-1440112', 'mp-1686417', 'mp-1793943', 'mp-1012059', 'mp-1590555']",0.0029604,"{'Tb': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.4949740949675,[],NM,False,139,0,"[-0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",4.520041485484718e-05,0.0029604,0,0.0029604,MP,data/source/MP/cleaned/cifs/MP-mp-6092.cif,True,,data/final/MP/graphs/B2C1Ni2Tb0.75Y0.25-MP-mp-6092-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Au3Te5,3,0.0833333333333333,0.3333666666666667,False,Au1Te1.667,Au1Te2,1.62,Other,True,Au37.5Te62.5,Au-Te,2,Supercon,Au3Te5,MP-mp-567525,Te2Au1,Au-Te,Au33.333Te66.667,C 1 2/m 1,monoclinic,4.228509889999999,4.228509889999999,5.15701111,data/final/MP/cifs/Au3Te5-MP-mp-567525-synth_doped.cif,data/source/MP/raw/cifs/mp-567525.cif,mp-567525,0.0,,2014-02-16 11:21:24,9.349466095623004,10.17188/1272560,"@misc{osti_1272560,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Te2Au (SG:12) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1272560"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668681'}},0.0177770462499995,6.52239204,520.0,-9.77688527,-3.2589617566666664,"{'tags': ['Gold telluride (1/2)', 'Gold ditelluride', 'Calaverite, average structure', 'High pressure experimental phase', 'Calaverite']}",-9.77688527,-3.2589617566666664,-0.3534672899999993,"['xas', 'bandstructure']",True,"[64681, 64682, 72435, 659325, 151373, 72434, 72437, 66625, 66626, 612390, 65105, 659328, 65104, 659326, 72438, 72436, 659327, 72439]",True,2021-05-12 10:57:23.123000,NM,3,7,mp-567525,,Te2Au,"{'functional': 'PBE', 'labels': ['Te', 'Au'], 'pot_type': 'paw'}","{'Te': 2.0, 'Au': 1.0}",GGA,mp-567525,"['mp-567525', 'mp-1441005', 'mp-1668681', 'mp-1799624', 'mp-1934226', 'mp-1595493', 'mp-1592789']",0.0002727,"{'Te': 2.0, 'Au': 1.0}",80.30835608746618,[],NM,False,12,0,"[0, 0, 0]",3.3956615884777227e-06,0.0002727,0,0.0002727,MP,data/source/MP/cleaned/cifs/MP-mp-567525.cif,True,,data/final/MP/graphs/Au3Te5-MP-mp-567525-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
Ba0.3Cu1La1Sr0.7Tl1O5,3,0.0666666666666666,1.0,True,Ba0.3Cu1La1Sr0.7Tl1O5,Cu1La1Sr1Tl1O5,30.0,Cuprate,True,Ba3.333Cu11.111La11.111Sr7.778Tl11.111O55.55555555555556,Ba-Cu-La-Sr-Tl-O,6,Supercon,Tl1Ba0.3Sr0.7La1Cu1O5,MP-mp-1218170,Sr1La1Tl1Cu1O5,Cu-La-Sr-Tl-O,Cu11.111La11.111Sr11.111Tl11.111O55.55555555555556,P 4 m m,tetragonal,3.808314,3.808314,8.940218,data/final/MP/cifs/Ba0.3Cu1La1Sr0.7Tl1O5-MP-mp-1218170-synth_doped.cif,data/source/MP/raw/cifs/mp-1218170.cif,mp-1218170,0.0,,2019-01-12 19:23:00.047000,7.356801903811997,,,{'GGA': {'task_id': 'mp-1751231'}},0.0235770105555133,5.93274247,520.0,-55.01092809,-6.1123253433333335,{'tags': []},-55.01092809,-6.1123253433333335,-2.2909747433333343,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,9,5,mp-1218170,oxide,SrLaTlCuO5,"{'functional': 'PBE', 'labels': ['Sr_sv', 'La', 'Tl_d', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 1.0, 'La': 1.0, 'Tl': 1.0, 'Cu': 1.0, 'O': 5.0}",GGA,mp-1218170,"['mp-1218170', 'mp-1444406', 'mp-1751231', 'mp-1787322', 'mp-1618863']",0.0033628,"{'Sr': 1.0, 'La': 1.0, 'Tl': 1.0, 'Cu': 1.0, 'O': 5.0}",129.66226608171218,[],NM,False,99,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",2.593507040730561e-05,0.0033628,0,0.0033628,MP,data/source/MP/cleaned/cifs/MP-mp-1218170.cif,True,,data/final/MP/graphs/Ba0.3Cu1La1Sr0.7Tl1O5-MP-mp-1218170-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
C2La1Ni1,1,0.0,1.0,True,C2La1Ni1,C2La1Ni1,2.89,Other,True,C50La25Ni25,C-La-Ni,3,Supercon,La1Ni1C2,MP-mp-1018048,La1Ni1C2,C-La-Ni,C50La25Ni25,A m m 2,orthorhombic,3.82731293,3.82731293,3.977635,data/final/MP/cifs/C2La1Ni1-MP-mp-1018048.cif,data/source/MP/raw/cifs/mp-1018048.cif,mp-1018048,0.0,,2017-04-06 23:27:44,6.5955568384756855,10.17188/1350127,"@article{osti_1350127,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaNiC2 (SG:38) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1350127"",
    place = ""United States"",
    year = ""2017"",
    month = ""4""
}
",{'GGA': {'task_id': 'mp-1697101'}},0.0,8.87914765,520.0,-30.18892584,-7.54723146,"{'tags': ['LaNiC2', 'Lanthanum nickel carbide (1/1/2)', 'CeNiC2']}",-30.18892584,-7.54723146,-0.2548051637499995,"['bandstructure', 'elasticity']",True,[618179],True,2021-05-12 10:56:08.727000,NM,4,12,mp-1018048,,LaNiC2,"{'functional': 'PBE', 'labels': ['La', 'Ni_pv', 'C'], 'pot_type': 'paw'}","{'La': 1.0, 'Ni': 1.0, 'C': 2.0}",GGA,mp-1018048,"['mp-1018048', 'mp-1018270', 'mp-1018463', 'mp-1067001', 'mp-1067047', 'mp-1067181', 'mp-1115476', 'mp-1412950', 'mp-1697101', 'mp-1783297', 'mp-1594865', 'mp-1067093']",0.005804,"{'La': 1.0, 'Ni': 1.0, 'C': 2.0}",55.79651958097468,[],NM,False,38,0,"[0.0, -0.0, 0.0, 0.0]",0.0001040208250189,0.005804,0,0.005804,MP,data/source/MP/cleaned/cifs/MP-mp-1018048.cif,False,,data/final/MP/graphs/C2La1Ni1-MP-mp-1018048.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
In0.75Tl0.25,1,0.0,4.0,False,In3Tl1,In3Tl1,0.0,Other,True,In75Tl25,In-Tl,2,Supercon,In0.75Tl0.25,MP-mp-1216611,Tl1In3,In-Tl,In75Tl25,P 4/m m m,tetragonal,3.292527,3.292527,10.620154,data/final/MP/cifs/In0.75Tl0.25-MP-mp-1216611.cif,data/source/MP/raw/cifs/mp-1216611.cif,mp-1216611,0.0,,2019-01-12 18:05:25.856000,7.915953094966258,,,{'GGA': {'task_id': 'mp-1759355'}},0.0157017466666666,6.544522,520.0,-10.55488735,-2.6387218375,{'tags': []},-10.55488735,-2.6387218375,0.0157017466666666,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,4,5,mp-1216611,,TlIn3,"{'functional': 'PBE', 'labels': ['Tl_d', 'In_d'], 'pot_type': 'paw'}","{'Tl': 1.0, 'In': 3.0}",GGA,mp-1216611,"['mp-1216611', 'mp-1410171', 'mp-1759355', 'mp-1802581', 'mp-1584686']",0.018572,"{'Tl': 1.0, 'In': 3.0}",115.13026503868502,[],NM,False,123,0,"[0, 0, 0, 0]",0.0001613129266553,0.018572,0,0.018572,MP,data/source/MP/cleaned/cifs/MP-mp-1216611.cif,False,,data/final/MP/graphs/In0.75Tl0.25-MP-mp-1216611.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Bi2Cu1O4,1,0.0,4.0,False,Bi8Cu4O16,Bi8Cu4O16,0.0,Cuprate,True,Bi28.571Cu14.286O57.142857142857146,Bi-Cu-O,3,Supercon,Bi2Cu1O4,MP-mp-505042,Cu4Bi8O16,Bi-Cu-O,Bi28.571Cu14.286O57.142857142857146,P 4/n c c,tetragonal,6.042072,8.491174,8.491174,data/final/MP/cifs/Bi2Cu1O4-MP-mp-505042.cif,data/source/MP/raw/cifs/mp-505042.cif,mp-505042,0.0,,2014-03-10 16:20:03,8.317369003305407,10.17188/1262213,"@misc{osti_1262213,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Cu(BiO2)2 (SG:130) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1262213"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1705825'}},0.0,5.33802468,520.0,-156.33295651,-5.583319875357143,"{'tags': ['Kusachiite', 'Dibismuth copper oxide', 'Bismuth copper oxide']}",-156.33295651,-5.583319875357143,-1.4514456882142857,"['xas', 'elasticity', 'bandstructure']",True,"[68814, 56390, 68813, 69746, 68812, 15865, 68815, 69747, 69308, 69307, 67018, 71313, 202994]",True,2021-05-12 10:56:20.740000,FM,28,8,mp-505042,oxide,Cu(BiO2)2,"{'functional': 'PBE', 'labels': ['Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Cu': 1.0, 'Bi': 2.0, 'O': 4.0}",GGA,mp-505042,"['mp-922615', 'mp-908185', 'mp-923392', 'mp-505042', 'mp-1426745', 'mp-1705825', 'mp-1818968', 'mp-1608668']",0.9997502,"{'Cu': 4.0, 'Bi': 8.0, 'O': 16.0}",435.6336080999684,[],FM,True,130,1,"[0.6, 0.6, 0.6, 0.6, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0091797343585169,0.9997502,4,3.9990008,MP,data/source/MP/cleaned/cifs/MP-mp-505042.cif,False,,data/final/MP/graphs/Bi2Cu1O4-MP-mp-505042.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
As1Fe1Pr1O0.896,2,0.0400410677618069,2.0,False,As2Fe2Pr2O1.792,As2Fe2Pr2O2,44.4,Ferrite,True,As25.667Fe25.667Pr25.667O22.99794661190965,As-Fe-Pr-O,4,Supercon,Pr1Fe1As1O0.896,MP-mp-22491,Pr2Fe2As2O2,As-Fe-Pr-O,As25Fe25Pr25O25,P 4/n m m,tetragonal,4.094889,4.094889,9.258722,data/final/MP/cifs/As1Fe1Pr1O0.896-MP-mp-22491-synth_doped.cif,data/source/MP/raw/cifs/mp-22491.cif,mp-22491,0.0,,2014-02-25 19:17:30,6.153806906111091,,,{'GGA+U': {'task_id': 'mp-1695715'}},0.3808778432291664,4.12348168,520.0,-51.7633941,-6.4704242625,{'tags': ['Praseodymium iron arsenic oxide (1/1/1/1)']},-51.7633941,-6.4704242625,-1.491677511249999,"['xas', 'bandstructure']",True,"[162830, 162833, 246832, 90316, 422000, 236649, 236648, 602491]",True,2021-05-12 10:57:10.838000,FM,8,8,mp-22491,oxide,PrFeAsO,"{'functional': 'PBE', 'labels': ['Pr_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Pr': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-22491,"['mp-510622', 'mp-1079608', 'mp-1079857', 'mp-22491', 'mp-1476145', 'mp-1695715', 'mp-1778524', 'mp-1596397']",3.7947681,"{'Pr': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",155.25132378854377,[],FM,True,129,1,"[0.0, 0.0, 3.5, 3.5, 0.0, 0.0, 0.0, 0.0]",0.0488854846116297,3.7947681,2,7.5895362,MP,data/source/MP/cleaned/cifs/MP-mp-22491.cif,True,,data/final/MP/graphs/As1Fe1Pr1O0.896-MP-mp-22491-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Er0.95Pd2Sn1Y0.05,2,0.025,1.0,True,Er0.95Pd2Sn1Y0.05,Er1Pd2Sn1,1.26,Other,True,Er23.75Pd50Sn25Y1.25,Er-Pd-Sn-Y,4,Supercon,Er0.95Y0.05Pd2Sn1,MP-mp-5850,Er1Sn1Pd2,Er-Pd-Sn,Er25Pd50Sn25,F m -3 m,cubic,4.78219427,4.78219427,4.78219427,data/final/MP/cifs/Er0.95Pd2Sn1Y0.05-MP-mp-5850-synth_doped.cif,data/source/MP/raw/cifs/mp-5850.cif,mp-5850,0.0,,2011-05-13 00:05:51,10.71067227167776,10.17188/1277090,"@misc{osti_1277090,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ErSnPd2 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277090"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700202'}},0.0,6.39384258,520.0,-22.50225514,-5.625563785,{'tags': ['Erbium palladium tin (1/2/1)']},-22.50225514,-5.625563785,-0.8913002137499992,"['xas', 'bandstructure']",True,"[103283, 103284]",True,2021-05-12 10:57:26.891000,NM,4,8,mp-5850,,ErSnPd2,"{'functional': 'PBE', 'labels': ['Er_3', 'Sn_d', 'Pd'], 'pot_type': 'paw'}","{'Er': 1.0, 'Sn': 1.0, 'Pd': 2.0}",GGA,mp-5850,"['mp-991640', 'mp-5850', 'mp-993556', 'mp-1438533', 'mp-1700202', 'mp-1801714', 'mp-994862', 'mp-1588611']",0.0008924,"{'Er': 1.0, 'Sn': 1.0, 'Pd': 2.0}",77.33331860614689,[],NM,False,225,0,"[0, 0, 0, 0]",1.1539657370000246e-05,0.0008924,0,0.0008924,MP,data/source/MP/cleaned/cifs/MP-mp-5850.cif,True,,data/final/MP/graphs/Er0.95Pd2Sn1Y0.05-MP-mp-5850-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ce0.075In1La2.925,2,0.0375,1.0,True,Ce0.075In1La2.925,In1La3,4.42,Other,True,Ce1.875In25La73.125,Ce-In-La,3,Supercon,La2.9251Ce0.0749In1,MP-mp-20909,La3In1,In-La,In25La75,P m -3 m,cubic,5.076766,5.076766,5.076766,data/final/MP/cifs/Ce0.075In1La2.925-MP-mp-20909-synth_doped.cif,data/source/MP/raw/cifs/mp-20909.cif,mp-20909,0.0,,2014-02-21 06:52:52,6.7455760598452565,10.17188/1196104,"@misc{osti_1196104,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La3In (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196104"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671685'}},0.0,8.16935076,520.0,-18.73796121,-4.6844903025,"{'tags': ['Indium lanthanum (1/3)', 'Lanthanum indium (3/1)']}",-18.73796121,-4.6844903025,-0.2945640412500001,"['xas', 'bandstructure']",True,"[639844, 51950, 639851, 639840, 603208, 107019]",True,2021-05-12 10:56:57.051000,NM,4,8,mp-20909,,La3In,"{'functional': 'PBE', 'labels': ['La', 'In_d'], 'pot_type': 'paw'}","{'La': 3.0, 'In': 1.0}",GGA,mp-20909,"['mp-906743', 'mp-921394', 'mp-920373', 'mp-20909', 'mp-1476042', 'mp-1671685', 'mp-1778647', 'mp-1590323']",0.0489742,"{'La': 3.0, 'In': 1.0}",130.84629766481785,[],NM,False,221,0,"[0, 0, 0, 0]",0.0003742880071811,0.0489742,0,0.0489742,MP,data/source/MP/cleaned/cifs/MP-mp-20909.cif,True,,data/final/MP/graphs/Ce0.075In1La2.925-MP-mp-20909-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
C2Lu1,3,0.1333333333333334,6.0,False,C12Lu6,C12Lu8,3.33,Carbon,True,C66.667Lu33.333,C-Lu,2,Supercon,C2Lu1,MP-mp-15319,Lu8C12,C-Lu,C60Lu40,I -4 3 d,cubic,6.938115761538072,6.93811576,6.93811576,data/final/MP/cifs/C2Lu1-MP-mp-15319-synth_doped.cif,data/source/MP/raw/cifs/mp-15319.cif,mp-15319,0.0,,2011-06-03 16:29:43,9.971385733383247,10.17188/1191102,"@misc{osti_1191102,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Lu2C3 (SG:220) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191102"",
    place = ""United States"",
    year = ""2015"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668178'}},0.0877965287800028,5.22285158,520.0,-152.26540835,-7.6132704175,{'tags': ['Lutetium carbide (2/3)']},-152.26540835,-7.6132704175,-0.2688217894999994,"['xas', 'bandstructure']",True,"[618221, 86294]",True,2021-05-12 10:56:53.126000,NM,20,8,mp-15319,,Lu2C3,"{'functional': 'PBE', 'labels': ['Lu_3', 'C'], 'pot_type': 'paw'}","{'Lu': 2.0, 'C': 3.0}",GGA,mp-15319,"['mp-937434', 'mp-939969', 'mp-916841', 'mp-15319', 'mp-1428316', 'mp-1668178', 'mp-1776597', 'mp-1605126']",0.0097528,"{'Lu': 8.0, 'C': 12.0}",257.1003888807674,[],NM,False,220,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0001517352819644,0.0097528,0,0.0390112,MP,data/source/MP/cleaned/cifs/MP-mp-15319.cif,True,,data/final/MP/graphs/C2Lu1-MP-mp-15319-synth_doped.json,0,True,-43m,5,0,0,0,0,0,0,0,0,1,0,1.0,False
Lu1Rh2Si2,1,0.0,1.0,True,Lu1Rh2Si2,Lu1Rh2Si2,0.0,Other,True,Lu20Rh40Si40,Lu-Rh-Si,3,Supercon,Lu1Rh2Si2,MP-mp-3108,Lu1Si2Rh2,Lu-Rh-Si,Lu20Rh40Si40,I 4/m m m,tetragonal,4.044560002665009,4.04456000266501,5.713379280000001,data/final/MP/cifs/Lu1Rh2Si2-MP-mp-3108.cif,data/source/MP/raw/cifs/mp-3108.cif,mp-3108,0.0,,2011-05-13 02:23:37,8.967641810059613,10.17188/1205406,"@misc{osti_1205406,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Lu(SiRh)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1205406"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1674384'}},0.0,7.08793137,520.0,-35.57622783,-7.1152455660000005,{'tags': ['Lutetium rhodium silicide (1/2/2)']},-35.57622783,-7.1152455660000005,-1.0952067060000004,"['xas', 'elasticity', 'bandstructure']",True,"[187016, 642548, 642551, 90198]",True,2021-05-12 10:56:18.721000,NM,5,14,mp-3108,,Lu(SiRh)2,"{'functional': 'PBE', 'labels': ['Lu_3', 'Si', 'Rh_pv'], 'pot_type': 'paw'}","{'Lu': 1.0, 'Si': 2.0, 'Rh': 2.0}",GGA,mp-3108,"['mp-1000877', 'mp-3108', 'mp-1007323', 'mp-1068423', 'mp-1068465', 'mp-1068522', 'mp-1125088', 'mp-1133338', 'mp-1437874', 'mp-1674384', 'mp-1800782', 'mp-1012060', 'mp-1594996', 'mp-1068502']",0.0122611,"{'Lu': 1.0, 'Si': 2.0, 'Rh': 2.0}",80.90988690001882,[],NM,False,139,0,"[0, 0, 0, 0, 0]",0.0001515401945271,0.0122611,0,0.0122611,MP,data/source/MP/cleaned/cifs/MP-mp-3108.cif,False,,data/final/MP/graphs/Lu1Rh2Si2-MP-mp-3108.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
P1W3,1,0.0,4.0,False,P4W12,P4W12,2.76,Other,True,P25W75,P-W,2,Supercon,P1W3,MP-mp-1209828,P4W12,P-W,P25W75,I -4 2 m,tetragonal,4.861875999075734,7.399441859858111,7.39944186,data/final/MP/cifs/P1W3-MP-mp-1209828.cif,data/source/MP/raw/cifs/mp-1209828.cif,mp-1209828,0.0,,2019-01-12 12:29:07.470000,16.292981251791442,,,{'GGA': {'task_id': 'mp-1729199'}},0.0579971543750001,8.69163576,520.0,-179.17479806,-11.19842487875,"{'tags': ['V3S', 'W3P']}",-179.17479806,-11.19842487875,-0.1265043995833323,[],False,[],True,2021-05-12 11:00:24.227000,NM,16,5,mp-1209828,,PW3,"{'functional': 'PBE', 'labels': ['P', 'W_pv'], 'pot_type': 'paw'}","{'P': 1.0, 'W': 3.0}",GGA,mp-1209828,"['mp-1209828', 'mp-1411670', 'mp-1729199', 'mp-1777232', 'mp-1861590']",3.975e-06,"{'P': 4.0, 'W': 12.0}",237.4651103819201,[],NM,False,121,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.69572046791535e-08,3.975e-06,0,1.59e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1209828.cif,False,,data/final/MP/graphs/P1W3-MP-mp-1209828.json,0,True,-42m,0,0,0,0,6,0,0,0,0,1,0,1.0,False
Nb0.03Si1V2.97,2,0.0149999999999999,2.0,False,Nb0.06Si2V5.94,Si2V6,15.8,Other,True,Nb0.75Si25V74.25,Nb-Si-V,3,Supercon,Nb0.03Si1V2.97,MP-mp-2567,V6Si2,Si-V,Si25V75,P m -3 n,cubic,4.702381,4.702381,4.702381,data/final/MP/cifs/Nb0.03Si1V2.97-MP-mp-2567-synth_doped.cif,data/source/MP/raw/cifs/mp-2567.cif,mp-2567,0.0,,2011-05-13 19:15:43,5.778142190030859,10.17188/1200874,"@misc{osti_1200874,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Si (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1200874"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668672'}},0.0,7.30599425,520.0,-69.05773321,-8.63221665125,{'tags': ['Vanadium silicide (3/1)']},-69.05773321,-8.63221665125,-0.4452085937499994,"['xas', 'elasticity', 'bandstructure']",True,"[652491, 87328, 652522, 652502, 652510, 652520, 600518, 186003, 652507, 652513, 652497, 601150, 652514, 652487, 22412, 652509, 652529, 652532, 652499, 652539, 652537, 652533, 652512, 652538, 652490, 652493, 652494, 652511, 652519, 87329, 652526, 652500]",True,2021-05-12 10:56:18.721000,FM,8,13,mp-2567,,V3Si,"{'functional': 'PBE', 'labels': ['V_pv', 'Si'], 'pot_type': 'paw'}","{'V': 3.0, 'Si': 1.0}",GGA,mp-2567,"['mp-920081', 'mp-906309', 'mp-919083', 'mp-2567', 'mp-1078474', 'mp-1078852', 'mp-1138781', 'mp-1145907', 'mp-1440678', 'mp-1668672', 'mp-1795955', 'mp-1593554', 'mp-1596575']",0.8382519,"{'V': 6.0, 'Si': 2.0}",103.98086881866836,[],FM,True,131,1,"[0.2, 0.3, 0.3, 0.2, 0.3, 0.3, 0.0, 0.0]",0.0161231947669493,0.8382519,6,1.6765038,MP,data/source/MP/cleaned/cifs/MP-mp-2567.cif,True,,data/final/MP/graphs/Nb0.03Si1V2.97-MP-mp-2567-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
B0.1P0.9Ru1Zr1,3,0.0666666666666666,4.0,False,B0.4P3.6Ru4Zr4,P4Ru4Zr4,8.1,Other,True,B3.333P30Ru33.333Zr33.333,B-P-Ru-Zr,4,Supercon,Zr1Ru1P0.9B0.1,MP-mp-22268,Zr4P4Ru4,P-Ru-Zr,P33.333Ru33.333Zr33.333,P n m a,orthorhombic,3.896771,6.476559,7.378435,data/final/MP/cifs/B0.1P0.9Ru1Zr1-MP-mp-22268-synth_doped.cif,data/source/MP/raw/cifs/mp-22268.cif,mp-22268,0.0,,2014-02-22 18:40:36,7.963823777103373,10.17188/1197495,"@misc{osti_1197495,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrPRu (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197495"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677547'}},0.0,7.91938263,520.0,-106.40582437,-8.867152030833333,"{'tags': ['Ruthenium zirconium phosphide (1/1/1)', 'Zirconium ruthenium phosphide (1/1/1)']}",-106.40582437,-8.867152030833333,-1.1220211002777785,"['xas', 'elasticity', 'bandstructure']",True,"[648038, 30727]",True,2021-05-12 10:56:16.728000,NM,12,9,mp-22268,,ZrPRu,"{'functional': 'PBE', 'labels': ['Zr_sv', 'P', 'Ru_pv'], 'pot_type': 'paw'}","{'Zr': 1.0, 'P': 1.0, 'Ru': 1.0}",GGA,mp-22268,"['mp-921696', 'mp-907212', 'mp-920689', 'mp-22268', 'mp-1102635', 'mp-1442687', 'mp-1677547', 'mp-1785321', 'mp-1602314']",3.01e-05,"{'Zr': 4.0, 'P': 4.0, 'Ru': 4.0}",186.21448765818843,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.46566233992512e-07,3.01e-05,0,0.0001204,MP,data/source/MP/cleaned/cifs/MP-mp-22268.cif,True,,data/final/MP/graphs/B0.1P0.9Ru1Zr1-MP-mp-22268-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Fe0.05P1Ru0.95Zr1,2,0.0333333333333333,4.0,False,Fe0.2P4Ru3.8Zr4,P4Ru4Zr4,10.3,Other,True,Fe1.667P33.333Ru31.667Zr33.333,Fe-P-Ru-Zr,4,Supercon,Zr1Ru0.95Fe0.05P1,MP-mp-22268,Zr4P4Ru4,P-Ru-Zr,P33.333Ru33.333Zr33.333,P n m a,orthorhombic,3.896771,6.476559,7.378435,data/final/MP/cifs/Fe0.05P1Ru0.95Zr1-MP-mp-22268-synth_doped.cif,data/source/MP/raw/cifs/mp-22268.cif,mp-22268,0.0,,2014-02-22 18:40:36,7.963823777103373,10.17188/1197495,"@misc{osti_1197495,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrPRu (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197495"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677547'}},0.0,7.91938263,520.0,-106.40582437,-8.867152030833333,"{'tags': ['Ruthenium zirconium phosphide (1/1/1)', 'Zirconium ruthenium phosphide (1/1/1)']}",-106.40582437,-8.867152030833333,-1.1220211002777785,"['xas', 'elasticity', 'bandstructure']",True,"[648038, 30727]",True,2021-05-12 10:56:16.728000,NM,12,9,mp-22268,,ZrPRu,"{'functional': 'PBE', 'labels': ['Zr_sv', 'P', 'Ru_pv'], 'pot_type': 'paw'}","{'Zr': 1.0, 'P': 1.0, 'Ru': 1.0}",GGA,mp-22268,"['mp-921696', 'mp-907212', 'mp-920689', 'mp-22268', 'mp-1102635', 'mp-1442687', 'mp-1677547', 'mp-1785321', 'mp-1602314']",3.01e-05,"{'Zr': 4.0, 'P': 4.0, 'Ru': 4.0}",186.21448765818843,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.46566233992512e-07,3.01e-05,0,0.0001204,MP,data/source/MP/cleaned/cifs/MP-mp-22268.cif,True,,data/final/MP/graphs/Fe0.05P1Ru0.95Zr1-MP-mp-22268-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ce0.2Ge12Pr0.8Pt4,3,0.0235294117647058,1.0,True,Ce0.2Ge12Pr0.8Pt4,Ge12Pr1Pt4,1.767,Heavy_fermion,True,Ce1.176Ge70.588Pr4.706Pt23.529,Ce-Ge-Pr-Pt,4,Supercon,Pr0.8Ce0.2Pt4Ge12,MP-mp-1105939,Pr1Ge12Pt4,Ge-Pr-Pt,Ge70.588Pr5.882Pt23.529,I m -3,cubic,7.560907531676135,7.560907530000001,7.56090753,data/final/MP/cifs/Ce0.2Ge12Pr0.8Pt4-MP-mp-1105939-synth_doped.cif,data/source/MP/raw/cifs/mp-1105939.cif,mp-1105939,0.0,,2018-07-19 06:58:09,8.947691530234051,,,{'GGA': {'task_id': 'mp-1705662'}},0.0059454020588258,4.25899828,520.0,-91.15368674,-5.361981572941176,{'tags': ['Praseodymium platinum germanide (1/4/12)']},-91.15368674,-5.361981572941176,-0.3889895585294119,['bandstructure'],True,[174554],True,2021-05-12 10:58:22.271000,NM,17,5,mp-1105939,,Pr(Ge3Pt)4,"{'functional': 'PBE', 'labels': ['Pr_3', 'Ge_d', 'Pt'], 'pot_type': 'paw'}","{'Pr': 1.0, 'Ge': 12.0, 'Pt': 4.0}",GGA,mp-1105939,"['mp-1105939', 'mp-1427343', 'mp-1705662', 'mp-1805701', 'mp-1584493']",0.0022709,"{'Pr': 1.0, 'Ge': 12.0, 'Pt': 4.0}",332.73607546662794,[],NM,False,204,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.824928727115922e-06,0.0022709,0,0.0022709,MP,data/source/MP/cleaned/cifs/MP-mp-1105939.cif,True,,data/final/MP/graphs/Ce0.2Ge12Pr0.8Pt4-MP-mp-1105939-synth_doped.json,0,True,m-3,2,0,0,0,0,0,0,0,0,1,0,1.0,False
La1Ni0.2Pt0.8Si1,3,0.1333333333333333,2.0,False,La2Ni0.4Pt1.6Si2,La2Pt2Si2,2.82,Other,True,La33.333Ni6.667Pt26.667Si33.333,La-Ni-Pt-Si,4,Supercon,La1Pt0.8Ni0.2Si1,MP-mp-1206485,La2Si2Pt2,La-Pt-Si,La33.333Pt33.333Si33.333,I 41 m d,tetragonal,4.277808001286174,4.277808001286175,7.94541446,data/final/MP/cifs/La1Ni0.2Pt0.8Si1-MP-mp-1206485-synth_doped.cif,data/source/MP/raw/cifs/mp-1206485.cif,mp-1206485,0.0,,2019-01-12 09:47:13.211000,8.943745313538361,,,{'GGA': {'task_id': 'mp-1734531'}},0.0,7.90579938,520.0,-39.77896993,-6.629828321666667,{'tags': ['LaPtSi']},-39.77896993,-6.629828321666667,-1.1287520433333331,['bandstructure'],True,[],True,2021-05-12 10:58:37.524000,NM,6,5,mp-1206485,,LaSiPt,"{'functional': 'PBE', 'labels': ['La', 'Si', 'Pt'], 'pot_type': 'paw'}","{'La': 1.0, 'Si': 1.0, 'Pt': 1.0}",GGA,mp-1206485,"['mp-1206485', 'mp-1387492', 'mp-1734531', 'mp-1788111', 'mp-1628393']",1.825e-05,"{'La': 2.0, 'Si': 2.0, 'Pt': 2.0}",134.4491846861766,[],NM,False,109,0,"[0, 0, 0, 0, 0, 0]",2.714780315343388e-07,1.825e-05,0,3.65e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1206485.cif,True,,data/final/MP/graphs/La1Ni0.2Pt0.8Si1-MP-mp-1206485-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,0,0,1,0,1.0,False
Os0.74W0.26,2,0.02,8.0,False,Os5.92W2.08,Os6W2,4.4,Other,True,Os74W26,Os-W,2,Supercon,Os0.74W0.26,MP-mp-1186374,Os6W2,Os-W,Os75W25,P 63/m m c,hexagonal,4.407165,5.567025997829749,5.56702605,data/final/MP/cifs/Os0.74W0.26-MP-mp-1186374-synth_doped.cif,data/source/MP/raw/cifs/mp-1186374.cif,mp-1186374,0.0,,2019-01-11 14:16:35.182000,21.184545858792507,,,{'GGA': {'task_id': 'mp-1753019'}},0.0,7.9158138,520.0,-93.7481822,-11.718522775,{'tags': []},-93.7481822,-11.718522775,-0.0584664662499996,['bandstructure'],True,[],True,2021-05-12 10:58:29.672000,NM,8,5,mp-1186374,,Os3W,"{'functional': 'PBE', 'labels': ['Os_pv', 'W_pv'], 'pot_type': 'paw'}","{'Os': 3.0, 'W': 1.0}",GGA,mp-1186374,"['mp-1186374', 'mp-1446191', 'mp-1753019', 'mp-1802622', 'mp-1619113']",0.0026669,"{'Os': 6.0, 'W': 2.0}",118.28684459635738,[],NM,False,187,0,"[-0.0, -0.0, -0.0, 0.0, 0.0, 0.0, -0.0, 0.0]",4.5092081187904586e-05,0.0026669,0,0.0053338,MP,data/source/MP/cleaned/cifs/MP-mp-1186374.cif,True,,data/final/MP/graphs/Os0.74W0.26-MP-mp-1186374-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Al0.62Ge0.38Nb3,3,0.06,2.0,False,Al1.24Ge0.76Nb6,Al1Ge1Nb6,17.2,Other,True,Al15.5Ge9.5Nb75,Al-Ge-Nb,3,Supercon,Nb3Al0.62Ge0.38,MP-mp-1220344,Nb6Al1Ge1,Al-Ge-Nb,Al12.5Ge12.5Nb75,P m -3,cubic,5.193789,5.193789,5.193789,data/final/MP/cifs/Al0.62Ge0.38Nb3-MP-mp-1220344-synth_doped.cif,data/source/MP/raw/cifs/mp-1220344.cif,mp-1220344,0.0,,2019-01-12 21:12:22.670000,7.787554520755366,,,{'GGA': {'task_id': 'mp-1754189'}},0.0456705447083347,5.7081774,520.0,-70.77042247,-8.84630280875,{'tags': []},-70.77042247,-8.84630280875,-0.2242485681249988,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,8,5,mp-1220344,,Nb6AlGe,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al', 'Ge_d'], 'pot_type': 'paw'}","{'Nb': 6.0, 'Al': 1.0, 'Ge': 1.0}",GGA,mp-1220344,"['mp-1220344', 'mp-1388432', 'mp-1754189', 'mp-1925908', 'mp-1619029']",0.0004952,"{'Nb': 6.0, 'Al': 1.0, 'Ge': 1.0}",140.10476523412882,[],NM,False,200,0,"[0, 0, 0, 0, 0, 0, 0, 0]",3.534497910706122e-06,0.0004952,0,0.0004952,MP,data/source/MP/cleaned/cifs/MP-mp-1220344.cif,True,,data/final/MP/graphs/Al0.62Ge0.38Nb3-MP-mp-1220344-synth_doped.json,0,True,m-3,2,0,0,0,0,0,0,1,0,0,0,1.0,False
B5Hf0.2Mo1.8,3,0.0571428571428571,1.0,True,B5Hf0.2Mo1.8,B5Mo2,8.4,Other,True,B71.429Hf2.857Mo25.714,B-Hf-Mo,3,Supercon,B5Hf0.2Mo1.8,MP-mp-7229,B5Mo2,B-Mo,B71.429Mo28.571,R -3 m,trigonal,3.086062143206312,3.086062143206312,7.38317517,data/final/MP/cifs/B5Hf0.2Mo1.8-MP-mp-7229-synth_doped.cif,data/source/MP/raw/cifs/mp-7229.cif,mp-7229,0.0,,2011-05-27 17:15:57,6.910597742884047,10.17188/1287525,"@misc{osti_1287525,
    author = ""Persson, Kristin"",
    title = ""Materials Data on B5Mo2 (SG:166) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1287525"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678538'}},0.4354736101190504,10.26159619,520.0,-54.63026953,-7.804324218571429,"{'tags': ['Molybdenum boride (2/5)', 'Molybdenum boride (1/2.5) - epsilon']}",-54.63026953,-7.804324218571429,0.0654250548809522,['bandstructure'],True,"[157530, 614795, 614810, 24282]",True,2021-05-12 10:58:55.498000,NM,7,11,mp-7229,,B5Mo2,"{'functional': 'PBE', 'labels': ['B', 'Mo_pv'], 'pot_type': 'paw'}","{'B': 5.0, 'Mo': 2.0}",GGA,mp-7229,"['mp-1001204', 'mp-7229', 'mp-1007569', 'mp-1077992', 'mp-1078025', 'mp-1078031', 'mp-1441558', 'mp-1678538', 'mp-1793658', 'mp-1012321', 'mp-1593525']",0.0189101,"{'B': 5.0, 'Mo': 2.0}",59.09541989544843,[],NM,False,166,0,"[0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0]",0.0003199926497426,0.0189101,0,0.0189101,MP,data/source/MP/cleaned/cifs/MP-mp-7229.cif,True,,data/final/MP/graphs/B5Hf0.2Mo1.8-MP-mp-7229-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Cu2Fe1Sr2Y1O7.51,2,0.0348459830325115,1.8640362183754997,False,Cu3.728Fe1.864Sr3.728Y1.864O14,Cu4Fe2Sr4Y2O14,53.5,Cuprate,True,Cu14.804Fe7.402Sr14.804Y7.402O55.58845299777943,Cu-Fe-Sr-Y-O,5,Supercon,Fe1Sr2Y1Cu2O7.51,MP-mvc-771,Sr4Y2Fe2Cu4O14,Cu-Fe-Sr-Y-O,Cu15.385Fe7.692Sr15.385Y7.692O53.84615384615385,I m a 2,orthorhombic,5.428009999807786,5.524618000554629,12.28734132,data/final/MP/cifs/Cu2Fe1Sr2Y1O7.51-MP-mvc-771-synth_doped.cif,data/source/MP/raw/cifs/mvc-771.cif,mvc-771,0.0,,2017-12-02 01:24:31,5.309669206142082,10.17188/1322699,"@misc{osti_1322699,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr2YFeCu2O7 (SG:46) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1322699"",
    place = ""United States"",
    year = ""2014"",
    month = ""9"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-1680490'}},0.0199638557692258,3.37539656,520.0,-169.36345348,-6.51397898,{'tags': []},-169.36345348,-6.51397898,-2.353624607307692,"['xas', 'bandstructure']",True,[],True,2021-05-12 10:58:07.127000,FM,26,8,mvc-771,oxide,Sr2YFeCu2O7,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Y_sv', 'Fe_pv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Y': 1.0, 'Fe': 1.0, 'Cu': 2.0, 'O': 7.0}",GGA+U,mvc-771,"['mvc-771', 'mp-1042547', 'mp-1042574', 'mp-1345426', 'mp-1655657', 'mp-1680490', 'mp-1836639', 'mp-1042570']",4.95893815,"{'Sr': 4.0, 'Y': 2.0, 'Fe': 2.0, 'Cu': 4.0, 'O': 14.0}",349.6910649548837,[],FM,True,5,5,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 4.2, 4.2, -0.0, -0.0, 0.0, 0.0, 0.2, 0.2, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0283618236035844,4.95893815,4,9.9178763,MP,data/source/MP/cleaned/cifs/MP-mvc-771.cif,True,,data/final/MP/graphs/Cu2Fe1Sr2Y1O7.51-MP-mvc-771-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,0,1,0,1.0,False
Ce0.016La0.984Sn3,2,0.008,1.0,True,Ce0.016La0.984Sn3,La1Sn3,4.33,Other,True,Ce0.4La24.6Sn75,Ce-La-Sn,3,Supercon,La0.9837Ce0.0163Sn3,MP-mp-633,La1Sn3,La-Sn,La25Sn75,P m -3 m,cubic,4.820061,4.820061,4.820061,data/final/MP/cifs/Ce0.016La0.984Sn3-MP-mp-633-synth_doped.cif,data/source/MP/raw/cifs/mp-633.cif,mp-633,0.0,,2011-05-13 04:30:54,7.340536659909055,10.17188/1279358,"@misc{osti_1279358,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaSn3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1279358"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688008'}},0.0,8.68748013,520.0,-19.26482408,-4.81620602,"{'tags': ['Lanthanum stannide (1/3)', 'Lanthanum tin (1/3)']}",-19.26482408,-4.81620602,-0.5750253525,"['xas', 'bandstructure']",True,"[641991, 104721, 641986, 261870, 104720, 151359, 642000, 641998, 191074]",True,2021-05-12 10:57:30.779000,NM,4,12,mp-633,,LaSn3,"{'functional': 'PBE', 'labels': ['La', 'Sn_d'], 'pot_type': 'paw'}","{'La': 1.0, 'Sn': 3.0}",GGA,mp-633,"['mp-991111', 'mp-993073', 'mp-633', 'mp-1066557', 'mp-1066573', 'mp-1066594', 'mp-1442023', 'mp-1688008', 'mp-1787436', 'mp-994393', 'mp-1590336', 'mp-1066601']",0.0055557,"{'La': 1.0, 'Sn': 3.0}",111.98441958300587,[],NM,False,221,0,"[0, 0, 0, 0]",4.961136576577034e-05,0.0055557,0,0.0055557,MP,data/source/MP/cleaned/cifs/MP-mp-633.cif,True,,data/final/MP/graphs/Ce0.016La0.984Sn3-MP-mp-633-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
B2La3N3Ni2,1,0.0,1.0,True,B2La3N3Ni2,B2La3N3Ni2,13.0325,Ferrite,True,B20La30N30Ni20,B-La-N-Ni,4,Supercon,La3Ni2B2N3,MP-mp-6114,La3Ni2B2N3,B-La-N-Ni,B20La30N30Ni20,I 4/m m m,tetragonal,3.767135999950148,3.7671359999501473,10.31581579,data/final/MP/cifs/B2La3N3Ni2-MP-mp-6114.cif,data/source/MP/raw/cifs/mp-6114.cif,mp-6114,0.0,,2011-05-14 09:55:00,7.018162978248144,10.17188/1277703,"@misc{osti_1277703,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La3Ni2B2N3 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277703"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1670967'}},0.0047344613333448,9.18991719,520.0,-75.091478,-7.509147799999999,{'tags': []},-75.091478,-7.509147799999999,-1.143791500833332,"['xas', 'bandstructure']",True,"[54042, 391192, 77938]",True,2021-05-12 10:57:28.836000,NM,10,8,mp-6114,,La3Ni2B2N3,"{'functional': 'PBE', 'labels': ['La', 'Ni_pv', 'B', 'N'], 'pot_type': 'paw'}","{'La': 3.0, 'Ni': 2.0, 'B': 2.0, 'N': 3.0}",GGA,mp-6114,"['mp-917367', 'mp-922470', 'mp-923256', 'mp-6114', 'mp-1300761', 'mp-1670967', 'mp-1921567', 'mp-1602393']",0.001032,"{'La': 3.0, 'Ni': 2.0, 'B': 2.0, 'N': 3.0}",141.4300924911967,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",7.296891218990306e-06,0.001032,0,0.001032,MP,data/source/MP/cleaned/cifs/MP-mp-6114.cif,False,,data/final/MP/graphs/B2La3N3Ni2-MP-mp-6114.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B12Lu0.065Zr0.935,2,0.0099999999999999,1.0,True,B12Lu0.065Zr0.935,B12Zr1,4.77,Other,True,B92.308Lu0.5Zr7.192,B-Lu-Zr,3,Supercon,Zr0.935Lu0.065B12,MP-mp-1084,Zr1B12,B-Zr,B92.308Zr7.692,F m -3 m,cubic,5.23882121,5.23882121,5.23882121,data/final/MP/cifs/B12Lu0.065Zr0.935-MP-mp-1084-synth_doped.cif,data/source/MP/raw/cifs/mp-1084.cif,mp-1084,0.0,,2011-05-13 01:55:40,3.608852766615364,10.17188/1187388,"@misc{osti_1187388,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrB12 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187388"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701270'}},0.0158721137179496,6.88737846,520.0,-91.45613101,-7.03508700076923,{'tags': ['Zirconium boride (1/12)']},-91.45613101,-7.03508700076923,-0.2119791638461532,"['xas', 'elasticity', 'bandstructure']",True,"[615764, 615752, 35363, 23861, 409634, 76257, 409635]",True,2021-05-12 10:56:10.715000,NM,13,8,mp-1084,,ZrB12,"{'functional': 'PBE', 'labels': ['Zr_sv', 'B'], 'pot_type': 'paw'}","{'Zr': 1.0, 'B': 12.0}",GGA,mp-1084,"['mp-922210', 'mp-1084', 'mp-907581', 'mp-921959', 'mp-1427051', 'mp-1701270', 'mp-1798000', 'mp-1593176']",1.76e-05,"{'Zr': 1.0, 'B': 12.0}",101.66833997602512,[],NM,False,225,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.7311190488750325e-07,1.76e-05,0,1.76e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1084.cif,True,,data/final/MP/graphs/B12Lu0.065Zr0.935-MP-mp-1084-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ce2S3,1,0.0,4.0,False,Ce8S12,Ce8S12,0.0,Heavy_fermion,True,Ce40S60,Ce-S,2,Supercon,Ce2S3,MP-mp-20973,Ce8S12,Ce-S,Ce40S60,P n m a,orthorhombic,4.039472,7.455474,15.456859,data/final/MP/cifs/Ce2S3-MP-mp-20973.cif,data/source/MP/raw/cifs/mp-20973.cif,mp-20973,0.0,,2014-02-23 01:45:05,5.371168141828418,10.17188/1196208,"@misc{osti_1196208,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ce2S3 (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196208"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1711394'}},0.0,7.37930432,520.0,-137.63541208,-6.881770604000001,"{'tags': ['Cerium sulfide (2/3)', 'Dicerium sulfide - A']}",-137.63541208,-6.881770604000001,-2.328465021875,"['xas', 'bandstructure']",True,"[89499, 622026]",True,2021-05-12 10:56:57.051000,FM,20,6,mp-20973,,Ce2S3,"{'functional': 'PBE', 'labels': ['Ce', 'S'], 'pot_type': 'paw'}","{'Ce': 2.0, 'S': 3.0}",GGA,mp-20973,"['mp-927032', 'mp-917582', 'mp-926516', 'mp-20973', 'mp-1504157', 'mp-1711394']",1.88577375,"{'Ce': 8.0, 'S': 12.0}",465.5015242254214,[],FM,True,62,2,"[0.9, 0.9, 0.9, 0.9, 0.8, 0.8, 0.8, 0.8, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.016204232655417,1.88577375,8,7.543095,MP,data/source/MP/cleaned/cifs/MP-mp-20973.cif,False,,data/final/MP/graphs/Ce2S3-MP-mp-20973.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
La0.1Os4Pr0.9Sb12,2,0.0117647058823529,1.0,True,La0.1Os4Pr0.9Sb12,Os4Pr1Sb12,1.7,Heavy_fermion,True,La0.588Os23.529Pr5.294Sb70.588,La-Os-Pr-Sb,4,Supercon,Pr0.9La0.1Os4Sb12,MP-mp-4251,Pr1Sb12Os4,Os-Pr-Sb,Os23.529Pr5.882Sb70.588,I m -3,cubic,8.16020751180899,8.16020751,8.16020751,data/final/MP/cifs/La0.1Os4Pr0.9Sb12-MP-mp-4251-synth_doped.cif,data/source/MP/raw/cifs/mp-4251.cif,mp-4251,0.0,,2011-05-15 09:44:04,9.380402650313032,10.17188/1208003,"@misc{osti_1208003,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Pr(Sb3Os)4 (SG:204) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208003"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700242'}},0.0086126564705901,7.28147826,520.0,-102.089288,-6.005252235294117,{'tags': ['Praseodymium osmium antimonide (1/4/12)']},-102.089288,-6.005252235294117,-0.1677005267647063,"['xas', 'elasticity', 'bandstructure']",True,"[155178, 155187, 165911, 155182, 155185, 155181, 647731, 155183, 155188, 155180, 155179, 165910, 155184, 155186, 183087]",True,2021-05-12 10:56:20.740000,NM,17,9,mp-4251,,Pr(Sb3Os)4,"{'functional': 'PBE', 'labels': ['Pr_3', 'Sb', 'Os_pv'], 'pot_type': 'paw'}","{'Pr': 1.0, 'Sb': 12.0, 'Os': 4.0}",GGA,mp-4251,"['mp-1000443', 'mp-1006919', 'mp-4251', 'mp-1188290', 'mp-1430112', 'mp-1700242', 'mp-1817791', 'mp-1011635', 'mp-1609307']",0.0526026,"{'Pr': 1.0, 'Sb': 12.0, 'Os': 4.0}",418.2940787754696,[],NM,False,204,0,"[-0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.000125755067234,0.0526026,0,0.0526026,MP,data/source/MP/cleaned/cifs/MP-mp-4251.cif,True,,data/final/MP/graphs/La0.1Os4Pr0.9Sb12-MP-mp-4251-synth_doped.json,0,True,m-3,2,0,0,0,0,0,0,0,0,1,0,1.0,False
B2Pr1Rh3,1,0.0,1.0,True,B2Pr1Rh3,B2Pr1Rh3,0.0,Heavy_fermion,True,B33.333Pr16.667Rh50,B-Pr-Rh,3,Supercon,Pr1Rh3B2,MP-mp-5369,Pr1B2Rh3,B-Pr-Rh,B33.333Pr16.667Rh50,P 6/m m m,hexagonal,3.118352,5.539014004196638,5.53901328,data/final/MP/cifs/B2Pr1Rh3-MP-mp-5369.cif,data/source/MP/raw/cifs/mp-5369.cif,mp-5369,0.0,,2011-05-13 09:57:34,9.44444178644721,10.17188/1263580,"@misc{osti_1263580,
    author = ""Persson, Kristin"",
    title = ""Materials Data on PrB2Rh3 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1263580"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677770'}},0.0,6.53149728,520.0,-44.04999814,-7.341666356666667,"{'tags': ['Rhodium praseodymium boride (3/1/2)', 'Praseodymium rhodium boride (1/3/2)']}",-44.04999814,-7.341666356666667,-0.6362319738888887,"['xas', 'bandstructure']",True,"[615198, 615193, 44550, 615187]",True,2021-05-12 10:57:10.838000,NM,6,8,mp-5369,,PrB2Rh3,"{'functional': 'PBE', 'labels': ['Pr_3', 'B', 'Rh_pv'], 'pot_type': 'paw'}","{'Pr': 1.0, 'B': 2.0, 'Rh': 3.0}",GGA,mp-5369,"['mp-910309', 'mp-925745', 'mp-926156', 'mp-5369', 'mp-1441285', 'mp-1677770', 'mp-1783576', 'mp-1594330']",0.0008931,"{'Pr': 1.0, 'B': 2.0, 'Rh': 3.0}",82.85536188944113,[],NM,False,191,0,"[-0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",1.0779024792526e-05,0.0008931,0,0.0008931,MP,data/source/MP/cleaned/cifs/MP-mp-5369.cif,False,,data/final/MP/graphs/B2Pr1Rh3-MP-mp-5369.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Cu2Sr2Tl1Y1O7,1,0.0,1.0,True,Cu2Sr2Tl1Y1O7,Cu2Sr2Tl1Y1O7,0.0,Cuprate,True,Cu15.385Sr15.385Tl7.692Y7.692O53.84615384615385,Cu-Sr-Tl-Y-O,5,Supercon,Tl1Sr2Y1Cu2O7,MP-mp-1218486,Sr2Y1Tl1Cu2O7,Cu-Sr-Tl-Y-O,Cu15.385Sr15.385Tl7.692Y7.692O53.84615384615385,P m m 2,orthorhombic,3.833755,3.847365,12.191786,data/final/MP/cifs/Cu2Sr2Tl1Y1O7-MP-mp-1218486.cif,data/source/MP/raw/cifs/mp-1218486.cif,mp-1218486,0.0,,2019-01-12 19:38:46.138000,6.534197370649527,,,{'GGA': {'task_id': 'mp-1720367'}},0.009972801490389,4.15074017,520.0,-79.46882872,-6.112986824615385,{'tags': []},-79.46882872,-6.112986824615385,-2.248891321410256,[],False,[],True,2021-05-12 11:00:42.526000,NM,13,4,mp-1218486,oxide,Sr2YTlCu2O7,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Y_sv', 'Tl_d', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Y': 1.0, 'Tl': 1.0, 'Cu': 2.0, 'O': 7.0}",GGA,mp-1218486,"['mp-1218486', 'mp-1405926', 'mp-1720367', 'mp-1833368']",0.0003878,"{'Sr': 2.0, 'Y': 1.0, 'Tl': 1.0, 'Cu': 2.0, 'O': 7.0}",179.827073320642,[],NM,False,25,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.156516217713949e-06,0.0003878,0,0.0003878,MP,data/source/MP/cleaned/cifs/MP-mp-1218486.cif,False,,data/final/MP/graphs/Cu2Sr2Tl1Y1O7-MP-mp-1218486.json,0,True,mm2,0,0,0,6,0,0,0,1,0,0,0,1.0,False
C0.98Mg1Ni3,2,0.0064257028112448,1.0,True,C0.98Mg1Ni3,C1Mg1Ni3,6.5,Other,True,C19.679Mg20.08Ni60.241,C-Mg-Ni,3,Supercon,Mg1C0.98Ni3,MP-mp-10700,Mg1Ni3C1,C-Mg-Ni,C20Mg20Ni60,P m -3 m,cubic,3.810209,3.810209,3.810209,data/final/MP/cifs/C0.98Mg1Ni3-MP-mp-10700-synth_doped.cif,data/source/MP/raw/cifs/mp-10700.cif,mp-10700,0.0,,2011-05-28 10:04:44,6.376007671789427,10.17188/1187303,"@misc{osti_1187303,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MgNi3C (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187303"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678621'}},0.0,6.64260176,520.0,-28.85099542,-5.770199084,{'tags': ['Magnesium nickel carbide (1/3/1)']},-28.85099542,-5.770199084,-0.1367049259999994,"['xas', 'elasticity', 'bandstructure']",True,[77152],True,2021-05-12 10:56:10.715000,NM,5,8,mp-10700,,MgNi3C,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Ni_pv', 'C'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",GGA,mp-10700,"['mp-927245', 'mp-927653', 'mp-911184', 'mp-10700', 'mp-1438083', 'mp-1678621', 'mp-1791467', 'mp-1591421']",0.0387875,"{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",55.31544309398296,[],NM,False,221,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",0.0007012056277683,0.0387875,0,0.0387875,MP,data/source/MP/cleaned/cifs/MP-mp-10700.cif,True,,data/final/MP/graphs/C0.98Mg1Ni3-MP-mp-10700-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Cu3Gd0.6Pr0.4O7,2,0.0153846153846153,2.0,False,Ba4Cu6Gd1.2Pr0.8O14,Ba4Cu6Gd1Pr1O14,20.9,Cuprate,True,Ba15.385Cu23.077Gd4.615Pr3.077O53.84615384615385,Ba-Cu-Gd-Pr-O,5,Supercon,Gd0.6Pr0.4Ba2Cu3O7,MP-mp-1228407,Ba4Pr1Gd1Cu6O14,Ba-Cu-Gd-Pr-O,Ba15.385Cu23.077Gd3.846Pr3.846O53.84615384615385,P m m m,orthorhombic,3.87425218,3.94743505,23.78525786,data/final/MP/cifs/Ba2Cu3Gd0.6Pr0.4O7-MP-mp-1228407-synth_doped.cif,data/source/MP/raw/cifs/mp-1228407.cif,mp-1228407,0.0,,2019-01-13 04:07:24.010000,6.631690218019455,,,,0.0335117883333344,3.22589413,520.0,-166.76646275,-6.4140947211538455,{'tags': []},-166.76646275,-6.4140947211538455,-2.15326399826923,[],False,[],True,2021-05-12 11:00:59.151000,FM,26,1,mp-1228407,oxide,Ba4PrGd(Cu3O7)2,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Pr_3', 'Gd', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 4.0, 'Pr': 1.0, 'Gd': 1.0, 'Cu': 6.0, 'O': 14.0}",GGA,mp-1228407,['mp-1228407'],6.9161964,"{'Ba': 4.0, 'Pr': 1.0, 'Gd': 1.0, 'Cu': 6.0, 'O': 14.0}",363.7564837421221,[],FM,True,47,1,"[-0.0, -0.0, -0.0, -0.0, -0.0, 6.9, -0.0, 0.0, -0.0, 0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0190132594444779,6.9161964,1,6.9161964,MP,data/source/MP/cleaned/cifs/MP-mp-1228407.cif,True,,data/final/MP/graphs/Ba2Cu3Gd0.6Pr0.4O7-MP-mp-1228407-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
N1S1,1,0.0,4.0,False,N4S4,N4S4,0.2175,Other,True,N50S50,N-S,2,Supercon,S1N1,MP-mp-235,S4N4,N-S,N50S50,P 1 21/c 1,monoclinic,4.533511,4.757116000000001,7.964977864086488,data/final/MP/cifs/N1S1-MP-mp-235.cif,data/source/MP/raw/cifs/mp-235.cif,mp-235,0.0,,2011-05-13 01:40:38,1.818160571155304,10.17188/1199553,"@misc{osti_1199553,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SN (SG:14) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199553"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695596'}},0.2541996769642853,2.12748735,520.0,-45.54288552,-5.69286069,"{'tags': ['Sulfur nitride (1/1) - beta', 'Sulfur nitride (1/1)']}",-45.54288552,-5.69286069,0.1116117059375003,"['xas', 'bandstructure']",True,"[41967, 4025, 41966]",True,2021-05-12 10:56:59.077000,NM,8,9,mp-235,,SN,"{'functional': 'PBE', 'labels': ['S', 'N'], 'pot_type': 'paw'}","{'S': 1.0, 'N': 1.0}",GGA,mp-235,"['mp-909815', 'mp-925365', 'mp-924833', 'mp-235', 'mp-559322', 'mp-1424455', 'mp-1695596', 'mp-1778327', 'mp-1589982']",7.5e-08,"{'S': 4.0, 'N': 4.0}",168.31045382545676,[],NM,False,14,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.782420480614409e-09,7.5e-08,0,3e-07,MP,data/source/MP/cleaned/cifs/MP-mp-235.cif,False,,data/final/MP/graphs/N1S1-MP-mp-235.json,0,True,2/m,0,0,3,0,0,0,0,1,0,0,0,1.0,False
B6Yb1,1,0.0,1.0,True,B6Yb1,B6Yb1,0.0,Heavy_fermion,True,B85.714Yb14.286,B-Yb,2,Supercon,B6Yb1,MP-mp-419,Yb1B6,B-Yb,B85.714Yb14.286,P m -3 m,cubic,4.128371,4.128371,4.128371,data/final/MP/cifs/B6Yb1-MP-mp-419.cif,data/source/MP/raw/cifs/mp-419.cif,mp-419,0.1059000000000001,,2011-05-12 19:42:38,5.614593733140208,10.17188/1207942,"@misc{osti_1207942,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YbB6 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207942"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1670773'}},0.0,4.12751371,520.0,-44.83859414,-6.405513448571428,"{'tags': ['Ytterbium boride (1/6)', 'Ytterbium octahedro-hexaboride']}",-44.83859414,-6.405513448571428,-0.4603764621428559,"['xas', 'elasticity', 'bandstructure']",True,"[659506, 615742, 615735, 615745, 615737, 615747, 615749, 150586]",True,2021-05-12 10:56:20.740000,NM,7,8,mp-419,,YbB6,"{'functional': 'PBE', 'labels': ['Yb_2', 'B'], 'pot_type': 'paw'}","{'Yb': 1.0, 'B': 6.0}",GGA,mp-419,"['mp-657124', 'mp-662066', 'mp-655428', 'mp-419', 'mp-1439165', 'mp-1670773', 'mp-1800392', 'mp-1590311']",5.75e-05,"{'Yb': 1.0, 'B': 6.0}",70.3616728039892,[],NM,False,221,0,"[0, 0, 0, 0, 0, 0, 0]",8.172062673976109e-07,5.75e-05,0,5.75e-05,MP,data/source/MP/cleaned/cifs/MP-mp-419.cif,False,,data/final/MP/graphs/B6Yb1-MP-mp-419.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
C1Cu1K0.1Sr1.9O5,2,0.0222222222222222,2.0,False,C2Cu2K0.2Sr3.8O10,C2Cu2Sr4O10,0.0,Cuprate,True,C11.111Cu11.111K1.111Sr21.111O55.55555555555556,C-Cu-K-Sr-O,5,Supercon,Sr1.9K0.1Cu1CO5,MP-mp-1147662,Sr4Cu2C2O10,C-Cu-Sr-O,C11.111Cu11.111Sr22.222O55.55555555555556,I -4 2 m,tetragonal,5.556718,5.556718,8.631809904721473,data/final/MP/cifs/C1Cu1K0.1Sr1.9O5-MP-mp-1147662-synth_doped.cif,data/source/MP/raw/cifs/mp-1147662.cif,mp-1147662,0.0,,2018-12-27 11:40:38.663000,4.629324765530757,,,,0.0444555886111093,3.36507303,520.0,-118.84575437,-6.602541909444444,{'tags': []},-118.84575437,-6.602541909444444,-2.3792330981481475,[],False,[],True,2021-05-12 10:59:37.456000,AFM,18,2,mp-1147662,oxide,Sr2CuCO5,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Cu_pv', 'C', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Cu': 1.0, 'C': 1.0, 'O': 5.0}",GGA,mp-1147662,"['mp-1147662', 'mp-1881214']",0.0031806,"{'Sr': 4.0, 'Cu': 2.0, 'C': 2.0, 'O': 10.0}",237.3114394242258,[],AFM,True,121,2,"[0.0, 0.0, 0.0, 0.0, 0.3, -0.3, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",2.6805281765741217e-05,0.0031806,2,0.0063612,MP,data/source/MP/cleaned/cifs/MP-mp-1147662.cif,True,,data/final/MP/graphs/C1Cu1K0.1Sr1.9O5-MP-mp-1147662-synth_doped.json,0,True,-42m,0,0,0,0,6,0,0,0,0,1,0,1.0,False
In1Sc2,1,0.0,2.0,False,In2Sc4,In2Sc4,0.0,Other,True,In33.333Sc66.667,In-Sc,2,Supercon,In1Sc2,MP-mp-31348,Sc4In2,In-Sc,In33.333Sc66.667,P 63/m m c,hexagonal,5.058461996095666,5.05846148,6.299803,data/final/MP/cifs/In1Sc2-MP-mp-31348.cif,data/source/MP/raw/cifs/mp-31348.cif,mp-31348,0.0,,2014-02-19 20:42:31,4.870411777856091,10.17188/1205598,"@misc{osti_1205598,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sc2In (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1205598"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695116'}},0.0,5.6595316,520.0,-33.07929237,-5.513215395,{'tags': ['Indium scandium (1/2)']},-33.07929237,-5.513215395,-0.3743414149999993,"['xas', 'elasticity', 'bandstructure']",True,[59522],True,2021-05-12 10:56:20.740000,FM,6,8,mp-31348,,Sc2In,"{'functional': 'PBE', 'labels': ['Sc_sv', 'In_d'], 'pot_type': 'paw'}","{'Sc': 2.0, 'In': 1.0}",GGA,mp-31348,"['mp-913901', 'mp-990745', 'mp-930615', 'mp-31348', 'mp-1429486', 'mp-1695116', 'mp-1860760', 'mp-1592901']",0.69945935,"{'Sc': 4.0, 'In': 2.0}",139.60292737292542,[],FM,True,194,2,"[0.3, 0.3, 0.0, 0.0, 0.0, 0.0]",0.0100206974619022,0.69945935,2,1.3989187,MP,data/source/MP/cleaned/cifs/MP-mp-31348.cif,False,,data/final/MP/graphs/In1Sc2-MP-mp-31348.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ce1Rh2,1,0.0,2.0,False,Ce2Rh4,Ce2Rh4,0.0,Heavy_fermion,True,Ce33.333Rh66.667,Ce-Rh,2,Supercon,Ce1Rh2,MP-mp-951,Ce2Rh4,Ce-Rh,Ce33.333Rh66.667,F d -3 m,cubic,5.36749767,5.367497669999999,5.367497669999999,data/final/MP/cifs/Ce1Rh2-MP-mp-951.cif,data/source/MP/raw/cifs/mp-951.cif,mp-951,0.0,,2011-05-14 01:10:07,10.506618373501276,10.17188/1313293,"@misc{osti_1313293,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeRh2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1313293"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671914'}},0.0,8.05481536,520.0,-45.60224681,-7.600374468333332,{'tags': ['Cerium rhodium (1/2)']},-45.60224681,-7.600374468333332,-0.7131395033333329,"['xas', 'elasticity', 'bandstructure']",True,"[621935, 621924, 621941, 102267, 621927, 106424, 621938, 102268]",True,2021-05-12 10:56:35.166000,FM,6,8,mp-951,,CeRh2,"{'functional': 'PBE', 'labels': ['Ce', 'Rh_pv'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Rh': 2.0}",GGA,mp-951,"['mp-941157', 'mp-934660', 'mp-941487', 'mp-951', 'mp-1438983', 'mp-1671914', 'mp-1789751', 'mp-1596578']",0.3485793,"{'Ce': 2.0, 'Rh': 4.0}",109.34541967194605,[],FM,True,227,1,"[0.3, 0.3, 0.0, 0.0, 0.0, 0.0]",0.0063757457979638,0.3485793,2,0.6971586,MP,data/source/MP/cleaned/cifs/MP-mp-951.cif,False,,data/final/MP/graphs/Ce1Rh2-MP-mp-951.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ce1In5Ir0.987Pt0.013,2,0.0037142857142857,1.0,True,Ce1In5Ir0.987Pt0.013,Ce1In5Ir1,0.897,Heavy_fermion,True,Ce14.286In71.429Ir14.1Pt0.186,Ce-In-Ir-Pt,4,Supercon,Ce1Ir0.987Pt0.013In5,MP-mp-20975,Ce1In5Ir1,Ce-In-Ir,Ce14.286In71.429Ir14.286,P 4/m m m,tetragonal,4.724199,4.724199,7.575801,data/final/MP/cifs/Ce1In5Ir0.987Pt0.013-MP-mp-20975-synth_doped.cif,data/source/MP/raw/cifs/mp-20975.cif,mp-20975,0.0,,2014-02-21 16:15:16,8.902153726103897,10.17188/1196209,"@misc{osti_1196209,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeIn5Ir (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196209"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688300'}},0.0,8.1498488,520.0,-31.20695684,-4.458136691428572,{'tags': ['Cerium iridium indide (1/1/5)']},-31.20695684,-4.458136691428572,-0.3824312307142854,"['xas', 'bandstructure']",True,[150225],True,2021-05-12 10:56:57.051000,FM,7,8,mp-20975,,CeIn5Ir,"{'functional': 'PBE', 'labels': ['Ce', 'In_d', 'Ir'], 'pot_type': 'paw'}","{'Ce': 1.0, 'In': 5.0, 'Ir': 1.0}",GGA,mp-20975,"['mp-919528', 'mp-918523', 'mp-905302', 'mp-20975', 'mp-1300982', 'mp-1688300', 'mp-1832383', 'mp-1591628']",0.1040192,"{'Ce': 1.0, 'In': 5.0, 'Ir': 1.0}",169.077152414387,[],FM,True,123,1,"[0.1, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0006152173638757,0.1040192,1,0.1040192,MP,data/source/MP/cleaned/cifs/MP-mp-20975.cif,True,,data/final/MP/graphs/Ce1In5Ir0.987Pt0.013-MP-mp-20975-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Cu0.1Ho1Ru0.9Sr2O6,2,0.0199999999999999,2.0,False,Cu0.2Ho2Ru1.8Sr4O12,Ho2Ru2Sr4O12,30.0,Cuprate,True,Cu1Ho10Ru9Sr20O60,Cu-Ho-Ru-Sr-O,5,Supercon,Sr2Ho1Ru0.9Cu0.1O6,MP-mp-6676,Sr4Ho2Ru2O12,Ho-Ru-Sr-O,Ho10Ru10Sr20O60,P 1 21/c 1,monoclinic,5.805209,5.862911,8.232547295801396,data/final/MP/cifs/Cu0.1Ho1Ru0.9Sr2O6-MP-mp-6676-synth_doped.cif,data/source/MP/raw/cifs/mp-6676.cif,mp-6676,0.0,,2011-05-16 18:49:04,6.367783135981076,10.17188/1281550,"@misc{osti_1281550,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr2HoRuO6 (SG:14) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281550"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1708450'}},0.0,3.19180573,520.0,-142.98501423,-7.1492507115,"{'tags': ['Distrontium holmium ruthenium(V) hexaoxide', 'Distrontium holmium ruthenium(V) oxide', 'Distrontium holmium ruthenium hexaoxide']}",-142.98501423,-7.1492507115,-2.869095565333333,"['xas', 'bandstructure']",True,"[90655, 90654, 188478, 164512, 90653, 185614, 93360]",True,2021-05-12 10:57:32.679000,FM,20,11,mp-6676,oxide,Sr2HoRuO6,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ho_3', 'Ru_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ho': 1.0, 'Ru': 1.0, 'O': 6.0}",GGA,mp-6676,"['mp-927031', 'mp-910807', 'mp-926644', 'mp-6676', 'mp-1188965', 'mp-1189815', 'mp-1237422', 'mp-1414773', 'mp-1708450', 'mp-1923733', 'mp-1603423']",2.9996671,"{'Sr': 4.0, 'Ho': 2.0, 'Ru': 2.0, 'O': 12.0}",280.19250735196414,[],FM,True,14,1,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 2.0, 2.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0214114726217997,2.9996671,2,5.9993342,MP,data/source/MP/cleaned/cifs/MP-mp-6676.cif,True,,data/final/MP/graphs/Cu0.1Ho1Ru0.9Sr2O6-MP-mp-6676-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,1,0,0,0,1.0,False
Co0.44Mo0.56,3,0.12,2.0,False,Co0.88Mo1.12,Co1Mo1,13.0,Other,True,Co44Mo56,Co-Mo,2,Supercon,Co0.44Mo0.56,MP-mp-1226002,Co1Mo1,Co-Mo,Co50Mo50,P -6 m 2,hexagonal,2.6949280049098028,2.69492791,4.183618,data/final/MP/cifs/Co0.44Mo0.56-MP-mp-1226002-synth_doped.cif,data/source/MP/raw/cifs/mp-1226002.cif,mp-1226002,0.0,,2019-01-13 02:02:02.302000,9.773461076493708,,,{'GGA': {'task_id': 'mp-1675345'}},0.2398282608333346,7.13091133,520.0,-17.54453254,-8.77226627,{'tags': []},-17.54453254,-8.77226627,0.2047141425000003,['bandstructure'],True,[],True,2021-05-12 10:58:45.495000,FiM,2,5,mp-1226002,,CoMo,"{'functional': 'PBE', 'labels': ['Co', 'Mo_pv'], 'pot_type': 'paw'}","{'Co': 1.0, 'Mo': 1.0}",GGA,mp-1226002,"['mp-1226002', 'mp-1428021', 'mp-1675345', 'mp-1792281', 'mp-1611748']",0.3620178,"{'Co': 1.0, 'Mo': 1.0}",26.31339999759044,[],FiM,True,187,2,"[0.4, -0.1]",0.0137579256209061,0.3620178,2,0.3620178,MP,data/source/MP/cleaned/cifs/MP-mp-1226002.cif,True,,data/final/MP/graphs/Co0.44Mo0.56-MP-mp-1226002-synth_doped.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Bi1K0.75La0.25O3,3,0.1,1.0,True,Bi1K0.75La0.25O3,Bi1K1O3,12.2,Oxide,True,Bi20K15La5O60,Bi-K-La-O,4,Supercon,K0.75La0.25Bi1O3,MP-mp-982040,K1Bi1O3,Bi-K-O,Bi20K20O60,P m -3 m,cubic,4.284204,4.284204,4.284204,data/final/MP/cifs/Bi1K0.75La0.25O3-MP-mp-982040-synth_doped.cif,data/source/MP/raw/cifs/mp-982040.cif,mp-982040,0.0,,2015-10-12 11:25:13,6.252348761231978,10.17188/1316390,"@misc{osti_1316390,
    author = ""Persson, Kristin"",
    title = ""Materials Data on KBiO3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1316390"",
    place = ""United States"",
    year = ""2016"",
    month = ""9"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1717462'}},0.0928686834999998,1.80216133,520.0,-25.20286901,-5.040573802,{'tags': []},-25.20286901,-5.040573802,-1.4839105476,"['xas', 'elasticity']",False,[],True,2021-05-12 10:56:37.246000,NM,5,9,mp-982040,oxide,KBiO3,"{'functional': 'PBE', 'labels': ['K_sv', 'Bi', 'O'], 'pot_type': 'paw'}","{'K': 1.0, 'Bi': 1.0, 'O': 3.0}",GGA,mp-982040,"['mp-982222', 'mp-1006156', 'mp-982040', 'mp-1006117', 'mp-1431172', 'mp-1717462', 'mp-1798749', 'mp-1011221', 'mp-1585048']",0.0005425,"{'K': 1.0, 'Bi': 1.0, 'O': 3.0}",78.63401066432932,[],NM,False,221,0,"[0, 0, 0, 0, 0]",6.899050365315956e-06,0.0005425,0,0.0005425,MP,data/source/MP/cleaned/cifs/MP-mp-982040.cif,True,,data/final/MP/graphs/Bi1K0.75La0.25O3-MP-mp-982040-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Rh2Sr1,1,0.0,2.0,False,Rh4Sr2,Rh4Sr2,6.2,Other,True,Rh66.667Sr33.333,Rh-Sr,2,Supercon,Rh2Sr1,MP-mp-1328,Sr2Rh4,Rh-Sr,Rh66.667Sr33.333,F d -3 m,cubic,5.50163158,5.50163158,5.50163158,data/final/MP/cifs/Rh2Sr1-MP-mp-1328.cif,data/source/MP/raw/cifs/mp-1328.cif,mp-1328,0.0,,2011-05-13 22:57:49,8.276096981224457,10.17188/1189497,"@misc{osti_1189497,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SrRh2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189497"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699817'}},0.0,4.35548917,520.0,-34.42441637,-5.7374027283333335,{'tags': ['Rhodium strontium (2/1)']},-34.42441637,-5.7374027283333335,-0.2646996638888896,"['xas', 'elasticity', 'bandstructure']",True,"[105937, 650413]",True,2021-05-12 10:56:12.755000,NM,6,8,mp-1328,,SrRh2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Rh_pv'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Rh': 2.0}",GGA,mp-1328,"['mp-929500', 'mp-929130', 'mp-912793', 'mp-1328', 'mp-1429059', 'mp-1699817', 'mp-1805181', 'mp-1591994']",0.0004612,"{'Sr': 2.0, 'Rh': 4.0}",117.74962037223854,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",7.833570903108163e-06,0.0004612,0,0.0009224,MP,data/source/MP/cleaned/cifs/MP-mp-1328.cif,False,,data/final/MP/graphs/Rh2Sr1-MP-mp-1328.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ba2Cu3Y0.7Zn0.3O7,3,0.0461538461538461,1.0,True,Ba2Cu3Y0.7Zn0.3O7,Ba2Cu3Y1O7,23.5,Cuprate,True,Ba15.385Cu23.077Y5.385Zn2.308O53.84615384615385,Ba-Cu-Y-Zn-O,5,Supercon,Y0.7Zn0.3Ba2Cu3O7,MP-mp-20674,Ba2Y1Cu3O7,Ba-Cu-Y-O,Ba15.385Cu23.077Y7.692O53.84615384615385,P m m m,orthorhombic,3.844668,3.926152,11.823664,data/final/MP/cifs/Ba2Cu3Y0.7Zn0.3O7-MP-mp-20674-synth_doped.cif,data/source/MP/raw/cifs/mp-20674.cif,mp-20674,0.0,,2014-02-22 18:23:22,6.198285186087997,10.17188/1195834,"@misc{osti_1195834,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2YCu3O7 (SG:47) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195834"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686609'}},0.0313759126602519,3.28295453,520.0,-80.7708035,-6.213138730769231,"{'tags': ['Yttrium barium copper oxide (1/2/3/7)', 'Dibarium yttrium dicopper copper(III) oxide', 'Yttrium barium copper oxide (1/2/3/6.93)', 'Dibarium yttrium copper(III) dicopper oxide', 'High pressure experimental phase', 'Yttrium dibarium dicopper copper(III) oxide']}",-80.7708035,-6.213138730769231,-2.180157206282052,"['xas', 'elasticity', 'bandstructure']",True,"[196266, 196264, 196265, 71423, 66620, 63483, 66621, 164530, 56507, 63487, 66602, 66601, 68394, 63486, 63485, 202774, 62466, 62465, 41646, 65224, 202773, 66600, 63335, 66611, 78598, 66617, 81175, 66610, 66619, 66615, 63484, 86958, 262809, 66609, 184677, 202775, 66616, 63488, 66618, 66623, 202771, 66622, 202772, 77737, 202770, 62928, 77745]",True,2021-05-12 10:56:14.760000,NM,13,14,mp-20674,oxide,Ba2YCu3O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Cu': 3.0, 'O': 7.0}",GGA,mp-20674,"['mp-923155', 'mp-917354', 'mp-922372', 'mp-20674', 'mp-1103385', 'mp-1103741', 'mp-1103748', 'mp-1104329', 'mp-1104589', 'mp-1440689', 'mp-1686609', 'mp-1832558', 'mp-1596594', 'mp-1592890']",0.0001806,"{'Ba': 2.0, 'Y': 1.0, 'Cu': 3.0, 'O': 7.0}",178.47526348558395,[],NM,False,47,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.0119049355799813e-06,0.0001806,0,0.0001806,MP,data/source/MP/cleaned/cifs/MP-mp-20674.cif,True,,data/final/MP/graphs/Ba2Cu3Y0.7Zn0.3O7-MP-mp-20674-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Cd0.06Cu0.94Se2,2,0.04,2.0,False,Cd0.12Cu1.88Se4,Cu2Se4,1.3,Other,True,Cd2Cu31.333Se66.667,Cd-Cu-Se,3,Supercon,Cd0.06Cu0.94Se2,MP-mp-2000,Cu2Se4,Cu-Se,Cu33.333Se66.667,P n n m,orthorhombic,3.810957,5.042092,6.218563,data/final/MP/cifs/Cd0.06Cu0.94Se2-MP-mp-2000-synth_doped.cif,data/source/MP/raw/cifs/mp-2000.cif,mp-2000,0.0,,2011-05-13 07:33:00,6.155329443959485,10.17188/1195176,"@misc{osti_1195176,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CuSe2 (SG:58) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195176"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677388'}},0.0,4.65801852,520.0,-22.68152542,-3.7802542366666665,"{'tags': ['Copper selenide (1/2)', 'Copper perselenide']}",-22.68152542,-3.7802542366666665,-0.3979110282291659,"['xas', 'elasticity', 'bandstructure']",True,"[25717, 629028, 629033, 242, 42118]",True,2021-05-12 10:56:14.760000,NM,6,8,mp-2000,,CuSe2,"{'functional': 'PBE', 'labels': ['Cu_pv', 'Se'], 'pot_type': 'paw'}","{'Cu': 1.0, 'Se': 2.0}",GGA,mp-2000,"['mp-927045', 'mp-926524', 'mp-917599', 'mp-2000', 'mp-1437988', 'mp-1677388', 'mp-1786066', 'mp-1594435']",0.0005509,"{'Cu': 2.0, 'Se': 4.0}",119.49090565234614,[],NM,False,58,0,"[0, 0, 0, 0, 0, 0]",9.22078541446193e-06,0.0005509,0,0.0011018,MP,data/source/MP/cleaned/cifs/MP-mp-2000.cif,True,,data/final/MP/graphs/Cd0.06Cu0.94Se2-MP-mp-2000-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
C1Re2W3,1,0.0,4.0,False,C4Re8W12,C4Re8W12,0.0,Other,True,C16.667Re33.333W50,C-Re-W,3,Supercon,C1Re2W3,MP-mp-16877,Re8W12C4,C-Re-W,C16.667Re33.333W50,P 41 3 2,cubic,6.957225,6.957225,6.957225,data/final/MP/cifs/C1Re2W3-MP-mp-16877.cif,data/source/MP/raw/cifs/mp-16877.cif,mp-16877,0.0,,2014-02-14 17:56:45,18.460826109271995,10.17188/1192218,"@misc{osti_1192218,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Re2W3C (SG:213) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1192218"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1708312'}},0.067405733750002,7.58482036,520.0,-291.32425271,-12.138510529583334,"{'tags': ['Rhenium tungsten carbide (2/3/1)', 'Tungsten rhenium carbide (3/2/1)']}",-291.32425271,-12.138510529583334,0.0265252170833344,"['xas', 'bandstructure']",True,"[618714, 77384]",True,2021-05-12 10:56:55.092000,NM,24,9,mp-16877,,Re2W3C,"{'functional': 'PBE', 'labels': ['Re_pv', 'W_pv', 'C'], 'pot_type': 'paw'}","{'Re': 2.0, 'W': 3.0, 'C': 1.0}",GGA,mp-16877,"['mp-911210', 'mp-927805', 'mp-927279', 'mp-16877', 'mp-1115876', 'mp-1504657', 'mp-1708312', 'mp-1809193', 'mp-1630103']",0.000340875,"{'Re': 8.0, 'W': 12.0, 'C': 4.0}",336.7504204476808,[],NM,False,213,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.048992717477067e-06,0.000340875,0,0.0013635,MP,data/source/MP/cleaned/cifs/MP-mp-16877.cif,False,,data/final/MP/graphs/C1Re2W3-MP-mp-16877.json,0,True,432,4,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Cu3Pr0.8Sm0.2O7,3,0.0307692307692307,1.0,True,Ba2Cu3Pr0.8Sm0.2O7,Ba2Cu3Pr1O7,0.0,Cuprate,True,Ba15.385Cu23.077Pr6.154Sm1.538O53.84615384615385,Ba-Cu-Pr-Sm-O,5,Supercon,Sm0.2Pr0.8Ba2Cu3O7,MP-mp-20936,Ba2Pr1Cu3O7,Ba-Cu-Pr-O,Ba15.385Cu23.077Pr7.692O53.84615384615385,P m m m,orthorhombic,3.903923,3.95568,11.916432,data/final/MP/cifs/Ba2Cu3Pr0.8Sm0.2O7-MP-mp-20936-synth_doped.cif,data/source/MP/raw/cifs/mp-20936.cif,mp-20936,0.0,,2014-02-22 14:41:55,6.480717836004672,10.17188/1196129,"@misc{osti_1196129,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2PrCu3O7 (SG:47) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196129"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698257'}},0.0256000172756332,3.18514576,520.0,-78.62827906,-6.048329158461538,"{'tags': ['Dibarium praseodymium tricopper heptaoxide', 'Praseodymium dibarium dicopper copper(III) oxide', 'Praseodymium dibarium tricopper heptaoxide', 'Praseodymium dibarium copper(III) dicopper oxide']}",-78.62827906,-6.048329158461538,-2.145007016153845,"['xas', 'bandstructure']",True,"[41452, 94377, 81168, 173910, 89221]",True,2021-05-12 10:56:57.051000,NM,13,8,mp-20936,oxide,Ba2PrCu3O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Pr_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Pr': 1.0, 'Cu': 3.0, 'O': 7.0}",GGA,mp-20936,"['mp-988090', 'mp-987725', 'mp-20936', 'mp-1417367', 'mp-1698257', 'mp-1833655', 'mp-988324', 'mp-1602318']",0.0007234,"{'Ba': 2.0, 'Pr': 1.0, 'Cu': 3.0, 'O': 7.0}",184.02152853403555,[],NM,False,47,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.931061793491212e-06,0.0007234,0,0.0007234,MP,data/source/MP/cleaned/cifs/MP-mp-20936.cif,True,,data/final/MP/graphs/Ba2Cu3Pr0.8Sm0.2O7-MP-mp-20936-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
C1Mg1Mn0.03Ni2.97,2,0.0119999999999999,1.0,True,C1Mg1Mn0.03Ni2.97,C1Mg1Ni3,0.0,Other,True,C20Mg20Mn0.6Ni59.4,C-Mg-Mn-Ni,4,Supercon,Mg1C1Ni2.97Mn0.03,MP-mp-10700,Mg1Ni3C1,C-Mg-Ni,C20Mg20Ni60,P m -3 m,cubic,3.810209,3.810209,3.810209,data/final/MP/cifs/C1Mg1Mn0.03Ni2.97-MP-mp-10700-synth_doped.cif,data/source/MP/raw/cifs/mp-10700.cif,mp-10700,0.0,,2011-05-28 10:04:44,6.376007671789427,10.17188/1187303,"@misc{osti_1187303,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MgNi3C (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187303"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678621'}},0.0,6.64260176,520.0,-28.85099542,-5.770199084,{'tags': ['Magnesium nickel carbide (1/3/1)']},-28.85099542,-5.770199084,-0.1367049259999994,"['xas', 'elasticity', 'bandstructure']",True,[77152],True,2021-05-12 10:56:10.715000,NM,5,8,mp-10700,,MgNi3C,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Ni_pv', 'C'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",GGA,mp-10700,"['mp-927245', 'mp-927653', 'mp-911184', 'mp-10700', 'mp-1438083', 'mp-1678621', 'mp-1791467', 'mp-1591421']",0.0387875,"{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",55.31544309398296,[],NM,False,221,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",0.0007012056277683,0.0387875,0,0.0387875,MP,data/source/MP/cleaned/cifs/MP-mp-10700.cif,True,,data/final/MP/graphs/C1Mg1Mn0.03Ni2.97-MP-mp-10700-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
C1Fe0.033Mg1Ni2.967,2,0.0131999999999999,1.0,True,C1Fe0.033Mg1Ni2.967,C1Mg1Ni3,4.9,Other,True,C20Fe0.66Mg20Ni59.34,C-Fe-Mg-Ni,4,Supercon,Mg1C1Ni2.967Fe0.033,MP-mp-10700,Mg1Ni3C1,C-Mg-Ni,C20Mg20Ni60,P m -3 m,cubic,3.810209,3.810209,3.810209,data/final/MP/cifs/C1Fe0.033Mg1Ni2.967-MP-mp-10700-synth_doped.cif,data/source/MP/raw/cifs/mp-10700.cif,mp-10700,0.0,,2011-05-28 10:04:44,6.376007671789427,10.17188/1187303,"@misc{osti_1187303,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MgNi3C (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187303"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678621'}},0.0,6.64260176,520.0,-28.85099542,-5.770199084,{'tags': ['Magnesium nickel carbide (1/3/1)']},-28.85099542,-5.770199084,-0.1367049259999994,"['xas', 'elasticity', 'bandstructure']",True,[77152],True,2021-05-12 10:56:10.715000,NM,5,8,mp-10700,,MgNi3C,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Ni_pv', 'C'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",GGA,mp-10700,"['mp-927245', 'mp-927653', 'mp-911184', 'mp-10700', 'mp-1438083', 'mp-1678621', 'mp-1791467', 'mp-1591421']",0.0387875,"{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",55.31544309398296,[],NM,False,221,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",0.0007012056277683,0.0387875,0,0.0387875,MP,data/source/MP/cleaned/cifs/MP-mp-10700.cif,True,,data/final/MP/graphs/C1Fe0.033Mg1Ni2.967-MP-mp-10700-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
As0.2Fe1La1P0.8O1,3,0.0999999999999999,2.0,False,As0.4Fe2La2P1.6O2,Fe2La2P2O2,11.42,Ferrite,True,As5Fe25La25P20O25,As-Fe-La-P-O,5,Supercon,La1Fe1As0.2P0.8O1,MP-mp-510668,La2Fe2P2O2,Fe-La-P-O,Fe25La25P25O25,P 4/n m m,tetragonal,4.068879,4.068879,9.084981,data/final/MP/cifs/As0.2Fe1La1P0.8O1-MP-mp-510668-synth_doped.cif,data/source/MP/raw/cifs/mp-510668.cif,mp-510668,0.0,,2014-02-26 04:17:37,5.337337070142887,,,{'GGA+U': {'task_id': 'mp-1704083'}},0.3903949226041714,6.29241646,520.0,-55.52669053,-6.94083631625,{'tags': []},-55.52669053,-6.94083631625,-1.734766549583334,"['xas', 'bandstructure']",True,"[162724, 420381, 391428]",True,2021-05-12 10:57:15.388000,FM,8,7,mp-510668,oxide,LaFePO,"{'functional': 'PBE', 'labels': ['La', 'Fe_pv', 'P', 'O'], 'pot_type': 'paw'}","{'La': 1.0, 'Fe': 1.0, 'P': 1.0, 'O': 1.0}",GGA+U,mp-510668,"['mp-542977', 'mp-510668', 'mp-1422599', 'mp-1704083', 'mp-1768909', 'mp-1779846', 'mp-1595432']",3.95130975,"{'La': 2.0, 'Fe': 2.0, 'P': 2.0, 'O': 2.0}",150.40891327693348,[],FM,True,129,1,"[0.0, 0.0, 3.7, 3.7, 0.0, 0.0, 0.0, 0.0]",0.0525408988591631,3.95130975,2,7.9026195,MP,data/source/MP/cleaned/cifs/MP-mp-510668.cif,True,,data/final/MP/graphs/As0.2Fe1La1P0.8O1-MP-mp-510668-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B2Lu1Os3,1,0.0,1.0,True,B2Lu1Os3,B2Lu1Os3,4.655,Other,True,B33.333Lu16.667Os50,B-Lu-Os,3,Supercon,Lu1Os3B2,MP-mp-2880,Lu1B2Os3,B-Lu-Os,B33.333Lu16.667Os50,P 6/m m m,hexagonal,3.031391,5.519706004788335,5.51970547,data/final/MP/cifs/B2Lu1Os3-MP-mp-2880.cif,data/source/MP/raw/cifs/mp-2880.cif,mp-2880,0.0,,2011-05-13 07:05:51,15.929347425938245,10.17188/1202854,"@misc{osti_1202854,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LuB2Os3 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1202854"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695723'}},0.0795813883333416,6.68748598,520.0,-53.63737556,-8.939562593333333,{'tags': ['Lutetium osmium boride (1/3/2)']},-53.63737556,-8.939562593333333,-0.3459237888888893,"['xas', 'elasticity', 'bandstructure']",True,"[614694, 44435]",True,2021-05-12 10:56:18.721000,NM,6,8,mp-2880,,LuB2Os3,"{'functional': 'PBE', 'labels': ['Lu_3', 'B', 'Os_pv'], 'pot_type': 'paw'}","{'Lu': 1.0, 'B': 2.0, 'Os': 3.0}",GGA,mp-2880,"['mp-1007262', 'mp-1000802', 'mp-2880', 'mp-1441844', 'mp-1695723', 'mp-1799193', 'mp-1012039', 'mp-1591160']",0.0031862,"{'Lu': 1.0, 'B': 2.0, 'Os': 3.0}",79.98424043455356,[],NM,False,191,0,"[0, 0, 0, 0, 0, 0]",3.9835347347044974e-05,0.0031862,0,0.0031862,MP,data/source/MP/cleaned/cifs/MP-mp-2880.cif,False,,data/final/MP/graphs/B2Lu1Os3-MP-mp-2880.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Se1Th1,1,0.0,1.0,True,Se1Th1,Se1Th1,0.0,Other,True,Se50Th50,Se-Th,2,Supercon,Se1Th1,MP-mp-2183,Th1Se1,Se-Th,Se50Th50,F m -3 m,cubic,4.20527575,4.20527575,4.20527575,data/final/MP/cifs/Se1Th1-MP-mp-2183.cif,data/source/MP/raw/cifs/mp-2183.cif,mp-2183,0.0,,2011-05-12 18:22:30,9.820607153741454,10.17188/1197183,"@misc{osti_1197183,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ThSe (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197183"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671150'}},0.0,7.8591734,520.0,-14.00855213,-7.004276065,"{'tags': ['Thorium(II) selenide', 'Thorium selenide (1/1)', 'Thorium selenide']}",-14.00855213,-7.004276065,-1.7853912011718744,"['xas', 'elasticity', 'bandstructure']",True,"[26653, 652030, 652018, 652023, 652031, 52444]",True,2021-05-12 10:56:16.728000,NM,2,8,mp-2183,,ThSe,"{'functional': 'PBE', 'labels': ['Th', 'Se'], 'pot_type': 'paw'}","{'Th': 1.0, 'Se': 1.0}",GGA,mp-2183,"['mp-911059', 'mp-927158', 'mp-926641', 'mp-2183', 'mp-1442214', 'mp-1671150', 'mp-1792954', 'mp-1595190']",8.05e-05,"{'Th': 1.0, 'Se': 1.0}",52.58579435896317,[],NM,False,225,0,"[0, 0]",1.5308316814706232e-06,8.05e-05,0,8.05e-05,MP,data/source/MP/cleaned/cifs/MP-mp-2183.cif,False,,data/final/MP/graphs/Se1Th1-MP-mp-2183.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ga0.222V0.778,3,0.056,8.0,False,Ga1.776V6.224,Ga2V6,12.3,Other,True,Ga22.2V77.8,Ga-V,2,Supercon,Ga0.222V0.778,MP-mp-22568,V6Ga2,Ga-V,Ga25V75,P m -3 n,cubic,4.789645,4.789645,4.789645,data/final/MP/cifs/Ga0.222V0.778-MP-mp-22568-synth_doped.cif,data/source/MP/raw/cifs/mp-22568.cif,mp-22568,0.0,,2014-02-22 11:36:40,6.726541666276222,10.17188/1198793,"@misc{osti_1198793,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Ga (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198793"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686867'}},0.0,5.67452231,520.0,-61.95244347,-7.74405543375,{'tags': ['Gallium vanadium (1/3)']},-61.95244347,-7.74405543375,-0.1741018756249994,"['xas', 'elasticity', 'bandstructure']",True,"[635643, 635628, 635619, 635634, 104021, 635646, 635604, 635610, 635617, 635624, 635626, 635605, 635631, 635625, 635636, 635603, 104020, 635616, 635607]",True,2021-05-12 10:56:16.728000,FM,8,9,mp-22568,,V3Ga,"{'functional': 'PBE', 'labels': ['V_pv', 'Ga_d'], 'pot_type': 'paw'}","{'V': 3.0, 'Ga': 1.0}",GGA,mp-22568,"['mp-941343', 'mp-941663', 'mp-934924', 'mp-22568', 'mp-1440749', 'mp-1686867', 'mp-1804076', 'mp-1593784', 'mp-1595713']",0.09063635,"{'V': 6.0, 'Ga': 2.0}",109.87780534443452,[],FM,True,131,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.0, -0.0, -0.0]",0.0016497662965852,0.09063635,2,0.1812727,MP,data/source/MP/cleaned/cifs/MP-mp-22568.cif,True,,data/final/MP/graphs/Ga0.222V0.778-MP-mp-22568-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ge1Pd2Y1,1,0.0,4.0,False,Ge4Pd8Y4,Ge4Pd8Y4,0.0,Other,True,Ge25Pd50Y25,Ge-Pd-Y,3,Supercon,Pd2Ge1Y1,MP-mp-1207627,Y4Ge4Pd8,Ge-Pd-Y,Ge25Pd50Y25,P n m a,orthorhombic,5.612536,7.135985,7.45014,data/final/MP/cifs/Ge1Pd2Y1-MP-mp-1207627.cif,data/source/MP/raw/cifs/mp-1207627.cif,mp-1207627,0.0,,2019-01-12 10:41:59.135000,8.333952346764416,,,{'GGA': {'task_id': 'mp-1709008'}},0.0,4.889839,520.0,-100.4037221,-6.27523263125,"{'tags': ['YPd2Ge', 'YPd2Si', 'Yttrium palladium germanide (1/2/1)']}",-100.4037221,-6.27523263125,-0.9129169841666664,['bandstructure'],True,[637566],True,2021-05-12 10:58:39.488000,NM,16,5,mp-1207627,,YGePd2,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ge_d', 'Pd'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ge': 1.0, 'Pd': 2.0}",GGA,mp-1207627,"['mp-1207627', 'mp-1426792', 'mp-1709008', 'mp-1813107', 'mp-1609115']",0.0002876,"{'Y': 4.0, 'Ge': 4.0, 'Pd': 8.0}",298.38535381048115,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.8554171151801045e-06,0.0002876,0,0.0011504,MP,data/source/MP/cleaned/cifs/MP-mp-1207627.cif,False,,data/final/MP/graphs/Ge1Pd2Y1-MP-mp-1207627.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Sb1Y1,1,0.0,1.0,True,Sb1Y1,Sb1Y1,0.0,Other,True,Sb50Y50,Sb-Y,2,Supercon,Sb1Y1,MP-mp-215,Y1Sb1,Sb-Y,Sb50Y50,F m -3 m,cubic,4.3947139,4.3947139,4.3947139,data/final/MP/cifs/Sb1Y1-MP-mp-215.cif,data/source/MP/raw/cifs/mp-215.cif,mp-215,0.0,,2011-05-12 17:45:47,5.828629006352761,10.17188/1196953,"@misc{osti_1196953,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YSb (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196953"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686626'}},0.0,5.1000509,520.0,-12.91374592,-6.45687296,"{'tags': ['Yttrium antimonide', 'Yttrium antimonide (1/1)']}",-12.91374592,-6.45687296,-1.2551367833333336,"['xas', 'elasticity', 'bandstructure']",True,"[651732, 190091, 52399, 651734, 43632, 185498, 651737, 651741]",True,2021-05-12 10:56:16.728000,NM,2,21,mp-215,,YSb,"{'functional': 'PBE', 'labels': ['Y_sv', 'Sb'], 'pot_type': 'paw'}","{'Y': 1.0, 'Sb': 1.0}",GGA,mp-215,"['mp-910020', 'mp-925527', 'mp-925979', 'mp-215', 'mp-1041067', 'mvc-16067', 'mp-1048657', 'mp-1057217', 'mp-1057235', 'mp-1057251', 'mp-1060863', 'mp-1060900', 'mp-1060841', 'mp-1440872', 'mp-1686626', 'mp-1784075', 'mp-1592226', 'mp-1589270', 'mp-1057254', 'mp-1060913', 'mp-1048659']",0.0027595,"{'Y': 1.0, 'Sb': 1.0}",60.01735117164254,[],NM,False,225,0,"[0, 0]",4.597837035673493e-05,0.0027595,0,0.0027595,MP,data/source/MP/cleaned/cifs/MP-mp-215.cif,False,,data/final/MP/graphs/Sb1Y1-MP-mp-215.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
As1F0.2Fe1Nd1O0.8,1,0.0,10.0,False,As10F2Fe10Nd10O8,As10F2Fe10Nd10O8,32.6,Ferrite,True,As25F5Fe25Nd25O20,As-F-Fe-Nd-O,5,Supercon,Nd1Fe1As1F0.2O0.8,MP-mp-698941,Nd10Fe10As10O8F2,As-F-Fe-Nd-O,As25F5Fe25Nd25O20,P -1,triclinic,9.076235,9.09192927,9.97782917,data/final/MP/cifs/As1F0.2Fe1Nd1O0.8-MP-mp-698941.cif,data/source/MP/raw/cifs/mp-698941.cif,mp-698941,0.0,,2014-05-03 10:13:31,6.439883359225445,10.17188/1285450,"@misc{osti_1285450,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nd5Fe5As5O4F (SG:2) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1285450"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",,0.2615877513749991,4.52887933,520.0,-260.16394435,-6.504098608750001,{'tags': []},-260.16394435,-6.504098608750001,-1.6691149431250003,[],False,[],True,2021-05-12 11:01:44.406000,FM,40,5,mp-698941,oxide,Nd5Fe5As5O4F,"{'functional': 'PBE', 'labels': ['Nd_3', 'Fe_pv', 'As', 'O', 'F'], 'pot_type': 'paw'}","{'Nd': 5.0, 'Fe': 5.0, 'As': 5.0, 'O': 4.0, 'F': 1.0}",GGA+U,mp-698941,"['mp-698941', 'mp-1173593', 'mp-1353010', 'mp-1770929', 'mp-1937355']",18.9993341,"{'Nd': 10.0, 'Fe': 10.0, 'As': 10.0, 'O': 8.0, 'F': 2.0}",751.9175706720634,[],FM,True,2,5,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 3.6, 3.6, 3.6, 3.6, 3.6, 3.6, 3.6, 3.6, 3.6, 3.6, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0505356832744802,18.9993341,10,37.9986682,MP,data/source/MP/cleaned/cifs/MP-mp-698941.cif,False,,data/final/MP/graphs/As1F0.2Fe1Nd1O0.8-MP-mp-698941.json,0,True,-1,0,0,0,0,0,2,0,1,0,0,0,1.0,False
In0.69Tl0.31,3,0.12,8.0,False,In5.52Tl2.48,In6Tl2,2.98,Other,True,In69Tl31,In-Tl,2,Supercon,In0.69Tl0.31,MP-mp-1187827,Tl2In6,In-Tl,In75Tl25,P 63/m m c,hexagonal,5.783429,6.828941998825169,6.82894178,data/final/MP/cifs/In0.69Tl0.31-MP-mp-1187827-synth_doped.cif,data/source/MP/raw/cifs/mp-1187827.cif,mp-1187827,0.0,,2019-01-11 15:22:55.539000,7.803687011739559,,,{'GGA': {'task_id': 'mp-1742935'}},0.0451075679166663,6.43460187,520.0,-20.87452813,-2.60931601625,{'tags': []},-20.87452813,-2.60931601625,0.0451075679166663,['bandstructure'],True,[],True,2021-05-12 10:58:31.620000,NM,8,5,mp-1187827,,TlIn3,"{'functional': 'PBE', 'labels': ['Tl_d', 'In_d'], 'pot_type': 'paw'}","{'Tl': 1.0, 'In': 3.0}",GGA,mp-1187827,"['mp-1187827', 'mp-1396913', 'mp-1742935', 'mp-1930688', 'mp-1637284']",0.0010443,"{'Tl': 2.0, 'In': 6.0}",233.57312421327032,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",8.94195343336225e-06,0.0010443,0,0.0020886,MP,data/source/MP/cleaned/cifs/MP-mp-1187827.cif,True,,data/final/MP/graphs/In0.69Tl0.31-MP-mp-1187827-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Hg2Na3,1,0.0,4.0,False,Hg8Na12,Hg8Na12,0.0,Other,True,Hg40Na60,Hg-Na,2,Supercon,Hg2Na3,MP-mp-17974,Na12Hg8,Hg-Na,Hg40Na60,P 42/m n m,tetragonal,7.925785,8.544427,8.544427,data/final/MP/cifs/Hg2Na3-MP-mp-17974.cif,data/source/MP/raw/cifs/mp-17974.cif,mp-17974,0.0,,2014-12-22 16:23:49,5.396804863955903,10.17188/1192808,"@misc{osti_1192808,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Na3Hg2 (SG:136) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1192808"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1715897'}},0.0027980778999998,1.34269309,520.0,-22.54389319,-1.1271946595,{'tags': ['Trisodium dimercury']},-22.54389319,-1.1271946595,-0.2122073374310344,"['xas', 'bandstructure']",True,[172518],True,2021-05-12 10:56:55.092000,NM,20,8,mp-17974,,Na3Hg2,"{'functional': 'PBE', 'labels': ['Na_pv', 'Hg'], 'pot_type': 'paw'}","{'Na': 3.0, 'Hg': 2.0}",GGA,mp-17974,"['mp-914109', 'mp-930833', 'mp-17974', 'mp-1436833', 'mp-1715897', 'mp-1937808', 'mp-977752', 'mp-1609784']",3.3e-06,"{'Na': 12.0, 'Hg': 8.0}",578.6396302874728,[],NM,False,136,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.2812125732629368e-08,3.3e-06,0,1.32e-05,MP,data/source/MP/cleaned/cifs/MP-mp-17974.cif,False,,data/final/MP/graphs/Hg2Na3-MP-mp-17974.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ba2Ca0.7Cu2Nd0.3Tl1O7,3,0.0461538461538461,1.0,True,Ba2Ca0.7Cu2Nd0.3Tl1O7,Ba2Ca1Cu2Tl1O7,95.5,Cuprate,True,Ba15.385Ca5.385Cu15.385Nd2.308Tl7.692O53.84615384615385,Ba-Ca-Cu-Nd-Tl-O,6,Supercon,Tl1Ba2Ca0.7Nd0.3Cu2O7,MP-mp-632802,Ba2Ca1Tl1Cu2O7,Ba-Ca-Cu-Tl-O,Ba15.385Ca7.692Cu15.385Tl7.692O53.84615384615385,P 4/m m m,tetragonal,3.840502,3.840502,13.048748,data/final/MP/cifs/Ba2Ca0.7Cu2Nd0.3Tl1O7-MP-mp-632802-synth_doped.cif,data/source/MP/raw/cifs/mp-632802.cif,mp-632802,0.0,,2013-06-21 12:28:47,6.541687864051921,10.17188/1279349,"@misc{osti_1279349,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2CaTlCu2O7 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1279349"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1742071'}},0.0444125982158123,2.89241018,520.0,-71.95529719,-5.535022860769231,{'tags': ['Thallium(III) calcium barium copper oxide (1/1/2/2/7)']},-71.95529719,-5.535022860769231,-1.978767086794871,"['xas', 'bandstructure']",True,[67128],True,2021-05-12 10:57:30.779000,NM,13,10,mp-632802,oxide,Ba2CaTlCu2O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ca_sv', 'Tl_d', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Ca': 1.0, 'Tl': 1.0, 'Cu': 2.0, 'O': 7.0}",GGA,mp-632802,"['mp-699409', 'mp-632802', 'mp-732256', 'mp-743134', 'mp-1182322', 'mp-1394572', 'mp-1742071', 'mp-1785618', 'mp-1654627', 'mp-749845']",0.0282595,"{'Ba': 2.0, 'Ca': 1.0, 'Tl': 1.0, 'Cu': 2.0, 'O': 7.0}",192.461929418226,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.000146831636186,0.0282595,0,0.0282595,MP,data/source/MP/cleaned/cifs/MP-mp-632802.cif,True,,data/final/MP/graphs/Ba2Ca0.7Cu2Nd0.3Tl1O7-MP-mp-632802-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Fe2Ge2Y1,1,0.0,1.0,True,Fe2Ge2Y1,Fe2Ge2Y1,0.99,Other,True,Fe40Ge40Y20,Fe-Ge-Y,3,Supercon,Y1Fe2Ge2,MP-mp-21113,Y1Fe2Ge2,Fe-Ge-Y,Fe40Ge40Y20,I 4/m m m,tetragonal,3.9826680015242695,3.9826680015242695,5.82080031,data/final/MP/cifs/Fe2Ge2Y1-MP-mp-21113.cif,data/source/MP/raw/cifs/mp-21113.cif,mp-21113,0.0,,2014-02-21 10:21:08,7.107959844950806,10.17188/1196391,"@misc{osti_1196391,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Y(FeGe)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196391"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697364'}},0.0,4.86426424,520.0,-34.95128923,-6.990257846,{'tags': ['Yttrium iron germanide (1/2/2)']},-34.95128923,-6.990257846,-0.4597491013333325,"['xas', 'elasticity', 'bandstructure']",True,[81745],True,2021-05-12 10:56:16.728000,FM,5,8,mp-21113,,Y(FeGe)2,"{'functional': 'PBE', 'labels': ['Y_sv', 'Fe_pv', 'Ge_d'], 'pot_type': 'paw'}","{'Y': 1.0, 'Fe': 2.0, 'Ge': 2.0}",GGA,mp-21113,"['mp-990908', 'mp-992921', 'mp-21113', 'mp-1432366', 'mp-1697364', 'mp-1800805', 'mp-994268', 'mp-1591731']",1.7067178,"{'Y': 1.0, 'Fe': 2.0, 'Ge': 2.0}",80.80242061672149,[],FM,True,139,1,"[0.0, 0.9, 0.9, 0.0, 0.0]",0.0211221122705673,1.7067178,2,1.7067178,MP,data/source/MP/cleaned/cifs/MP-mp-21113.cif,False,,data/final/MP/graphs/Fe2Ge2Y1-MP-mp-21113.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Be13Y1,1,0.0,2.0,False,Be26Y2,Be26Y2,0.0,Other,True,Be92.857Y7.143,Be-Y,2,Supercon,Be13Y1,MP-mp-1193534,Y2Be26,Be-Y,Be92.857Y7.143,F m -3 c,cubic,7.201848630000001,7.20184863,7.20184863,data/final/MP/cifs/Be13Y1-MP-mp-1193534.cif,data/source/MP/raw/cifs/mp-1193534.cif,mp-1193534,0.0,,2019-01-11 23:19:11.006000,2.590983848977716,,,{'GGA': {'task_id': 'mp-1674549'}},0.0,4.07367735,520.0,-115.39949518,-4.121410542142857,"{'tags': ['Beryllium yttrium (13/1)', 'NaZn13', 'Be13Y']}",-115.39949518,-4.121410542142857,-0.1872078022619052,['bandstructure'],True,"[616507, 616509]",True,2021-05-12 10:58:35.561000,NM,28,6,mp-1193534,,YBe13,"{'functional': 'PBE', 'labels': ['Y_sv', 'Be_sv'], 'pot_type': 'paw'}","{'Y': 1.0, 'Be': 13.0}",GGA,mp-1193534,"['mp-1193534', 'mp-1194278', 'mp-1381939', 'mp-1674549', 'mp-1775607', 'mp-1605534']",0.0001531,"{'Y': 2.0, 'Be': 26.0}",264.1295359917496,[],NM,False,226,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.1592796649957565e-06,0.0001531,0,0.0003062,MP,data/source/MP/cleaned/cifs/MP-mp-1193534.cif,False,,data/final/MP/graphs/Be13Y1-MP-mp-1193534.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
As1Co0.025Fe0.975Sm1O1,2,0.0125,2.0,False,As2Co0.05Fe1.95Sm2O2,As2Fe2Sm2O2,0.0,Ferrite,True,As25Co0.625Fe24.375Sm25O25,As-Co-Fe-Sm-O,5,Supercon,Sm1Fe0.975Co0.025As1O1,MP-mp-20349,Sm2Fe2As2O2,As-Fe-Sm-O,As25Fe25Sm25O25,P 4/n m m,tetragonal,4.026492,4.026492,9.046755,data/final/MP/cifs/As1Co0.025Fe0.975Sm1O1-MP-mp-20349-synth_doped.cif,data/source/MP/raw/cifs/mp-20349.cif,mp-20349,0.0,,2014-02-19 11:24:42,6.727802583283198,,,{'GGA+U': {'task_id': 'mp-1695938'}},0.3015723809374986,3.77685593,520.0,-52.73407138,-6.5917589225,{'tags': ['Samarium iron arsenic oxide (1/1/1/1)']},-52.73407138,-6.5917589225,-1.6285904237499995,"['xas', 'elasticity', 'bandstructure']",True,"[236652, 236653, 422002, 163457, 163458]",True,2021-05-12 10:56:16.728000,FM,8,10,mp-20349,oxide,SmFeAsO,"{'functional': 'PBE', 'labels': ['Sm_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Sm': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-20349,"['mp-24944', 'mp-1078897', 'mp-1079866', 'mp-1173321', 'mp-20349', 'mp-1425472', 'mp-1695938', 'mp-1772503', 'mp-1789694', 'mp-1588381']",3.75729895,"{'Sm': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",146.67176231613362,[],FM,True,129,1,"[0.0, 0.0, 3.5, 3.5, -0.0, -0.0, -0.0, -0.0]",0.0512341147425717,3.75729895,2,7.5145979,MP,data/source/MP/cleaned/cifs/MP-mp-20349.cif,True,,data/final/MP/graphs/As1Co0.025Fe0.975Sm1O1-MP-mp-20349-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Al3Pd4Si1,1,0.0,1.0,True,Al3Pd4Si1,Al3Pd4Si1,0.0,Other,True,Al37.5Pd50Si12.5,Al-Pd-Si,3,Supercon,Al3Pd4Si1,MP-mp-1228909,Al3Si1Pd4,Al-Pd-Si,Al37.5Pd50Si12.5,R 3,trigonal,4.888751730000001,4.88875173,4.88875161,data/final/MP/cifs/Al3Pd4Si1-MP-mp-1228909.cif,data/source/MP/raw/cifs/mp-1228909.cif,mp-1228909,0.0,,2019-01-13 04:33:59.025000,7.600534887620268,,,{'GGA': {'task_id': 'mp-1754225'}},0.0,7.85426524,520.0,-43.95267445,-5.49408430625,{'tags': []},-43.95267445,-5.49408430625,-0.8213882125000005,['bandstructure'],True,[],True,2021-05-12 10:58:49.477000,NM,8,5,mp-1228909,,Al3SiPd4,"{'functional': 'PBE', 'labels': ['Al', 'Si', 'Pd'], 'pot_type': 'paw'}","{'Al': 3.0, 'Si': 1.0, 'Pd': 4.0}",GGA,mp-1228909,"['mp-1228909', 'mp-1407831', 'mp-1754225', 'mp-1805232', 'mp-1619598']",0.0003764,"{'Al': 3.0, 'Si': 1.0, 'Pd': 4.0}",116.82165133382,[],NM,False,146,0,"[0, 0, 0, 0, 0, 0, 0, 0]",3.2220054733212945e-06,0.0003764,0,0.0003764,MP,data/source/MP/cleaned/cifs/MP-mp-1228909.cif,False,,data/final/MP/graphs/Al3Pd4Si1-MP-mp-1228909.json,0,True,3,0,0,0,0,0,0,1,1,0,0,0,1.0,False
P0.4S0.6Y1,3,0.0999999999999999,2.0,False,P0.8S1.2Y2,P1S1Y2,0.0,Other,True,P20S30Y50,P-S-Y,3,Supercon,P0.4S0.6Y1,MP-mp-1216056,Y2P1S1,P-S-Y,P25S25Y50,R -3 m,trigonal,3.971481719367268,3.971481719367268,6.8821478,data/final/MP/cifs/P0.4S0.6Y1-MP-mp-1216056-synth_doped.cif,data/source/MP/raw/cifs/mp-1216056.cif,mp-1216056,0.0,,2019-01-12 17:37:56.001000,4.512183410944671,,,{'GGA': {'task_id': 'mp-1767434'}},0.0,5.86994809,520.0,-30.00958265,-7.5023956625,{'tags': []},-30.00958265,-7.5023956625,-2.0074720124479164,['bandstructure'],True,[],True,2021-05-12 10:58:39.488000,NM,4,5,mp-1216056,,Y2PS,"{'functional': 'PBE', 'labels': ['Y_sv', 'P', 'S'], 'pot_type': 'paw'}","{'Y': 2.0, 'P': 1.0, 'S': 1.0}",GGA,mp-1216056,"['mp-1216056', 'mp-1419952', 'mp-1767434', 'mp-1874992', 'mp-1616074']",0.0030014,"{'Y': 2.0, 'P': 1.0, 'S': 1.0}",88.63593629407164,[],NM,False,166,0,"[0, 0, 0, 0]",3.386211197726973e-05,0.0030014,0,0.0030014,MP,data/source/MP/cleaned/cifs/MP-mp-1216056.cif,True,,data/final/MP/graphs/P0.4S0.6Y1-MP-mp-1216056-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ce0.042In1La2.958,2,0.0209999999999999,1.0,True,Ce0.042In1La2.958,In1La3,7.11,Other,True,Ce1.05In25La73.95,Ce-In-La,3,Supercon,La2.9579Ce0.0421In1,MP-mp-20909,La3In1,In-La,In25La75,P m -3 m,cubic,5.076766,5.076766,5.076766,data/final/MP/cifs/Ce0.042In1La2.958-MP-mp-20909-synth_doped.cif,data/source/MP/raw/cifs/mp-20909.cif,mp-20909,0.0,,2014-02-21 06:52:52,6.7455760598452565,10.17188/1196104,"@misc{osti_1196104,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La3In (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196104"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671685'}},0.0,8.16935076,520.0,-18.73796121,-4.6844903025,"{'tags': ['Indium lanthanum (1/3)', 'Lanthanum indium (3/1)']}",-18.73796121,-4.6844903025,-0.2945640412500001,"['xas', 'bandstructure']",True,"[639844, 51950, 639851, 639840, 603208, 107019]",True,2021-05-12 10:56:57.051000,NM,4,8,mp-20909,,La3In,"{'functional': 'PBE', 'labels': ['La', 'In_d'], 'pot_type': 'paw'}","{'La': 3.0, 'In': 1.0}",GGA,mp-20909,"['mp-906743', 'mp-921394', 'mp-920373', 'mp-20909', 'mp-1476042', 'mp-1671685', 'mp-1778647', 'mp-1590323']",0.0489742,"{'La': 3.0, 'In': 1.0}",130.84629766481785,[],NM,False,221,0,"[0, 0, 0, 0]",0.0003742880071811,0.0489742,0,0.0489742,MP,data/source/MP/cleaned/cifs/MP-mp-20909.cif,True,,data/final/MP/graphs/Ce0.042In1La2.958-MP-mp-20909-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Mo2Re4Se8,1,0.0,1.0,True,Mo2Re4Se8,Mo2Re4Se8,0.0,Chevrel,True,Mo14.286Re28.571Se57.143,Mo-Re-Se,3,Supercon,Mo2Re4Se8,MP-mp-1219132,Re4Mo2Se8,Mo-Re-Se,Mo14.286Re28.571Se57.143,P 1,triclinic,6.73349722,6.733698,6.73587233,data/final/MP/cifs/Mo2Re4Se8-MP-mp-1219132.cif,data/source/MP/raw/cifs/mp-1219132.cif,mp-1219132,1.0564,,2019-01-12 20:11:12.415000,8.578163542643878,,,,0.0,5.32124225,700.0,-105.95353526,-7.568109661428571,{'tags': []},-105.95353526,-7.568109661428571,-0.7352034741964276,"['diel', 'piezo']",False,[],True,2021-05-12 10:56:39.288000,NM,14,5,mp-1219132,,Re2MoSe4,"{'functional': 'PBE', 'labels': ['Re_pv', 'Mo_pv', 'Se'], 'pot_type': 'paw'}","{'Re': 2.0, 'Mo': 1.0, 'Se': 4.0}",GGA,mp-1219132,"['mp-1219132', 'mp-1346682', 'mp-1541230', 'mp-1540151', 'mp-1811430']",0.000194,"{'Re': 4.0, 'Mo': 2.0, 'Se': 8.0}",303.60455739037434,[],NM,False,1,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.2779781810096814e-06,0.000194,0,0.000388,MP,data/source/MP/cleaned/cifs/MP-mp-1219132.cif,False,,data/final/MP/graphs/Mo2Re4Se8-MP-mp-1219132.json,0,True,1,0,0,0,0,0,1,0,1,0,0,0,1.0,False
P1,1,0.0,42.0,False,P42,P42,6.728571429,Other,True,P100,P,1,Supercon,P1,MP-mp-1198724,P42,P,P100,P -1,triclinic,7.857479999999999,12.1470762,13.04870569,data/final/MP/cifs/P1-MP-mp-1198724.cif,data/source/MP/raw/cifs/mp-1198724.cif,mp-1198724,1.9259,,2019-01-12 03:27:11.510000,1.939294650444865,,,,0.0,4.13781117,520.0,-227.35870528,-5.413302506666667,{'tags': ['Phosphorus - aP42']},-227.35870528,-5.413302506666667,0.0,[],False,[391323],True,2021-05-12 11:00:03.538000,NM,42,3,mp-1198724,,P,"{'functional': 'PBE', 'labels': ['P'], 'pot_type': 'paw'}",{'P': 1.0},GGA,mp-1198724,"['mp-1198724', 'mp-1368140', 'mp-1845882']",6.171428571428571e-05,{'P': 42.0},1113.9060053656235,[],NM,False,2,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.326946786815476e-06,6.171428571428571e-05,0,0.002592,MP,data/source/MP/cleaned/cifs/MP-mp-1198724.cif,False,,data/final/MP/graphs/P1-MP-mp-1198724.json,0,True,-1,0,0,0,0,0,2,0,1,0,0,0,1.0,False
Bi3Fe0.05Ni0.95,2,0.025,4.0,False,Bi12Fe0.2Ni3.8,Bi12Ni4,4.08,Ferrite,True,Bi75Fe1.25Ni23.75,Bi-Fe-Ni,3,Supercon,Bi3Ni0.95Fe0.05,MP-mp-23179,Ni4Bi12,Bi-Ni,Bi75Ni25,P n m a,orthorhombic,4.158823,8.90949,11.546925,data/final/MP/cifs/Bi3Fe0.05Ni0.95-MP-mp-23179-synth_doped.cif,data/source/MP/raw/cifs/mp-23179.cif,mp-23179,0.0,,2014-02-22 14:41:23,10.644179451228444,10.17188/1199299,"@misc{osti_1199299,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NiBi3 (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199299"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1708341'}},0.0,6.61871576,520.0,-70.18994443,-4.386871526875,"{'tags': ['Bismuth nickel (3/1)', 'Nickel bismuthide (1/3)', 'Tribismuth nickel']}",-70.18994443,-4.386871526875,-0.0243116243750005,"['xas', 'elasticity', 'bandstructure']",True,"[180771, 58821, 391336]",True,2021-05-12 10:56:16.728000,NM,16,8,mp-23179,,NiBi3,"{'functional': 'PBE', 'labels': ['Ni_pv', 'Bi'], 'pot_type': 'paw'}","{'Ni': 1.0, 'Bi': 3.0}",GGA,mp-23179,"['mp-904851', 'mp-918297', 'mp-919312', 'mp-23179', 'mp-1432205', 'mp-1708341', 'mp-1815572', 'mp-1608049']",0.0002736,"{'Ni': 4.0, 'Bi': 12.0}",427.84811884443286,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.557917054668476e-06,0.0002736,0,0.0010944,MP,data/source/MP/cleaned/cifs/MP-mp-23179.cif,True,,data/final/MP/graphs/Bi3Fe0.05Ni0.95-MP-mp-23179-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Hf0.3V2Zr0.7,3,0.1333333333333333,2.0,False,Hf0.6V4Zr1.4,Hf1V4Zr1,9.9,Other,True,Hf10V66.667Zr23.333,Hf-V-Zr,3,Supercon,Zr0.7Hf0.3V2,MP-mp-1224085,Hf1Zr1V4,Hf-V-Zr,Hf16.667V66.667Zr16.667,F -4 3 m,cubic,5.18701573,5.187015729999999,5.187015729999999,data/final/MP/cifs/Hf0.3V2Zr0.7-MP-mp-1224085-synth_doped.cif,data/source/MP/raw/cifs/mp-1224085.cif,mp-1224085,0.0,,2019-01-13 00:23:09.162000,7.967334263158579,,,{'GGA': {'task_id': 'mp-1756967'}},0.0410283783333351,5.00695262,520.0,-54.59434349,-9.099057248333333,{'tags': []},-54.59434349,-9.099057248333333,0.0410283783333322,['bandstructure'],True,[],True,2021-05-12 10:58:45.495000,FM,6,5,mp-1224085,,HfZrV4,"{'functional': 'PBE', 'labels': ['Hf_pv', 'Zr_sv', 'V_pv'], 'pot_type': 'paw'}","{'Hf': 1.0, 'Zr': 1.0, 'V': 4.0}",GGA,mp-1224085,"['mp-1224085', 'mp-1444296', 'mp-1756967', 'mp-1796002', 'mp-1624522']",0.362572,"{'Hf': 1.0, 'Zr': 1.0, 'V': 4.0}",98.68194446031352,[],FM,True,160,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.1]",0.0036741473020509,0.362572,3,0.362572,MP,data/source/MP/cleaned/cifs/MP-mp-1224085.cif,True,,data/final/MP/graphs/Hf0.3V2Zr0.7-MP-mp-1224085-synth_doped.json,0,True,-43m,5,0,0,0,0,0,0,0,0,0,1,1.0,False
C1Ta2,1,0.0,1.0,True,C1Ta2,C1Ta2,1.63,Other,True,C33.333Ta66.667,C-Ta,2,Supercon,C1Ta2,MP-mp-7088,Ta2C1,C-Ta,C33.333Ta66.667,P -3 m 1,trigonal,3.1250519978903206,3.1250525,4.97079,data/final/MP/cifs/C1Ta2-MP-mp-7088.cif,data/source/MP/raw/cifs/mp-7088.cif,mp-7088,0.0,,2011-05-27 16:38:17,14.768671437371712,10.17188/1286550,"@misc{osti_1286550,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ta2C (SG:164) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1286550"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687508'}},0.0,6.48100088,520.0,-34.73531553,-11.57843851,{'tags': ['Tantalum carbide (2/1)']},-34.73531553,-11.57843851,-0.5976598566666667,"['bandstructure', 'elasticity']",True,"[618840, 409555]",True,2021-05-12 10:56:29.056000,NM,3,8,mp-7088,,Ta2C,"{'functional': 'PBE', 'labels': ['Ta_pv', 'C'], 'pot_type': 'paw'}","{'Ta': 2.0, 'C': 1.0}",GGA,mp-7088,"['mp-910911', 'mp-927075', 'mp-926538', 'mp-7088', 'mp-1476064', 'mp-1687508', 'mp-1781409', 'mp-1590653']",2.24e-05,"{'Ta': 2.0, 'C': 1.0}",42.04076762876414,[],NM,False,164,0,"[0, 0, 0]",5.328161511654703e-07,2.24e-05,0,2.24e-05,MP,data/source/MP/cleaned/cifs/MP-mp-7088.cif,False,,data/final/MP/graphs/C1Ta2-MP-mp-7088.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Mo0.3U0.7,3,0.0666666666666666,3.0,False,Mo0.9U2.1,Mo1U2,1.97,Heavy_fermion,True,Mo30U70,Mo-U,2,Supercon,Mo0.3U0.7,MP-mp-30789,U2Mo1,Mo-U,Mo33.333U66.667,I 4/m m m,tetragonal,3.430325997815822,3.430325997815821,5.42677653,data/final/MP/cifs/Mo0.3U0.7-MP-mp-30789-synth_doped.cif,data/source/MP/raw/cifs/mp-30789.cif,mp-30789,0.0,,2014-02-24 00:29:27,16.627488444909705,10.17188/1205150,"@misc{osti_1205150,
    author = ""Persson, Kristin"",
    title = ""Materials Data on U2Mo (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1205150"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678310'}},0.0687579333333339,12.75097727,520.0,-33.22218925,-11.074063083333334,{'tags': ['Molybdenum uranium (1/2)']},-33.22218925,-11.074063083333334,0.0687579333333327,"['xas', 'elasticity', 'bandstructure']",True,[105107],True,2021-05-12 10:56:18.721000,NM,3,8,mp-30789,,U2Mo,"{'functional': 'PBE', 'labels': ['U', 'Mo_pv'], 'pot_type': 'paw'}","{'U': 2.0, 'Mo': 1.0}",GGA,mp-30789,"['mp-929433', 'mp-929038', 'mp-912678', 'mp-30789', 'mp-1438511', 'mp-1678310', 'mp-1793169', 'mp-1591032']",0.0421186,"{'U': 2.0, 'Mo': 1.0}",57.123764016856775,[],NM,False,139,0,"[0.0, 0.0, 0.0]",0.0007373218611359,0.0421186,0,0.0421186,MP,data/source/MP/cleaned/cifs/MP-mp-30789.cif,True,,data/final/MP/graphs/Mo0.3U0.7-MP-mp-30789-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ba2Ce0.1Cu4Dy0.9O8,2,0.0133333333333333,1.0,True,Ba2Ce0.1Cu4Dy0.9O8,Ba2Cu4Dy1O8,44.0,Cuprate,True,Ba13.333Ce0.667Cu26.667Dy6O53.333333333333336,Ba-Ce-Cu-Dy-O,5,Supercon,Dy0.9Ce0.1Ba2Cu4O8,MP-mp-6691,Ba2Dy1Cu4O8,Ba-Cu-Dy-O,Ba13.333Cu26.667Dy6.667O53.333333333333336,C m m m,orthorhombic,3.886246,3.897522001622928,13.87885898,data/final/MP/cifs/Ba2Ce0.1Cu4Dy0.9O8-MP-mp-6691-synth_doped.cif,data/source/MP/raw/cifs/mp-6691.cif,mp-6691,0.0,,2011-05-16 02:52:15,6.536736444395467,10.17188/1281561,"@misc{osti_1281561,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Dy(CuO2)4 (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281561"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698809'}},0.0,3.29500259,520.0,-89.84357728,-5.989571818666667,"{'tags': ['Dysprosium dibarium tricopper copper(III) oxide', 'Dysprosium barium copper oxide (1/2/4/8)']}",-89.84357728,-5.989571818666667,-2.060955604,"['xas', 'bandstructure']",True,"[74125, 67637, 78625]",True,2021-05-12 10:57:32.679000,NM,15,8,mp-6691,oxide,Ba2Dy(CuO2)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Dy_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Dy': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-6691,"['mp-1007135', 'mp-1000661', 'mp-6691', 'mp-1431030', 'mp-1698809', 'mp-1785190', 'mp-1011884', 'mp-1599163']",0.0002446,"{'Ba': 2.0, 'Dy': 1.0, 'Cu': 4.0, 'O': 8.0}",208.1367053323528,[],NM,False,65,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.175189160457895e-06,0.0002446,0,0.0002446,MP,data/source/MP/cleaned/cifs/MP-mp-6691.cif,True,,data/final/MP/graphs/Ba2Ce0.1Cu4Dy0.9O8-MP-mp-6691-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ba2Cu2Nb1Pr1O8,1,0.0,2.0,False,Ba4Cu4Nb2Pr2O16,Ba4Cu4Nb2Pr2O16,0.0,Cuprate,True,Ba14.286Cu14.286Nb7.143Pr7.143O57.142857142857146,Ba-Cu-Nb-Pr-O,5,Supercon,Pr1Ba2Cu2Nb1O8,MP-mp-1228503,Ba4Pr2Nb2Cu4O16,Ba-Cu-Nb-Pr-O,Ba14.286Cu14.286Nb7.143Pr7.143O57.142857142857146,I 4/m c m,tetragonal,5.6523240008018885,5.6523240008018885,12.891359700000002,data/final/MP/cifs/Ba2Cu2Nb1Pr1O8-MP-mp-1228503.cif,data/source/MP/raw/cifs/mp-1228503.cif,mp-1228503,0.0,,2019-01-13 04:12:27.910000,6.476077285414362,,,{'GGA': {'task_id': 'mp-1681109'}},0.0,3.15488536,520.0,-197.21763621,-7.0434870075,{'tags': []},-197.21763621,-7.0434870075,-2.68589792,[],False,[],True,2021-05-12 11:00:59.151000,NM,28,4,mp-1228503,oxide,Ba2PrNb(CuO4)2,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Pr_3', 'Nb_pv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Pr': 1.0, 'Nb': 1.0, 'Cu': 2.0, 'O': 8.0}",GGA,mp-1228503,"['mp-1228503', 'mp-1347285', 'mp-1681109', 'mp-1839661']",0.4602329,"{'Ba': 4.0, 'Pr': 2.0, 'Nb': 2.0, 'Cu': 4.0, 'O': 16.0}",391.5683006987532,[],NM,False,140,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0023507158223927,0.4602329,0,0.9204658,MP,data/source/MP/cleaned/cifs/MP-mp-1228503.cif,False,,data/final/MP/graphs/Ba2Cu2Nb1Pr1O8-MP-mp-1228503.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Pd3Y1,1,0.0,1.0,True,Pd3Y1,Pd3Y1,0.0,Other,True,Pd75Y25,Pd-Y,2,Supercon,Pd3Y1,MP-mp-559,Y1Pd3,Pd-Y,Pd75Y25,P m -3 m,cubic,4.140147,4.140147,4.140147,data/final/MP/cifs/Pd3Y1-MP-mp-559.cif,data/source/MP/raw/cifs/mp-559.cif,mp-559,0.0,,2011-05-12 23:12:28,9.550772030484303,10.17188/1270599,"@misc{osti_1270599,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YPd3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1270599"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1670952'}},0.0,4.30448502,520.0,-25.45351326,-6.363378315,"{'tags': ['Palladium yttrium (3/1)', 'Yttrium palladium (1/3)']}",-25.45351326,-6.363378315,-0.8618491791666667,"['xas', 'elasticity', 'bandstructure']",True,"[649115, 105745, 649102, 163410, 649114, 105743, 105744, 649104]",True,2021-05-12 10:56:22.739000,NM,4,8,mp-559,,YPd3,"{'functional': 'PBE', 'labels': ['Y_sv', 'Pd'], 'pot_type': 'paw'}","{'Y': 1.0, 'Pd': 3.0}",GGA,mp-559,"['mp-993121', 'mp-559', 'mp-991162', 'mp-1442172', 'mp-1670952', 'mp-1798408', 'mp-994439', 'mp-1593318']",0.0033057,"{'Y': 1.0, 'Pd': 3.0}",70.96550283198694,[],NM,False,221,0,"[0, 0, 0, 0]",4.658178788398567e-05,0.0033057,0,0.0033057,MP,data/source/MP/cleaned/cifs/MP-mp-559.cif,False,,data/final/MP/graphs/Pd3Y1-MP-mp-559.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
B4Er0.73Ho0.27Rh4,3,0.06,2.0,False,B8Er1.46Ho0.54Rh8,B8Er2Rh8,8.06,Other,True,B44.444Er8.111Ho3Rh44.444,B-Er-Ho-Rh,4,Supercon,Er0.73Ho0.27Rh4B4,MP-mp-8408,Er2B8Rh8,B-Er-Rh,B44.444Er11.111Rh44.444,P 42/n m c,tetragonal,5.336304,5.336304,7.44528,data/final/MP/cifs/B4Er0.73Ho0.27Rh4-MP-mp-8408-synth_doped.cif,data/source/MP/raw/cifs/mp-8408.cif,mp-8408,0.0,,2011-06-07 02:27:50,9.745285939793032,10.17188/1308086,"@misc{osti_1308086,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Er(BRh)4 (SG:137) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1308086"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1673724'}},0.0133402750000009,6.84272912,520.0,-131.92031901,-7.328906611666666,{'tags': ['Erbium rhodium boride (1/4/4)']},-131.92031901,-7.328906611666666,-0.5797380146296286,"['xas', 'bandstructure']",True,"[613809, 601530, 49631]",True,2021-05-12 10:57:51.871000,NM,18,8,mp-8408,,Er(BRh)4,"{'functional': 'PBE', 'labels': ['Er_3', 'B', 'Rh_pv'], 'pot_type': 'paw'}","{'Er': 1.0, 'B': 4.0, 'Rh': 4.0}",GGA,mp-8408,"['mp-932384', 'mp-931412', 'mp-8408', 'mp-915879', 'mp-1434188', 'mp-1673724', 'mp-1785064', 'mp-1597242']",7.985e-05,"{'Er': 2.0, 'B': 8.0, 'Rh': 8.0}",212.01283845150363,[],NM,False,137,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",7.532562705467018e-07,7.985e-05,0,0.0001597,MP,data/source/MP/cleaned/cifs/MP-mp-8408.cif,True,,data/final/MP/graphs/B4Er0.73Ho0.27Rh4-MP-mp-8408-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
C1Cu0.03Mg1Ni2.97,2,0.0119999999999999,1.0,True,C1Cu0.03Mg1Ni2.97,C1Mg1Ni3,6.8,Other,True,C20Cu0.6Mg20Ni59.4,C-Cu-Mg-Ni,4,Supercon,Mg1C1Ni2.97Cu0.03,MP-mp-10700,Mg1Ni3C1,C-Mg-Ni,C20Mg20Ni60,P m -3 m,cubic,3.810209,3.810209,3.810209,data/final/MP/cifs/C1Cu0.03Mg1Ni2.97-MP-mp-10700-synth_doped.cif,data/source/MP/raw/cifs/mp-10700.cif,mp-10700,0.0,,2011-05-28 10:04:44,6.376007671789427,10.17188/1187303,"@misc{osti_1187303,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MgNi3C (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187303"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678621'}},0.0,6.64260176,520.0,-28.85099542,-5.770199084,{'tags': ['Magnesium nickel carbide (1/3/1)']},-28.85099542,-5.770199084,-0.1367049259999994,"['xas', 'elasticity', 'bandstructure']",True,[77152],True,2021-05-12 10:56:10.715000,NM,5,8,mp-10700,,MgNi3C,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Ni_pv', 'C'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",GGA,mp-10700,"['mp-927245', 'mp-927653', 'mp-911184', 'mp-10700', 'mp-1438083', 'mp-1678621', 'mp-1791467', 'mp-1591421']",0.0387875,"{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",55.31544309398296,[],NM,False,221,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",0.0007012056277683,0.0387875,0,0.0387875,MP,data/source/MP/cleaned/cifs/MP-mp-10700.cif,True,,data/final/MP/graphs/C1Cu0.03Mg1Ni2.97-MP-mp-10700-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Pd3Ta4Te16,1,0.0,1.0,True,Pd3Ta4Te16,Pd3Ta4Te16,4.38,Other,True,Pd13.043Ta17.391Te69.565,Pd-Ta-Te,3,Supercon,Ta4Pd3Te16,MP-mp-510426,Ta4Te16Pd3,Pd-Ta-Te,Pd13.043Ta17.391Te69.565,C 1 2/m 1,monoclinic,3.788564001599754,11.1112109,16.076468839811405,data/final/MP/cifs/Pd3Ta4Te16-MP-mp-510426.cif,data/source/MP/raw/cifs/mp-510426.cif,mp-510426,0.0,,2014-02-26 00:28:58,7.805559975312634,10.17188/1262922,"@misc{osti_1262922,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ta4Te16Pd3 (SG:12) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1262922"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1760890'}},5.10564734330643e-05,5.78718952,520.0,-121.04153306,-5.262675350434783,{'tags': ['Tantalum palladium telluride (4/3/16)']},-121.04153306,-5.262675350434783,-0.63173748826087,"['xas', 'bandstructure']",True,[71217],True,2021-05-12 10:57:10.838000,NM,23,8,mp-510426,,Ta4Te16Pd3,"{'functional': 'PBE', 'labels': ['Ta_pv', 'Te', 'Pd'], 'pot_type': 'paw'}","{'Ta': 4.0, 'Te': 16.0, 'Pd': 3.0}",GGA,mp-510426,"['mp-913850', 'mp-930715', 'mp-990734', 'mp-510426', 'mp-1408933', 'mp-1760890', 'mp-1873021', 'mp-1619289']",0.001564,"{'Ta': 4.0, 'Te': 16.0, 'Pd': 3.0}",656.2225352194432,[],NM,False,12,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.3833378405345267e-06,0.001564,0,0.001564,MP,data/source/MP/cleaned/cifs/MP-mp-510426.cif,False,,data/final/MP/graphs/Pd3Ta4Te16-MP-mp-510426.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
Al3Ni2U0.98,2,0.0055741360089185,1.0,True,Al3Ni2U0.98,Al3Ni2U1,1.145,Heavy_fermion,True,Al50.167Ni33.445U16.388,Al-Ni-U,3,Supercon,U0.98Ni2Al3,MP-mp-2903,U1Al3Ni2,Al-Ni-U,Al50Ni33.333U16.667,P 6/m m m,hexagonal,4.031899,5.147229997095757,5.14723005,data/final/MP/cifs/Al3Ni2U0.98-MP-mp-2903-synth_doped.cif,data/source/MP/raw/cifs/mp-2903.cif,mp-2903,0.0,,2011-05-13 05:51:52,7.832617582421956,10.17188/1203074,"@misc{osti_1203074,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UAl3Ni2 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1203074"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678525'}},0.1051396383333314,9.05221071,520.0,-36.52297192,-6.087161986666668,"{'tags': ['Uranium nickel aluminium (1/2/3)', 'Aluminum nickel uranium (3/2/1)', 'Aluminium nickel uranium (3/2/1)']}",-36.52297192,-6.087161986666668,-0.4057601766666678,"['xas', 'elasticity', 'bandstructure']",True,"[659220, 602903, 104408, 659142, 370029]",True,2021-05-12 10:56:18.721000,NM,6,9,mp-2903,,UAl3Ni2,"{'functional': 'PBE', 'labels': ['U', 'Al', 'Ni_pv'], 'pot_type': 'paw'}","{'U': 1.0, 'Al': 3.0, 'Ni': 2.0}",GGA,mp-2903,"['mp-991128', 'mp-2903', 'mp-993112', 'mp-1256856', 'mp-1437596', 'mp-1678525', 'mp-1796633', 'mp-994437', 'mp-1589145']",0.0881673,"{'U': 1.0, 'Al': 3.0, 'Ni': 2.0}",92.50973387636644,[],NM,False,191,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0009530597084824,0.0881673,0,0.0881673,MP,data/source/MP/cleaned/cifs/MP-mp-2903.cif,True,,data/final/MP/graphs/Al3Ni2U0.98-MP-mp-2903-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Fe30Zr70,3,0.0666666666666666,0.0571380952380952,False,Fe1.714Zr4,Fe2Zr4,0.5,Other,True,Fe30Zr70,Fe-Zr,2,Supercon,Fe30Zr70,MP-mp-1159,Zr4Fe2,Fe-Zr,Fe33.333Zr66.667,I 4/m c m,tetragonal,5.284995779990666,5.28499578,5.28499578,data/final/MP/cifs/Fe30Zr70-MP-mp-1159-synth_doped.cif,data/source/MP/raw/cifs/mp-1159.cif,mp-1159,0.0,,2011-05-13 20:27:53,7.00133973662212,10.17188/1188091,"@misc{osti_1188091,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Zr2Fe (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188091"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-928933'}},0.0060293753333322,4.42743038,520.0,-51.95663803,-8.659439671666666,"{'tags': ['Iron zirconium (1/2)', 'Iron zirconium hydride (2/4/9)']}",-51.95663803,-8.659439671666666,-0.137636435000001,"['xas', 'elasticity', 'bandstructure']",True,"[634192, 634145, 656524, 634183, 634154, 103712]",True,2021-05-12 10:56:12.755000,NM,6,14,mp-1159,,Zr2Fe,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Fe_pv'], 'pot_type': 'paw'}","{'Zr': 2.0, 'Fe': 1.0}",GGA,mp-1159,"['mp-929296', 'mp-912432', 'mp-928933', 'mp-1159', 'mp-1072488', 'mp-1072511', 'mp-1072571', 'mp-1077264', 'mp-1077149', 'mp-1077406', 'mp-1439576', 'mp-1803785', 'mp-1590449', 'mp-1072552']",0.00302495,"{'Zr': 4.0, 'Fe': 2.0}",113.03403368002292,[],NM,False,140,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",5.352281788975234e-05,0.00302495,0,0.0060499,MP,data/source/MP/cleaned/cifs/MP-mp-1159.cif,True,,data/final/MP/graphs/Fe30Zr70-MP-mp-1159-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B4Ho1Rh4,1,0.0,2.0,False,B8Ho2Rh8,B8Ho2Rh8,0.7,Other,True,B44.444Ho11.111Rh44.444,B-Ho-Rh,3,Supercon,Ho1Rh4B4,MP-mp-1189784,Ho2B8Rh8,B-Ho-Rh,B44.444Ho11.111Rh44.444,P 42/n m c,tetragonal,5.334437,5.334437,7.442515,data/final/MP/cifs/B4Ho1Rh4-MP-mp-1189784.cif,data/source/MP/raw/cifs/mp-1189784.cif,mp-1189784,0.0,,2019-01-11 20:27:24.618000,9.719214946416653,,,{'GGA': {'task_id': 'mp-1671459'}},0.0130335600000011,6.87149626,520.0,-131.93964083,-7.329980046111111,{'tags': ['Holmium rhodium boride (1/4/4)']},-131.93964083,-7.329980046111111,-0.5791792201851851,['bandstructure'],True,[601533],True,2021-05-12 10:58:33.577000,NM,18,5,mp-1189784,,Ho(BRh)4,"{'functional': 'PBE', 'labels': ['Ho_3', 'B', 'Rh_pv'], 'pot_type': 'paw'}","{'Ho': 1.0, 'B': 4.0, 'Rh': 4.0}",GGA,mp-1189784,"['mp-1189784', 'mp-1430146', 'mp-1671459', 'mp-1786743', 'mp-1604112']",0.00025395,"{'Ho': 2.0, 'B': 8.0, 'Rh': 8.0}",211.7858301043884,[],NM,False,137,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.39817744062319e-06,0.00025395,0,0.0005079,MP,data/source/MP/cleaned/cifs/MP-mp-1189784.cif,False,,data/final/MP/graphs/B4Ho1Rh4-MP-mp-1189784.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
La0.9Pr0.1Se1,3,0.0999999999999999,1.0,True,La0.9Pr0.1Se1,La1Se1,0.48,Other,True,La45Pr5Se50,La-Pr-Se,3,Supercon,La0.9Pr0.1Se1,MP-mp-1161,La1Se1,La-Se,La50Se50,F m -3 m,cubic,4.31451102,4.314511019999999,4.31451102,data/final/MP/cifs/La0.9Pr0.1Se1-MP-mp-1161-synth_doped.cif,data/source/MP/raw/cifs/mp-1161.cif,mp-1161,0.0,,2011-05-12 18:01:53,6.370268690982408,10.17188/1188105,"@misc{osti_1188105,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaSe (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188105"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668729'}},0.0,7.8532263,520.0,-12.42054673,-6.210273365,"{'tags': ['Lanthanum(II) selenide', 'Lanthanum selenide (1/1)']}",-12.42054673,-6.210273365,-2.2303140736718747,"['xas', 'bandstructure']",True,"[183943, 641921, 29395, 641924, 641930, 641926, 27104]",True,2021-05-12 10:56:51.169000,NM,2,13,mp-1161,,LaSe,"{'functional': 'PBE', 'labels': ['La', 'Se'], 'pot_type': 'paw'}","{'La': 1.0, 'Se': 1.0}",GGA,mp-1161,"['mp-1000461', 'mp-1006939', 'mp-1161', 'mp-1056965', 'mp-1056977', 'mp-1056998', 'mp-1442026', 'mp-1668729', 'mp-1792555', 'mp-1011660', 'mp-1591521', 'mp-1595264', 'mp-1057003']",0.0004867,"{'La': 1.0, 'Se': 1.0}",56.79103060602274,[],NM,False,225,0,"[0, 0]",8.570015278933591e-06,0.0004867,0,0.0004867,MP,data/source/MP/cleaned/cifs/MP-mp-1161.cif,True,,data/final/MP/graphs/La0.9Pr0.1Se1-MP-mp-1161-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ba1.85Cu2La2Ti2O10.7,2,0.0469002695417789,0.5,False,Ba0.925Cu1La1Ti1O5.35,Ba1Cu1La1Ti1O6,0.0,Cuprate,True,Ba9.973Cu10.782La10.782Ti10.782O57.68194070080863,Ba-Cu-La-Ti-O,5,Supercon,La2Ba1.85Cu2Ti2O10.7,MP-mp-1227852,Ba1La1Ti1Cu1O6,Ba-Cu-La-Ti-O,Ba10Cu10La10Ti10O60,F -4 3 m,cubic,5.61997722,5.619977219999999,5.619977219999999,data/final/MP/cifs/Ba1.85Cu2La2Ti2O10.7-MP-mp-1227852-synth_doped.cif,data/source/MP/raw/cifs/mp-1227852.cif,mp-1227852,0.0,,2019-01-13 03:38:10.917000,6.398590577851808,,,{'GGA': {'task_id': 'mp-1734188'}},0.1228187138579528,4.96777084,520.0,-72.7941219,-7.279412189999999,{'tags': []},-72.7941219,-7.279412189999999,-2.8378679248333327,['bandstructure'],True,[],True,2021-05-12 10:58:49.477000,FM,10,5,mp-1227852,oxide,BaLaTiCuO6,"{'functional': 'PBE', 'labels': ['Ba_sv', 'La', 'Ti_pv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 1.0, 'La': 1.0, 'Ti': 1.0, 'Cu': 1.0, 'O': 6.0}",GGA,mp-1227852,"['mp-1227852', 'mp-1389128', 'mp-1734188', 'mp-1805149', 'mp-1621737']",1.9113509,"{'Ba': 1.0, 'La': 1.0, 'Ti': 1.0, 'Cu': 1.0, 'O': 6.0}",125.51298752546604,[],FM,True,216,1,"[0.0, 0.0, 0.0, 0.9, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0152283117283954,1.9113509,1,1.9113509,MP,data/source/MP/cleaned/cifs/MP-mp-1227852.cif,True,,data/final/MP/graphs/Ba1.85Cu2La2Ti2O10.7-MP-mp-1227852-synth_doped.json,0,True,-43m,5,0,0,0,0,0,0,0,0,0,1,1.0,False
Te2Ti1,1,0.0,1.0,True,Te2Ti1,Te2Ti1,0.0,Other,True,Te66.667Ti33.333,Te-Ti,2,Supercon,Te2Ti1,MP-mp-1907,Ti1Te2,Te-Ti,Te66.667Ti33.333,P -3 m 1,trigonal,3.779459996726725,3.77946054,6.816936,data/final/MP/cifs/Te2Ti1-MP-mp-1907.cif,data/source/MP/raw/cifs/mp-1907.cif,mp-1907,0.0,,2011-05-12 19:16:39,5.967718226177564,10.17188/1193853,"@misc{osti_1193853,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TiTe2 (SG:164) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1193853"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668780'}},0.0,5.74226167,520.0,-16.27253071,-5.424176903333334,"{'tags': ['Titanium(IV) telluride', 'Titanium telluride (1/2)', 'Titanium telluride']}",-16.27253071,-5.424176903333334,-0.978145611111112,"['xas', 'elasticity', 'bandstructure']",True,"[43413, 603791, 30051, 657477, 26863, 15543, 56011, 653074, 653078, 653071, 80092, 653079]",True,2021-05-12 10:56:14.760000,NM,3,9,mp-1907,,TiTe2,"{'functional': 'PBE', 'labels': ['Ti_pv', 'Te'], 'pot_type': 'paw'}","{'Ti': 1.0, 'Te': 2.0}",GGA,mp-1907,"['mp-921958', 'mp-922208', 'mp-907593', 'mp-1907', 'mp-1440863', 'mp-1668780', 'mp-1923988', 'mp-1590099', 'mp-1587806']",2.39e-05,"{'Ti': 1.0, 'Te': 2.0}",84.32948309954074,[],NM,False,164,0,"[0, 0, 0]",2.8341214865255305e-07,2.39e-05,0,2.39e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1907.cif,False,,data/final/MP/graphs/Te2Ti1-MP-mp-1907.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ba0.24Cu1La1.76O4,3,0.0685714285714285,1.0,True,Ba0.24Cu1La1.76O4,Cu1La2O4,14.0,Cuprate,True,Ba3.429Cu14.286La25.143O57.142857142857146,Ba-Cu-La-O,4,Supercon,La1.76Ba0.24Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ba0.24Cu1La1.76O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ba0.24Cu1La1.76O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As2Ba0.75Fe2K0.25,1,0.0,4.0,False,As8Ba3Fe8K1,As8Ba3Fe8K1,28.45,Ferrite,True,As40Ba15Fe40K5,As-Ba-Fe-K,4,Supercon,Ba0.75K0.25Fe2As2,MP-mp-1223625,K1Ba3Fe8As8,As-Ba-Fe-K,As40Ba15Fe40K5,P -1,triclinic,7.16214702,7.85870106,8.719984900000002,data/final/MP/cifs/As2Ba0.75Fe2K0.25-MP-mp-1223625.cif,data/source/MP/raw/cifs/mp-1223625.cif,mp-1223625,0.0,,2019-01-12 23:59:40.148000,6.109504575325467,,,,0.0102233117499999,4.42230604,520.0,-121.58751246,-6.079375623,{'tags': []},-121.58751246,-6.079375623,-0.4843593091499997,[],False,[],True,2021-05-12 11:00:52.054000,FiM,20,2,mp-1223625,,KBa3(FeAs)8,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 3.0, 'Fe': 8.0, 'As': 8.0}",GGA,mp-1223625,"['mp-1223625', 'mp-1659033']",0.1971845,"{'K': 1.0, 'Ba': 3.0, 'Fe': 8.0, 'As': 8.0}",406.936299397694,[],FiM,True,2,4,"[-0.0, -0.0, -0.0, -0.0, 1.3, -1.1, -1.7, 1.7, 1.3, -1.1, 1.7, -1.7, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0004845586404846,0.1971845,8,0.1971845,MP,data/source/MP/cleaned/cifs/MP-mp-1223625.cif,False,,data/final/MP/graphs/As2Ba0.75Fe2K0.25-MP-mp-1223625.json,0,True,-1,0,0,0,0,0,2,0,1,0,0,0,1.0,False
B12Lu0.015Zr0.985,2,0.0023076923076923,1.0,True,B12Lu0.015Zr0.985,B12Zr1,5.67,Other,True,B92.308Lu0.115Zr7.577,B-Lu-Zr,3,Supercon,Zr0.985Lu0.015B12,MP-mp-1084,Zr1B12,B-Zr,B92.308Zr7.692,F m -3 m,cubic,5.23882121,5.23882121,5.23882121,data/final/MP/cifs/B12Lu0.015Zr0.985-MP-mp-1084-synth_doped.cif,data/source/MP/raw/cifs/mp-1084.cif,mp-1084,0.0,,2011-05-13 01:55:40,3.608852766615364,10.17188/1187388,"@misc{osti_1187388,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrB12 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187388"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701270'}},0.0158721137179496,6.88737846,520.0,-91.45613101,-7.03508700076923,{'tags': ['Zirconium boride (1/12)']},-91.45613101,-7.03508700076923,-0.2119791638461532,"['xas', 'elasticity', 'bandstructure']",True,"[615764, 615752, 35363, 23861, 409634, 76257, 409635]",True,2021-05-12 10:56:10.715000,NM,13,8,mp-1084,,ZrB12,"{'functional': 'PBE', 'labels': ['Zr_sv', 'B'], 'pot_type': 'paw'}","{'Zr': 1.0, 'B': 12.0}",GGA,mp-1084,"['mp-922210', 'mp-1084', 'mp-907581', 'mp-921959', 'mp-1427051', 'mp-1701270', 'mp-1798000', 'mp-1593176']",1.76e-05,"{'Zr': 1.0, 'B': 12.0}",101.66833997602512,[],NM,False,225,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.7311190488750325e-07,1.76e-05,0,1.76e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1084.cif,True,,data/final/MP/graphs/B12Lu0.015Zr0.985-MP-mp-1084-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ce1Co0.8In5Rh0.2,3,0.0571428571428571,1.0,True,Ce1Co0.8In5Rh0.2,Ce1Co1In5,1.57,Heavy_fermion,True,Ce14.286Co11.429In71.429Rh2.857,Ce-Co-In-Rh,4,Supercon,Ce1Rh0.2Co0.8In5,MP-mp-19961,Ce1In5Co1,Ce-Co-In,Ce14.286Co14.286In71.429,P 4/m m m,tetragonal,4.635989,4.635989,7.564124,data/final/MP/cifs/Ce1Co0.8In5Rh0.2-MP-mp-19961-synth_doped.cif,data/source/MP/raw/cifs/mp-19961.cif,mp-19961,0.0,,2014-02-21 14:08:25,7.897022127398995,10.17188/1195145,"@misc{osti_1195145,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeIn5Co (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195145"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701944'}},0.0,7.80626318,520.0,-28.52795357,-4.075421938571429,{'tags': ['Cerium cobalt indium (1/1/5)']},-28.52795357,-4.075421938571429,-0.2468754242857146,"['xas', 'bandstructure']",True,[102108],True,2021-05-12 10:56:57.051000,FM,7,8,mp-19961,,CeIn5Co,"{'functional': 'PBE', 'labels': ['Ce', 'In_d', 'Co'], 'pot_type': 'paw'}","{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",GGA,mp-19961,"['mp-928775', 'mp-912209', 'mp-928270', 'mp-19961', 'mp-1504062', 'mp-1701944', 'mp-1785253', 'mp-1593180']",0.9310323,"{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",162.57113333428427,[],FM,True,123,1,"[0.7, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0057269226147644,0.9310323,1,0.9310323,MP,data/source/MP/cleaned/cifs/MP-mp-19961.cif,True,,data/final/MP/graphs/Ce1Co0.8In5Rh0.2-MP-mp-19961-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Bi1S1,1,0.0,10.0,False,Bi10S10,Bi10S10,0.0,Other,True,Bi50S50,Bi-S,2,Supercon,Bi1S1,MP-mp-28677,Bi10S10,Bi-S,Bi50S50,A m m 2,orthorhombic,5.653613997922504,12.22808424,15.24353,data/final/MP/cifs/Bi1S1-MP-mp-28677.cif,data/source/MP/raw/cifs/mp-28677.cif,mp-28677,0.0,,2014-02-20 03:03:23,3.90394778627873,10.17188/1202754,"@misc{osti_1202754,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BiS (SG:38) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1202754"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1736729'}},0.2280339124999999,1.2240078,520.0,-81.40691995,-4.0703459975000005,{'tags': ['Bismuth(II) sulfide']},-81.40691995,-4.0703459975000005,-0.3086039090625,"['xas', 'bandstructure']",True,[67650],True,2021-05-12 10:57:03.017000,NM,20,7,mp-28677,,BiS,"{'functional': 'PBE', 'labels': ['Bi', 'S'], 'pot_type': 'paw'}","{'Bi': 1.0, 'S': 1.0}",GGA,mp-28677,"['mp-916209', 'mp-931587', 'mp-932631', 'mp-28677', 'mp-1410983', 'mp-1736729', 'mp-1845676']",0.06012533,"{'Bi': 10.0, 'S': 10.0}",1025.2834449554955,[],NM,False,38,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0005864264198922,0.06012533,0,0.6012533,MP,data/source/MP/cleaned/cifs/MP-mp-28677.cif,False,,data/final/MP/graphs/Bi1S1-MP-mp-28677.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
As1F0.1Fe1Pr1O0.9,2,0.0499999999999999,2.0,False,As2F0.2Fe2Pr2O1.8,As2Fe2Pr2O2,43.5,Ferrite,True,As25F2.5Fe25Pr25O22.5,As-F-Fe-Pr-O,5,Supercon,Pr1Fe1As1F0.1O0.9,MP-mp-22491,Pr2Fe2As2O2,As-Fe-Pr-O,As25Fe25Pr25O25,P 4/n m m,tetragonal,4.094889,4.094889,9.258722,data/final/MP/cifs/As1F0.1Fe1Pr1O0.9-MP-mp-22491-synth_doped.cif,data/source/MP/raw/cifs/mp-22491.cif,mp-22491,0.0,,2014-02-25 19:17:30,6.153806906111091,,,{'GGA+U': {'task_id': 'mp-1695715'}},0.3808778432291664,4.12348168,520.0,-51.7633941,-6.4704242625,{'tags': ['Praseodymium iron arsenic oxide (1/1/1/1)']},-51.7633941,-6.4704242625,-1.491677511249999,"['xas', 'bandstructure']",True,"[162830, 162833, 246832, 90316, 422000, 236649, 236648, 602491]",True,2021-05-12 10:57:10.838000,FM,8,8,mp-22491,oxide,PrFeAsO,"{'functional': 'PBE', 'labels': ['Pr_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Pr': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-22491,"['mp-510622', 'mp-1079608', 'mp-1079857', 'mp-22491', 'mp-1476145', 'mp-1695715', 'mp-1778524', 'mp-1596397']",3.7947681,"{'Pr': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",155.25132378854377,[],FM,True,129,1,"[0.0, 0.0, 3.5, 3.5, 0.0, 0.0, 0.0, 0.0]",0.0488854846116297,3.7947681,2,7.5895362,MP,data/source/MP/cleaned/cifs/MP-mp-22491.cif,True,,data/final/MP/graphs/As1F0.1Fe1Pr1O0.9-MP-mp-22491-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
La1Pd2Si2,1,0.0,1.0,True,La1Pd2Si2,La1Pd2Si2,0.39,Other,True,La20Pd40Si40,La-Pd-Si,3,Supercon,La1Pd2Si2,MP-mp-4954,La1Si2Pd2,La-Pd-Si,La20Pd40Si40,I 4/m m m,tetragonal,4.305958003185077,4.305958003185077,5.84634074,data/final/MP/cifs/La1Pd2Si2-MP-mp-4954.cif,data/source/MP/raw/cifs/mp-4954.cif,mp-4954,0.0,,2011-05-12 23:20:25,7.319848038586709,10.17188/1208509,"@misc{osti_1208509,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La(SiPd)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208509"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677534'}},0.0,7.89598154,520.0,-30.84623056,-6.169246112,{'tags': ['Lanthanum palladium silicide (1/2/2)']},-30.84623056,-6.169246112,-0.9115663589999996,"['xas', 'elasticity', 'bandstructure']",True,"[603881, 641679, 656124, 601623]",True,2021-05-12 10:56:20.740000,NM,5,10,mp-4954,,La(SiPd)2,"{'functional': 'PBE', 'labels': ['La', 'Si', 'Pd'], 'pot_type': 'paw'}","{'La': 1.0, 'Si': 2.0, 'Pd': 2.0}",GGA,mp-4954,"['mp-1007518', 'mp-1001148', 'mp-4954', 'mp-1144221', 'mp-1264081', 'mp-1438020', 'mp-1677534', 'mp-1796441', 'mp-1012278', 'mp-1588413']",0.0001217,"{'La': 1.0, 'Si': 2.0, 'Pd': 2.0}",92.53760881016176,[],NM,False,139,0,"[0, 0, 0, 0, 0]",1.315140963385644e-06,0.0001217,0,0.0001217,MP,data/source/MP/cleaned/cifs/MP-mp-4954.cif,False,,data/final/MP/graphs/La1Pd2Si2-MP-mp-4954.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ba0.55Bi1K0.45O3,2,0.0466666666666666,3.0,False,Ba1.65Bi3K1.35O9,Ba2Bi3K1O9,24.525,Oxide,True,Ba11Bi20K9O60,Ba-Bi-K-O,4,Supercon,Ba0.55K0.45Bi1O3,MP-mp-1223518,K1Ba2Bi3O9,Ba-Bi-K-O,Ba13.333Bi20K6.667O60,P -3 m 1,trigonal,6.18756400330999,6.187564340000001,7.581401,data/final/MP/cifs/Ba0.55Bi1K0.45O3-MP-mp-1223518-synth_doped.cif,data/source/MP/raw/cifs/mp-1223518.cif,mp-1223518,0.0,,2019-01-12 23:54:06.965000,7.16530091201999,,,{'GGA': {'task_id': 'mp-1729135'}},0.001551682833333,3.46143017,520.0,-85.22271396,-5.681514264,{'tags': []},-85.22271396,-5.681514264,-2.0170414252000004,[],False,[],True,2021-05-12 11:00:52.054000,NM,15,4,mp-1223518,oxide,KBa2(BiO3)3,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Bi', 'O'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 2.0, 'Bi': 3.0, 'O': 9.0}",GGA,mp-1223518,"['mp-1223518', 'mp-1391182', 'mp-1729135', 'mp-1775199']",4.99e-05,"{'K': 1.0, 'Ba': 2.0, 'Bi': 3.0, 'O': 9.0}",251.37352739849624,[],NM,False,164,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.9850936777799505e-07,4.99e-05,0,4.99e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1223518.cif,True,,data/final/MP/graphs/Ba0.55Bi1K0.45O3-MP-mp-1223518-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Cd0.18Tl0.82,3,0.1399999999999999,4.0,False,Cd0.72Tl3.28,Cd1Tl3,2.54,Other,True,Cd18Tl82,Cd-Tl,2,Supercon,Cd0.18Tl0.82,MP-mp-979269,Tl3Cd1,Cd-Tl,Cd25Tl75,P m -3 m,cubic,4.903289,4.903289,4.903289,data/final/MP/cifs/Cd0.18Tl0.82-MP-mp-979269-synth_doped.cif,data/source/MP/raw/cifs/mp-979269.cif,mp-979269,0.0,,2015-10-09 15:14:50,10.220225878748494,10.17188/1316109,"@misc{osti_1316109,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Tl3Cd (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1316109"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1761465'}},0.0366714350000001,4.98981271,520.0,-7.86413346,-1.966033365,{'tags': []},-7.86413346,-1.966033365,0.0366714350000001,"['xas', 'elasticity', 'bandstructure']",True,[],True,2021-05-12 10:56:37.246000,NM,4,8,mp-979269,,Tl3Cd,"{'functional': 'PBE', 'labels': ['Tl_d', 'Cd'], 'pot_type': 'paw'}","{'Tl': 3.0, 'Cd': 1.0}",GGA,mp-979269,"['mp-982330', 'mp-979269', 'mp-982416', 'mp-1434661', 'mp-1761465', 'mp-1803362', 'mp-982716', 'mp-1585830']",0.0302426,"{'Tl': 3.0, 'Cd': 1.0}",117.88606572313752,[],NM,False,221,0,"[0, 0, 0, 0]",0.0002565409220715,0.0302426,0,0.0302426,MP,data/source/MP/cleaned/cifs/MP-mp-979269.cif,True,,data/final/MP/graphs/Cd0.18Tl0.82-MP-mp-979269-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
B2Ta0.84,3,0.0751173708920188,1.0,True,B2Ta0.84,B2Ta1,0.0,Other,True,B70.423Ta29.577,B-Ta,2,Supercon,B2Ta0.84,MP-mp-1108,Ta1B2,B-Ta,B66.667Ta33.333,P 6/m m m,hexagonal,3.096679998231196,3.09668039,3.34261,data/final/MP/cifs/B2Ta0.84-MP-mp-1108-synth_doped.cif,data/source/MP/raw/cifs/mp-1108.cif,mp-1108,0.0,,2011-05-12 18:00:51,12.117552130391864,10.17188/1187553,"@misc{osti_1187553,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TaB2 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187553"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686770'}},0.0,9.24259718,520.0,-27.16421123,-9.054737076666669,{'tags': ['Tantalum boride (1/2)']},-27.16421123,-9.054737076666669,-0.6492166861111102,"['xas', 'elasticity', 'bandstructure']",True,"[30420, 615520, 30329, 44588, 602947, 615507, 247644, 615505, 191905, 615518, 615508, 615501, 615498, 615494, 108085, 615525]",True,2021-05-12 10:56:10.715000,NM,3,17,mp-1108,,TaB2,"{'functional': 'PBE', 'labels': ['Ta_pv', 'B'], 'pot_type': 'paw'}","{'Ta': 1.0, 'B': 2.0}",GGA,mp-1108,"['mp-1007029', 'mp-1000553', 'mp-1108', 'mp-1062719', 'mp-1062745', 'mp-1062807', 'mp-1062781', 'mp-1062797', 'mp-1062839', 'mp-1440846', 'mp-1686770', 'mp-1792080', 'mp-1011769', 'mp-1592578', 'mp-1594918', 'mp-1062772', 'mp-1062825']",0.0031646,"{'Ta': 1.0, 'B': 2.0}",27.75933586560078,[],NM,False,191,0,"[0, 0, 0]",0.0001140012864616,0.0031646,0,0.0031646,MP,data/source/MP/cleaned/cifs/MP-mp-1108.cif,True,,data/final/MP/graphs/B2Ta0.84-MP-mp-1108-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
As2Ba1Fe1.3Ru0.7,3,0.12,1.0,True,As2Ba1Fe1.3Ru0.7,As2Ba1Fe1Ru1,19.7,Ferrite,True,As40Ba20Fe26Ru14,As-Ba-Fe-Ru,4,Supercon,Ba1Fe1.3Ru0.7As2,MP-mp-1227957,Ba1Fe1As2Ru1,As-Ba-Fe-Ru,As40Ba20Fe20Ru20,I -4 m 2,tetragonal,4.094864001738776,4.094864001738776,6.95494631,data/final/MP/cifs/As2Ba1Fe1.3Ru0.7-MP-mp-1227957-synth_doped.cif,data/source/MP/raw/cifs/mp-1227957.cif,mp-1227957,0.0,,2019-01-13 03:43:43.313000,6.954649854678861,,,{'GGA': {'task_id': 'mp-1760595'}},0.0416149764999991,4.99960359,520.0,-31.92363508,-6.384727016,{'tags': []},-31.92363508,-6.384727016,-0.5884058670000002,['bandstructure'],True,[],True,2021-05-12 10:58:49.477000,FM,5,5,mp-1227957,,BaFeAs2Ru,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Fe_pv', 'As', 'Ru_pv'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Fe': 1.0, 'As': 2.0, 'Ru': 1.0}",GGA,mp-1227957,"['mp-1227957', 'mp-1384589', 'mp-1760595', 'mp-1795888', 'mp-1627878']",0.1424858,"{'Ba': 1.0, 'Fe': 1.0, 'As': 2.0, 'Ru': 1.0}",106.03277503651196,[],FM,True,119,1,"[0.0, 0.2, 0.0, 0.0, -0.0]",0.0013437901625316,0.1424858,1,0.1424858,MP,data/source/MP/cleaned/cifs/MP-mp-1227957.cif,True,,data/final/MP/graphs/As2Ba1Fe1.3Ru0.7-MP-mp-1227957-synth_doped.json,0,True,-42m,0,0,0,0,6,0,0,0,0,1,0,1.0,False
As2Ba0.511Co0.228Fe1.772K0.489,3,0.0955999999999999,2.0,False,As4Ba1.022Co0.456Fe3.544K0.978,As4Ba1Fe4K1,22.0,Ferrite,True,As40Ba10.22Co4.56Fe35.44K9.78,As-Ba-Co-Fe-K,5,Supercon,Ba0.511K0.489Fe1.772Co0.228As2,MP-mp-1223517,K1Ba1Fe4As4,As-Ba-Fe-K,As40Ba10Fe40K10,C m m m,orthorhombic,5.479027,5.480024002658328,7.13170472,data/final/MP/cifs/As2Ba0.511Co0.228Fe1.772K0.489-MP-mp-1223517-synth_doped.cif,data/source/MP/raw/cifs/mp-1223517.cif,mp-1223517,0.0,,2019-01-12 23:54:03.876000,5.87534599912672,,,{'GGA': {'task_id': 'mp-1743010'}},0.0132513644999994,4.21185628,520.0,-59.66633886,-5.966633886,{'tags': []},-59.66633886,-5.966633886,-0.4120461663000007,[],False,[],True,2021-05-12 11:00:52.054000,FM,10,4,mp-1223517,,KBa(FeAs)4,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",GGA,mp-1223517,"['mp-1223517', 'mp-1396881', 'mp-1743010', 'mp-1827585']",0.9947188,"{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",197.6961518155852,[],FM,True,65,1,"[0.0, 0.0, 0.3, 0.3, 0.3, 0.3, 0.0, 0.0, 0.0, 0.0]",0.0050315536790412,0.9947188,4,0.9947188,MP,data/source/MP/cleaned/cifs/MP-mp-1223517.cif,True,,data/final/MP/graphs/As2Ba0.511Co0.228Fe1.772K0.489-MP-mp-1223517-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Pt1Y1,1,0.0,4.0,False,Pt4Y4,Pt4Y4,0.0,Other,True,Pt50Y50,Pt-Y,2,Supercon,Pt1Y1,MP-mp-1025448,Y4Pt4,Pt-Y,Pt50Y50,P n m a,orthorhombic,4.554193,5.594387,7.057355,data/final/MP/cifs/Pt1Y1-MP-mp-1025448.cif,data/source/MP/raw/cifs/mp-1025448.cif,mp-1025448,0.0,,2016-10-10 00:45:42,10.490737150110771,10.17188/1355214,"@article{osti_1355214,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YPt (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1355214"",
    place = ""United States"",
    year = ""2017"",
    month = ""5""
}
",{'GGA': {'task_id': 'mp-1703742'}},0.0,4.92370917,520.0,-60.20091844,-7.525114805,"{'tags': ['Platinum thulium (1/1)', 'YPt', 'Platinum yttrium (1/1)', 'FeB-b']}",-60.20091844,-7.525114805,-1.2564253933333331,"['bandstructure', 'elasticity']",True,"[649850, 649793]",True,2021-05-12 10:56:10.715000,NM,8,5,mp-1025448,,YPt,"{'functional': 'PBE', 'labels': ['Y_sv', 'Pt'], 'pot_type': 'paw'}","{'Y': 1.0, 'Pt': 1.0}",GGA,mp-1025448,"['mp-1025448', 'mp-1420834', 'mp-1703742', 'mp-1831822', 'mp-1592248']",0.00017345,"{'Y': 4.0, 'Pt': 4.0}",179.8067127963051,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0]",3.858587864769958e-06,0.00017345,0,0.0006938,MP,data/source/MP/cleaned/cifs/MP-mp-1025448.cif,False,,data/final/MP/graphs/Pt1Y1-MP-mp-1025448.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ge2Ti1,1,0.0,2.0,False,Ge4Ti2,Ge4Ti2,0.0,Other,True,Ge66.667Ti33.333,Ge-Ti,2,Supercon,Ti1Ge2,MP-mp-567889,Ti2Ge4,Ge-Ti,Ge66.667Ti33.333,F d d d,orthorhombic,5.02974504775364,5.02974505,5.11100978,data/final/MP/cifs/Ge2Ti1-MP-mp-567889.cif,data/source/MP/raw/cifs/mp-567889.cif,mp-567889,0.0,,2015-02-15 03:46:22,6.553899874919122,10.17188/1274109,"@misc{osti_1274109,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TiGe2 (SG:70) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1274109"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704111'}},0.0,5.6232722,520.0,-36.79630536,-6.13271756,{'tags': ['Titanium germanide (1/2)']},-36.79630536,-6.13271756,-0.4188683177777778,"['xas', 'elasticity', 'bandstructure']",True,"[638053, 638050]",True,2021-05-12 10:56:22.739000,NM,6,8,mp-567889,,TiGe2,"{'functional': 'PBE', 'labels': ['Ti_pv', 'Ge_d'], 'pot_type': 'paw'}","{'Ti': 1.0, 'Ge': 2.0}",GGA,mp-567889,"['mp-944470', 'mp-943825', 'mp-933652', 'mp-567889', 'mp-1504692', 'mp-1704111', 'mp-1798259', 'mp-1587745']",4.435e-05,"{'Ti': 2.0, 'Ge': 4.0}",97.87398197032972,[],NM,False,70,0,"[0, 0, 0, 0, 0, 0]",9.062674085017736e-07,4.435e-05,0,8.87e-05,MP,data/source/MP/cleaned/cifs/MP-mp-567889.cif,False,,data/final/MP/graphs/Ge2Ti1-MP-mp-567889.json,0,True,mmm,0,0,0,7,0,0,0,0,0,0,1,1.0,False
B4Er0.134Ho0.866Rh4,2,0.0297777777777777,2.0,False,B8Er0.268Ho1.732Rh8,B8Ho2Rh8,6.15,Other,True,B44.444Er1.489Ho9.622Rh44.444,B-Er-Ho-Rh,4,Supercon,Er0.134Ho0.866Rh4B4,MP-mp-1189784,Ho2B8Rh8,B-Ho-Rh,B44.444Ho11.111Rh44.444,P 42/n m c,tetragonal,5.334437,5.334437,7.442515,data/final/MP/cifs/B4Er0.134Ho0.866Rh4-MP-mp-1189784-synth_doped.cif,data/source/MP/raw/cifs/mp-1189784.cif,mp-1189784,0.0,,2019-01-11 20:27:24.618000,9.719214946416653,,,{'GGA': {'task_id': 'mp-1671459'}},0.0130335600000011,6.87149626,520.0,-131.93964083,-7.329980046111111,{'tags': ['Holmium rhodium boride (1/4/4)']},-131.93964083,-7.329980046111111,-0.5791792201851851,['bandstructure'],True,[601533],True,2021-05-12 10:58:33.577000,NM,18,5,mp-1189784,,Ho(BRh)4,"{'functional': 'PBE', 'labels': ['Ho_3', 'B', 'Rh_pv'], 'pot_type': 'paw'}","{'Ho': 1.0, 'B': 4.0, 'Rh': 4.0}",GGA,mp-1189784,"['mp-1189784', 'mp-1430146', 'mp-1671459', 'mp-1786743', 'mp-1604112']",0.00025395,"{'Ho': 2.0, 'B': 8.0, 'Rh': 8.0}",211.7858301043884,[],NM,False,137,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.39817744062319e-06,0.00025395,0,0.0005079,MP,data/source/MP/cleaned/cifs/MP-mp-1189784.cif,True,,data/final/MP/graphs/B4Er0.134Ho0.866Rh4-MP-mp-1189784-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B2C1Lu0.16Ni2Y0.84,3,0.0533333333333333,1.0,True,B2C1Lu0.16Ni2Y0.84,B2C1Ni2Y1,14.8,Other,True,B33.333C16.667Lu2.667Ni33.333Y14,B-C-Lu-Ni-Y,5,Supercon,Y0.84Lu0.16Ni2B2C1,MP-mp-6576,Y1Ni2B2C1,B-C-Ni-Y,B33.333C16.667Ni33.333Y16.667,I 4/m m m,tetragonal,3.548790000501972,3.548790000501972,5.76144136,data/final/MP/cifs/B2C1Lu0.16Ni2Y0.84-MP-mp-6576-synth_doped.cif,data/source/MP/raw/cifs/mp-6576.cif,mp-6576,0.0,,2011-05-13 05:21:43,6.099730998852292,10.17188/1281366,"@misc{osti_1281366,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281366"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688230'}},0.0,6.81083016,520.0,-43.677878,-7.279646333333333,{'tags': []},-43.677878,-7.279646333333333,-0.5109282141666659,"['xas', 'bandstructure']",True,"[75816, 89142, 83231, 79574, 41549]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6576,,YNi2B2C,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6576,"['mp-6576', 'mp-1007054', 'mp-1000583', 'mp-1439516', 'mp-1688230', 'mp-1794280', 'mp-1011792', 'mp-1597064']",0.0006603,"{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.3152437079014,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",1.010943177297096e-05,0.0006603,0,0.0006603,MP,data/source/MP/cleaned/cifs/MP-mp-6576.cif,True,,data/final/MP/graphs/B2C1Lu0.16Ni2Y0.84-MP-mp-6576-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Pb1Sb1,1,0.0,1.0,True,Pb1Sb1,Pb1Sb1,4.05,Other,True,Pb50Sb50,Pb-Sb,2,Supercon,Pb1Sb1,MP-mp-1206982,Sb1Pb1,Pb-Sb,Pb50Sb50,F m -3 m,cubic,4.49650616,4.49650616,4.49650616,data/final/MP/cifs/Pb1Sb1-MP-mp-1206982.cif,data/source/MP/raw/cifs/mp-1206982.cif,mp-1206982,0.0,,2019-01-12 10:11:00.206000,8.497312867052623,,,{'GGA': {'task_id': 'mp-1766321'}},0.0,6.15121262,520.0,-7.67955297,-3.839776485,"{'tags': ['NaCl', 'PbSb m']}",-7.67955297,-3.839776485,-0.0149523299999998,['bandstructure'],True,[],True,2021-05-12 10:58:39.488000,NM,2,5,mp-1206982,,SbPb,"{'functional': 'PBE', 'labels': ['Sb', 'Pb_d'], 'pot_type': 'paw'}","{'Sb': 1.0, 'Pb': 1.0}",GGA,mp-1206982,"['mp-1206982', 'mp-1429080', 'mp-1766321', 'mp-1795435', 'mp-1612573']",0.0009864,"{'Sb': 1.0, 'Pb': 1.0}",64.2851381248727,[],NM,False,225,0,"[0, 0]",1.5344137521862924e-05,0.0009864,0,0.0009864,MP,data/source/MP/cleaned/cifs/MP-mp-1206982.cif,False,,data/final/MP/graphs/Pb1Sb1-MP-mp-1206982.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Mo1Ru1,1,0.0,1.0,True,Mo1Ru1,Mo1Ru1,10.0,Other,True,Mo50Ru50,Mo-Ru,2,Supercon,Mo1Ru1,MP-mp-1221386,Mo1Ru1,Mo-Ru,Mo50Ru50,P -6 m 2,hexagonal,2.777414004047596,2.7774148,4.463707,data/final/MP/cifs/Mo1Ru1-MP-mp-1221386.cif,data/source/MP/raw/cifs/mp-1221386.cif,mp-1221386,0.0,,2019-01-12 22:05:14.676000,10.97058156361833,,,{'GGA': {'task_id': 'mp-1675533'}},0.0999567891666668,7.97970583,520.0,-20.00158449,-10.000792245,{'tags': []},-20.00158449,-10.000792245,0.0592240974999995,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,2,5,mp-1221386,,MoRu,"{'functional': 'PBE', 'labels': ['Mo_pv', 'Ru_pv'], 'pot_type': 'paw'}","{'Mo': 1.0, 'Ru': 1.0}",GGA,mp-1221386,"['mp-1221386', 'mp-1423242', 'mp-1675533', 'mp-1926969', 'mp-1607065']",1.05e-05,"{'Mo': 1.0, 'Ru': 1.0}",29.820005403885563,[],NM,False,187,0,"[0, 0]",3.521126122476102e-07,1.05e-05,0,1.05e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1221386.cif,False,,data/final/MP/graphs/Mo1Ru1-MP-mp-1221386.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Ni30Zr70,3,0.0666666666666666,0.0571380952380952,False,Ni1.714Zr4,Ni2Zr4,2.58,Other,True,Ni30Zr70,Ni-Zr,2,Supercon,Ni30Zr70,MP-mp-328,Zr4Ni2,Ni-Zr,Ni33.333Zr66.667,I 4/m c m,tetragonal,5.262569995425936,5.300086679397286,5.30008668,data/final/MP/cifs/Ni30Zr70-MP-mp-328-synth_doped.cif,data/source/MP/raw/cifs/mp-328.cif,mp-328,0.0,,2011-05-13 23:00:52,7.189329355994663,10.17188/1206385,"@misc{osti_1206385,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Zr2Ni (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1206385"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704571'}},0.0,5.05377097,520.0,-47.68946569,-7.948244281666667,{'tags': ['Nickel zirconium (1/2)']},-47.68946569,-7.948244281666667,-0.3230649683333328,"['xas', 'elasticity', 'bandstructure']",True,"[656070, 647167, 102805, 105479]",True,2021-05-12 10:56:20.740000,NM,6,11,mp-328,,Zr2Ni,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Ni_pv'], 'pot_type': 'paw'}","{'Zr': 2.0, 'Ni': 1.0}",GGA,mp-328,"['mp-918996', 'mp-919988', 'mp-906163', 'mp-604722', 'mp-328', 'mp-1076983', 'mp-1205320', 'mp-1413019', 'mp-1704571', 'mp-1802467', 'mp-1592827']",0.00134705,"{'Zr': 4.0, 'Ni': 2.0}",111.39417752247834,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0]",2.4185285621920005e-05,0.00134705,0,0.0026941,MP,data/source/MP/cleaned/cifs/MP-mp-328.cif,True,,data/final/MP/graphs/Ni30Zr70-MP-mp-328-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Sb1Te2Tl1,1,0.0,1.0,True,Sb1Te2Tl1,Sb1Te2Tl1,0.0,Other,True,Sb25Te50Tl25,Sb-Te-Tl,3,Supercon,Sb1Te2Tl1,MP-mp-4573,Tl1Sb1Te2,Sb-Te-Tl,Sb25Te50Tl25,R -3 m,trigonal,4.502372449246354,4.502372449246354,8.31546622,data/final/MP/cifs/Sb1Te2Tl1-MP-mp-4573.cif,data/source/MP/raw/cifs/mp-4573.cif,mp-4573,0.1322999999999998,,2011-05-12 21:20:05,6.961636047726495,10.17188/1208259,"@misc{osti_1208259,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TlSbTe2 (SG:166) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208259"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702518'}},0.0,5.29710403,520.0,-13.70122856,-3.42530714,"{'tags': ['Antimony thallium telluride', 'Thallium antimony telluride', 'Antimony thallium telluride (1/1/2)']}",-13.70122856,-3.42530714,-0.4417455783333333,"['diel', 'bandstructure', 'elasticity']",True,"[15411, 651642, 651646]",True,2021-05-12 10:56:20.740000,NM,4,13,mp-4573,,TlSbTe2,"{'functional': 'PBE', 'labels': ['Tl_d', 'Sb', 'Te'], 'pot_type': 'paw'}","{'Tl': 1.0, 'Sb': 1.0, 'Te': 2.0}",GGA,mp-4573,"['mp-908746', 'mp-923749', 'mp-4573', 'mp-922971', 'mp-1067914', 'mp-1067945', 'mp-1067975', 'mp-1141460', 'mp-1441470', 'mp-1702518', 'mp-1878404', 'mp-1591806', 'mp-1067968']",9.27e-05,"{'Tl': 1.0, 'Sb': 1.0, 'Te': 2.0}",138.66614889633908,[],NM,False,166,0,"[0, 0, 0, 0]",6.685121115557812e-07,9.27e-05,0,9.27e-05,MP,data/source/MP/cleaned/cifs/MP-mp-4573.cif,False,,data/final/MP/graphs/Sb1Te2Tl1-MP-mp-4573.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
As1F0.1Fe1Nd1O0.9,2,0.0499999999999999,2.0,False,As2F0.2Fe2Nd2O1.8,As2Fe2Nd2O2,50.525,Ferrite,True,As25F2.5Fe25Nd25O22.5,As-F-Fe-Nd-O,5,Supercon,Nd1Fe1As1F0.1O0.9,MP-mp-622621,Nd2Fe2As2O2,As-Fe-Nd-O,As25Fe25Nd25O25,P 4/n m m,tetragonal,4.074653,4.074653,9.170967,data/final/MP/cifs/As1F0.1Fe1Nd1O0.9-MP-mp-622621-synth_doped.cif,data/source/MP/raw/cifs/mp-622621.cif,mp-622621,0.0,,2014-02-16 22:28:25,6.347279619112142,10.17188/1278150,"@misc{osti_1278150,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NdFeAsO (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278150"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-1677677'}},0.2809314202083302,3.74777613,520.0,-52.70842543,-6.58855317875,{'tags': ['Neodymium iron arsenic oxide (1/1/1/1)']},-52.70842543,-6.58855317875,-1.61299541125,"['xas', 'bandstructure']",True,"[163547, 164679, 422001, 163546, 236651, 236650, 602466, 164680, 164676]",True,2021-05-12 10:57:28.836000,FM,8,8,mp-622621,oxide,NdFeAsO,"{'functional': 'PBE', 'labels': ['Nd_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Nd': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-622621,"['mp-622621', 'mp-1079381', 'mp-1173401', 'mp-1438697', 'mp-1677677', 'mp-1772072', 'mp-1926310', 'mp-1592869']",3.83954265,"{'Nd': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",152.26370404041757,[],FM,True,129,1,"[0.0, 0.0, 3.6, 3.6, -0.0, -0.0, -0.0, -0.0]",0.0504328024094411,3.83954265,2,7.6790853,MP,data/source/MP/cleaned/cifs/MP-mp-622621.cif,True,,data/final/MP/graphs/As1F0.1Fe1Nd1O0.9-MP-mp-622621-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B6Y1,1,0.0,1.0,True,B6Y1,B6Y1,5.692857143,Other,True,B85.714Y14.286,B-Y,2,Supercon,B6Y1,MP-mp-2203,Y1B6,B-Y,B85.714Y14.286,P m -3 m,cubic,4.1021,4.1021,4.1021,data/final/MP/cifs/B6Y1-MP-mp-2203.cif,data/source/MP/raw/cifs/mp-2203.cif,mp-2203,0.0,,2011-05-12 20:11:15,3.699194842606093,10.17188/1197299,"@misc{osti_1197299,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YB6 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197299"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686414'}},0.0285229421428576,6.62579631,520.0,-49.33978236,-7.048540337142858,"{'tags': ['Yttrium boride (1/6)', 'Yttrium octahedro-hexaboride', 'Yttrium hexaboride']}",-49.33978236,-7.048540337142858,-0.3995658030952376,"['xas', 'elasticity', 'bandstructure']",True,"[194635, 615723, 54730, 615726, 615714, 659505, 76126, 615728, 615710]",True,2021-05-12 10:56:16.728000,NM,7,9,mp-2203,,YB6,"{'functional': 'PBE', 'labels': ['Y_sv', 'B'], 'pot_type': 'paw'}","{'Y': 1.0, 'B': 6.0}",GGA,mp-2203,"['mp-1000404', 'mp-1006875', 'mp-2203', 'mp-1077859', 'mp-1440131', 'mp-1686414', 'mp-1801281', 'mp-1011609', 'mp-1592923']",3.48e-05,"{'Y': 1.0, 'B': 6.0}",69.026957252261,[],NM,False,221,0,"[0, 0, 0, 0, 0, 0, 0]",5.041508620005138e-07,3.48e-05,0,3.48e-05,MP,data/source/MP/cleaned/cifs/MP-mp-2203.cif,False,,data/final/MP/graphs/B6Y1-MP-mp-2203.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
C1.35La1,3,0.051063829787234,8.0,False,C10.8La8,C12La8,11.0,Other,True,C57.447La42.553,C-La,2,Supercon,C1.35La1,MP-mp-1184,La8C12,C-La,C60La40,I -4 3 d,cubic,7.637375841693086,7.63737584,7.63737584,data/final/MP/cifs/C1.35La1-MP-mp-1184-synth_doped.cif,data/source/MP/raw/cifs/mp-1184.cif,mp-1184,0.0,,2011-05-15 20:02:16,6.078703935325423,10.17188/1188425,"@misc{osti_1188425,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La2C3 (SG:220) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188425"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1705323'}},0.0,8.62068433,520.0,-153.54505024,-7.677252512,"{'tags': ['Dilanthanum tricarbide', 'Lanthanum carbide (2/3)', 'High pressure experimental phase']}",-153.54505024,-7.677252512,-0.1667812499999982,"['xas', 'bandstructure']",True,"[601151, 618149, 602770, 153809, 26588, 618154, 618165, 74660, 153808]",True,2021-05-12 10:56:51.169000,NM,20,8,mp-1184,,La2C3,"{'functional': 'PBE', 'labels': ['La', 'C'], 'pot_type': 'paw'}","{'La': 2.0, 'C': 3.0}",GGA,mp-1184,"['mp-908695', 'mp-1184', 'mp-922935', 'mp-923731', 'mp-1430354', 'mp-1705323', 'mp-1841098', 'mp-1597811']",0.000412725,"{'La': 8.0, 'C': 12.0}",342.93404268099584,[],NM,False,220,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.814045252240241e-06,0.000412725,0,0.0016509,MP,data/source/MP/cleaned/cifs/MP-mp-1184.cif,True,,data/final/MP/graphs/C1.35La1-MP-mp-1184-synth_doped.json,0,True,-43m,5,0,0,0,0,0,0,0,0,1,0,1.0,False
Ba2Cu1Hg1O4.04,2,0.0049751243781094,0.9900247524752476,True,Ba1.98Cu0.99Hg0.99O4,Ba2Cu1Hg1O4,0.0,Cuprate,True,Ba24.876Cu12.438Hg12.438O50.24875621890548,Ba-Cu-Hg-O,4,Supercon,Hg1Ba2Cu1O4.04,MP-mp-6562,Ba2Cu1Hg1O4,Ba-Cu-Hg-O,Ba25Cu12.5Hg12.5O50,P 4/m m m,tetragonal,3.933714,3.933714,9.827602,data/final/MP/cifs/Ba2Cu1Hg1O4.04-MP-mp-6562-synth_doped.cif,data/source/MP/raw/cifs/mp-6562.cif,mp-6562,0.0,,2011-05-13 18:18:06,6.582036471328142,10.17188/1281336,"@misc{osti_1281336,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2CuHgO4 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281336"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697135'}},0.0234340381250053,2.58068675,520.0,-40.91481298,-5.1143516225,"{'tags': ['Mercury dibarium copper oxide', 'High pressure experimental phase']}",-40.91481298,-5.1143516225,-1.953767533125,"['xas', 'bandstructure']",True,"[75722, 75720, 75724, 75721, 75723]",True,2021-05-12 10:57:32.679000,NM,8,8,mp-6562,oxide,Ba2CuHgO4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Cu_pv', 'Hg', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",GGA,mp-6562,"['mp-6562', 'mp-990899', 'mp-992892', 'mp-1435690', 'mp-1697135', 'mp-1878488', 'mp-994198', 'mp-1592659']",0.0003984,"{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",152.07335344042525,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0, 0, 0]",2.619788352047311e-06,0.0003984,0,0.0003984,MP,data/source/MP/cleaned/cifs/MP-mp-6562.cif,True,,data/final/MP/graphs/Ba2Cu1Hg1O4.04-MP-mp-6562-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ga0.8Nb3Zn0.2,3,0.0999999999999999,2.0,False,Ga1.6Nb6Zn0.4,Ga2Nb6,16.2,Other,True,Ga20Nb75Zn5,Ga-Nb-Zn,3,Supercon,Nb3Ga0.8Zn0.2,MP-mp-2670,Nb6Ga2,Ga-Nb,Ga25Nb75,P m -3 n,cubic,5.189021,5.189021,5.189021,data/final/MP/cifs/Ga0.8Nb3Zn0.2-MP-mp-2670-synth_doped.cif,data/source/MP/raw/cifs/mp-2670.cif,mp-2670,0.0,,2011-05-14 07:55:50,8.28234811962253,10.17188/1201220,"@misc{osti_1201220,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Ga (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201220"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686575'}},0.0550303606249986,4.96610647,520.0,-68.03986833,-8.50498354125,"{'tags': ['Gallium niobium (1/3)', 'Niobium gallide (3/1)']}",-68.03986833,-8.50498354125,-0.1719807556250003,"['xas', 'elasticity', 'bandstructure']",True,"[634772, 634745, 634746, 634774, 634731, 634748, 634762, 634767, 108484, 634734, 634761, 103831]",True,2021-05-12 10:56:18.721000,NM,8,9,mp-2670,,Nb3Ga,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Ga_d'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Ga': 1.0}",GGA,mp-2670,"['mp-928915', 'mp-912435', 'mp-929292', 'mp-2670', 'mp-1078851', 'mp-1440107', 'mp-1686575', 'mp-1781117', 'mp-1594502']",0.0001134,"{'Nb': 6.0, 'Ga': 2.0}",139.71926259628808,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.6232550600794926e-06,0.0001134,0,0.0002268,MP,data/source/MP/cleaned/cifs/MP-mp-2670.cif,True,,data/final/MP/graphs/Ga0.8Nb3Zn0.2-MP-mp-2670-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Al2La0.996Tb0.004,2,0.0026666666666666,2.0,False,Al4La1.992Tb0.008,Al4La2,2.4,Other,True,Al66.667La33.2Tb0.133,Al-La-Tb,3,Supercon,La0.996Tb0.004Al2,MP-mp-2694,La2Al4,Al-La,Al66.667La33.333,F d -3 m,cubic,5.75810346,5.75810346,5.75810346,data/final/MP/cifs/Al2La0.996Tb0.004-MP-mp-2694-synth_doped.cif,data/source/MP/raw/cifs/mp-2694.cif,mp-2694,0.0,,2011-05-12 21:07:48,4.744791242841679,10.17188/1201263,"@misc{osti_1201263,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaAl2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201263"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686658'}},0.0,8.10972418,520.0,-27.8605497,-4.64342495,{'tags': ['Aluminium lanthanum (2/1)']},-27.8605497,-4.64342495,-0.5010386950000001,"['xas', 'elasticity', 'bandstructure']",True,"[608275, 608277, 608265, 608290, 608288, 57933, 608270, 608269, 603920, 608272, 608286, 608273, 608289, 604450, 608266]",True,2021-05-12 10:56:18.721000,NM,6,10,mp-2694,,LaAl2,"{'functional': 'PBE', 'labels': ['La', 'Al'], 'pot_type': 'paw'}","{'La': 1.0, 'Al': 2.0}",GGA,mp-2694,"['mp-940230', 'mp-925817', 'mp-940644', 'mp-2694', 'mp-1258643', 'mp-1440554', 'mp-1686658', 'mp-1787219', 'mp-1596037', 'mp-1594760']",0.0008869,"{'La': 2.0, 'Al': 4.0}",134.99677475891534,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",1.3139573172527638e-05,0.0008869,0,0.0017738,MP,data/source/MP/cleaned/cifs/MP-mp-2694.cif,True,,data/final/MP/graphs/Al2La0.996Tb0.004-MP-mp-2694-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Al4Np1,1,0.0,2.0,False,Al8Np2,Al8Np2,0.0,Heavy_fermion,True,Al80Np20,Al-Np,2,Supercon,Np1Al4,MP-mp-16520,Np2Al8,Al-Np,Al80Np20,I m m a,orthorhombic,4.422144001030617,6.143960002732238,7.88104558,data/final/MP/cifs/Al4Np1-MP-mp-16520.cif,data/source/MP/raw/cifs/mp-16520.cif,mp-16520,0.0,,2011-05-28 22:54:01,6.099275635913227,10.17188/1191973,"@misc{osti_1191973,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NpAl4 (SG:74) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191973"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677496'}},0.0,8.76810088,520.0,-56.89574536,-5.689574536,"{'tags': ['Neptunium aluminide (1/4)', 'Aluminium neptunium (4/1)']}",-56.89574536,-5.689574536,-0.1035579357500005,"['xas', 'bandstructure']",True,"[164913, 58088]",True,2021-05-12 10:56:53.126000,FM,10,9,mp-16520,,NpAl4,"{'functional': 'PBE', 'labels': ['Np', 'Al'], 'pot_type': 'paw'}","{'Np': 1.0, 'Al': 4.0}",GGA,mp-16520,"['mp-927457', 'mp-911576', 'mp-16520', 'mp-1263419', 'mp-1300921', 'mp-1677496', 'mp-1831639', 'mp-927937', 'mp-1600407']",4.12604125,"{'Np': 2.0, 'Al': 8.0}",187.81356628672685,[],FM,True,74,1,"[3.7, 3.7, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.043937627420385,4.12604125,2,8.2520825,MP,data/source/MP/cleaned/cifs/MP-mp-16520.cif,False,,data/final/MP/graphs/Al4Np1-MP-mp-16520.json,0,True,mmm,0,0,0,7,0,0,0,0,0,1,0,1.0,False
Nb0.7Ru0.3,3,0.0666666666666666,3.0,False,Nb2.1Ru0.9,Nb2Ru1,0.0,Other,True,Nb70Ru30,Nb-Ru,2,Supercon,Nb0.7Ru0.3,MP-mp-1220677,Nb2Ru1,Nb-Ru,Nb66.667Ru33.333,F m m m,orthorhombic,2.851184741387406,2.85118474,6.82314741,data/final/MP/cifs/Nb0.7Ru0.3-MP-mp-1220677-synth_doped.cif,data/source/MP/raw/cifs/mp-1220677.cif,mp-1220677,0.0,,2019-01-12 21:29:13.342000,9.392703835709009,,,{'GGA': {'task_id': 'mp-1764746'}},0.125383196666668,5.90919132,520.0,-29.66571899,-9.888572996666666,{'tags': []},-29.66571899,-9.888572996666666,-0.0629064183333329,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,3,5,mp-1220677,,Nb2Ru,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Ru_pv'], 'pot_type': 'paw'}","{'Nb': 2.0, 'Ru': 1.0}",GGA,mp-1220677,"['mp-1220677', 'mp-1431434', 'mp-1764746', 'mp-1794148', 'mp-1609880']",0.0007089,"{'Nb': 2.0, 'Ru': 1.0}",50.71809341022112,[],NM,False,69,0,"[0.0, 0.0, 0.0]",1.3977260427875955e-05,0.0007089,0,0.0007089,MP,data/source/MP/cleaned/cifs/MP-mp-1220677.cif,True,,data/final/MP/graphs/Nb0.7Ru0.3-MP-mp-1220677-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,0,0,1,1.0,False
As2Pd5,1,0.0,6.0,False,As12Pd30,As12Pd30,0.23,Other,True,As28.571Pd71.429,As-Pd,2,Supercon,As2Pd5,MP-mp-1214686,As12Pd30,As-Pd,As28.571Pd71.429,P 63 c m,hexagonal,7.471092003144069,7.4710916,13.67579,data/final/MP/cifs/As2Pd5-MP-mp-1214686.cif,data/source/MP/raw/cifs/mp-1214686.cif,mp-1214686,0.0,,2019-01-12 16:29:16.362000,10.277733646023483,,,,0.0160513504761903,5.96111529,520.0,-226.02972775,-5.38166018452381,"{'tags': ['Pd5Sb2', 'Pd5As2 hex']}",-226.02972775,-5.38166018452381,-0.3505679188095233,[],False,[],True,2021-05-12 11:00:37.845000,NM,42,3,mp-1214686,,As2Pd5,"{'functional': 'PBE', 'labels': ['As', 'Pd'], 'pot_type': 'paw'}","{'As': 2.0, 'Pd': 5.0}",GGA,mp-1214686,"['mp-1214686', 'mp-1365497', 'mp-1907590']",0.0001463333333333,"{'As': 12.0, 'Pd': 30.0}",661.0756984777553,[],NM,False,185,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.3281383690578123e-06,0.0001463333333333,0,0.000878,MP,data/source/MP/cleaned/cifs/MP-mp-1214686.cif,False,,data/final/MP/graphs/As2Pd5-MP-mp-1214686.json,0,True,6mm,0,5,0,0,0,0,0,1,0,0,0,1.0,False
B2Cr0.03Mg0.97,2,0.02,1.0,True,B2Cr0.03Mg0.97,B2Mg1,35.1,Other,True,B66.667Cr1Mg32.333,B-Cr-Mg,3,Supercon,Mg0.97Cr0.03B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B2Cr0.03Mg0.97-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B2Cr0.03Mg0.97-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Nb3Rh1,1,0.0,2.0,False,Nb6Rh2,Nb6Rh2,2.742333333,Other,True,Nb75Rh25,Nb-Rh,2,Supercon,Nb3Rh1,MP-mp-1545,Nb6Rh2,Nb-Rh,Nb75Rh25,P m -3 n,cubic,5.186072,5.186072,5.186072,data/final/MP/cifs/Nb3Rh1-MP-mp-1545.cif,data/source/MP/raw/cifs/mp-1545.cif,mp-1545,0.0,,2011-05-14 11:20:25,9.086567873234834,10.17188/1191190,"@misc{osti_1191190,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Rh (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191190"",
    place = ""United States"",
    year = ""2015"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700041'}},0.0,5.48706495,520.0,-77.37430008,-9.67178751,{'tags': ['Niobium rhodium (3/1)']},-77.37430008,-9.67178751,-0.2547317625000005,"['xas', 'elasticity', 'bandstructure']",True,"[105216, 645269]",True,2021-05-12 10:56:12.755000,NM,8,8,mp-1545,,Nb3Rh,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Rh_pv'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Rh': 1.0}",GGA,mp-1545,"['mp-942004', 'mp-943019', 'mp-935201', 'mp-1545', 'mp-1433570', 'mp-1700041', 'mp-1786474', 'mp-1591392']",0.00021655,"{'Nb': 6.0, 'Rh': 2.0}",139.48118416938905,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",3.1050783127424102e-06,0.00021655,0,0.0004331,MP,data/source/MP/cleaned/cifs/MP-mp-1545.cif,False,,data/final/MP/graphs/Nb3Rh1-MP-mp-1545.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
As1La1Rh1,1,0.0,2.0,False,As2La2Rh2,As2La2Rh2,0.0,Other,True,As33.333La33.333Rh33.333,As-La-Rh,3,Supercon,La1Rh1As1,MP-mp-10956,La2As2Rh2,As-La-Rh,As33.333La33.333Rh33.333,I 41 m d,tetragonal,4.216848001135582,4.216848001135582,8.11798675,data/final/MP/cifs/As1La1Rh1-MP-mp-10956.cif,data/source/MP/raw/cifs/mp-10956.cif,mp-10956,0.0,,2011-05-28 12:11:18,7.834609168813391,10.17188/1187480,"@misc{osti_1187480,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaAsRh (SG:109) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187480"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697706'}},0.0,7.38669593,520.0,-40.84997627,-6.808329378333333,{'tags': ['Lanthanum rhodium arsenide (1/1/1)']},-40.84997627,-6.808329378333333,-1.1551849183333331,"['xas', 'bandstructure']",True,"[193888, 95191]",True,2021-05-12 10:56:51.169000,NM,6,13,mp-10956,,LaAsRh,"{'functional': 'PBE', 'labels': ['La', 'As', 'Rh_pv'], 'pot_type': 'paw'}","{'La': 1.0, 'As': 1.0, 'Rh': 1.0}",GGA,mp-10956,"['mp-928411', 'mp-917656', 'mp-927557', 'mp-10956', 'mp-1071279', 'mp-1071110', 'mp-1071175', 'mp-1115656', 'mp-1423882', 'mp-1697706', 'mp-1779318', 'mp-1590796', 'mp-1071271']",6.75e-06,"{'La': 2.0, 'As': 2.0, 'Rh': 2.0}",134.2624232599155,[],NM,False,109,0,"[0, 0, 0, 0, 0, 0]",1.0054935455667788e-07,6.75e-06,0,1.35e-05,MP,data/source/MP/cleaned/cifs/MP-mp-10956.cif,False,,data/final/MP/graphs/As1La1Rh1-MP-mp-10956.json,0,True,4mm,0,0,0,0,5,0,0,0,0,1,0,1.0,False
Hf1Rh1,1,0.0,1.0,True,Hf1Rh1,Hf1Rh1,0.865,Other,True,Hf50Rh50,Hf-Rh,2,Supercon,Hf1Rh1,MP-mp-11457,Hf1Rh1,Hf-Rh,Hf50Rh50,P m -3 m,cubic,3.27704,3.27704,3.27704,data/final/MP/cifs/Hf1Rh1-MP-mp-11457.cif,data/source/MP/raw/cifs/mp-11457.cif,mp-11457,0.0,,2011-05-27 18:27:49,13.277643936174565,10.17188/1187849,"@misc{osti_1187849,
    author = ""Persson, Kristin"",
    title = ""Materials Data on HfRh (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187849"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672782'}},0.0,6.4003215,520.0,-19.0382795,-9.51913975,{'tags': ['Hafnium rhodium (1/1)']},-19.0382795,-9.51913975,-0.8583913900000013,"['xas', 'elasticity', 'bandstructure']",True,[104265],True,2021-05-12 10:56:10.715000,NM,2,9,mp-11457,,HfRh,"{'functional': 'PBE', 'labels': ['Hf_pv', 'Rh_pv'], 'pot_type': 'paw'}","{'Hf': 1.0, 'Rh': 1.0}",GGA,mp-11457,"['mp-991481', 'mp-993427', 'mp-11457', 'mp-1141146', 'mp-1439163', 'mp-1672782', 'mp-1792935', 'mp-994731', 'mp-1594497']",0.0028276,"{'Hf': 1.0, 'Rh': 1.0}",35.19210359620966,[],NM,False,221,0,"[0, 0]",8.034756979700822e-05,0.0028276,0,0.0028276,MP,data/source/MP/cleaned/cifs/MP-mp-11457.cif,False,,data/final/MP/graphs/Hf1Rh1-MP-mp-11457.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Cu1Hg1O4.101,2,0.0124675965930132,0.975217965130456,True,Ba1.951Cu0.975Hg0.975O4,Ba2Cu1Hg1O4,93.4,Cuprate,True,Ba24.688Cu12.344Hg12.344O50.623379829650666,Ba-Cu-Hg-O,4,Supercon,Hg1Ba2Cu1O4.101,MP-mp-6562,Ba2Cu1Hg1O4,Ba-Cu-Hg-O,Ba25Cu12.5Hg12.5O50,P 4/m m m,tetragonal,3.933714,3.933714,9.827602,data/final/MP/cifs/Ba2Cu1Hg1O4.101-MP-mp-6562-synth_doped.cif,data/source/MP/raw/cifs/mp-6562.cif,mp-6562,0.0,,2011-05-13 18:18:06,6.582036471328142,10.17188/1281336,"@misc{osti_1281336,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2CuHgO4 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281336"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697135'}},0.0234340381250053,2.58068675,520.0,-40.91481298,-5.1143516225,"{'tags': ['Mercury dibarium copper oxide', 'High pressure experimental phase']}",-40.91481298,-5.1143516225,-1.953767533125,"['xas', 'bandstructure']",True,"[75722, 75720, 75724, 75721, 75723]",True,2021-05-12 10:57:32.679000,NM,8,8,mp-6562,oxide,Ba2CuHgO4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Cu_pv', 'Hg', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",GGA,mp-6562,"['mp-6562', 'mp-990899', 'mp-992892', 'mp-1435690', 'mp-1697135', 'mp-1878488', 'mp-994198', 'mp-1592659']",0.0003984,"{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",152.07335344042525,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0, 0, 0]",2.619788352047311e-06,0.0003984,0,0.0003984,MP,data/source/MP/cleaned/cifs/MP-mp-6562.cif,True,,data/final/MP/graphs/Ba2Cu1Hg1O4.101-MP-mp-6562-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Hg5Mn2,1,0.0,2.0,False,Hg10Mn4,Hg10Mn4,0.0,Other,True,Hg71.429Mn28.571,Hg-Mn,2,Supercon,Hg5Mn2,MP-mp-30720,Mn4Hg10,Hg-Mn,Hg71.429Mn28.571,P 4/m b m,tetragonal,3.016986,10.00514,10.00514,data/final/MP/cifs/Hg5Mn2-MP-mp-30720.cif,data/source/MP/raw/cifs/mp-30720.cif,mp-30720,0.0,,2014-02-19 23:10:47,12.237332412147238,10.17188/1205079,"@misc{osti_1205079,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Mn2Hg5 (SG:127) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1205079"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1708070'}},0.2362020655911325,2.8640236,520.0,-36.3780359,-2.5984311357142857,{'tags': ['Mercury manganese (5/2)']},-36.3780359,-2.5984311357142857,0.236202065591133,"['xas', 'bandstructure']",True,[104324],True,2021-05-12 10:57:04.957000,FM,14,8,mp-30720,,Mn2Hg5,"{'functional': 'PBE', 'labels': ['Mn_pv', 'Hg'], 'pot_type': 'paw'}","{'Mn': 2.0, 'Hg': 5.0}",GGA,mp-30720,"['mp-992801', 'mp-30720', 'mp-990681', 'mp-1436757', 'mp-1708070', 'mp-1807656', 'mp-994285', 'mp-1598523']",7.74170645,"{'Mn': 4.0, 'Hg': 10.0}",302.00882586836343,[],FM,True,127,1,"[3.8, 3.8, 3.8, 3.8, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0512680808432689,7.74170645,4,15.4834129,MP,data/source/MP/cleaned/cifs/MP-mp-30720.cif,False,,data/final/MP/graphs/Hg5Mn2-MP-mp-30720.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B2Mg0.99Mn0.01,2,0.0066666666666666,1.0,True,B2Mg0.99Mn0.01,B2Mg1,33.4,Other,True,B66.667Mg33Mn0.333,B-Mg-Mn,3,Supercon,Mg0.99Mn0.01B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B2Mg0.99Mn0.01-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B2Mg0.99Mn0.01-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Rh3Y7,1,0.0,2.0,False,Rh6Y14,Rh6Y14,0.0,Other,True,Rh30Y70,Rh-Y,2,Supercon,Rh3Y7,MP-mp-1189474,Y14Rh6,Rh-Y,Rh30Y70,P 63 m c,hexagonal,6.220473,9.828099998655311,9.828100629999998,data/final/MP/cifs/Rh3Y7-MP-mp-1189474.cif,data/source/MP/raw/cifs/mp-1189474.cif,mp-1189474,0.0,,2019-01-11 20:13:19.783000,5.94240655223256,,,{'GGA': {'task_id': 'mp-1674914'}},0.0,3.99071651,520.0,-146.64350951,-7.3321754755,"{'tags': ['Th7Fe3', 'Y7Rh3', 'Yttrium rhodium (7/3)']}",-146.64350951,-7.3321754755,-0.5963533351666669,['bandstructure'],True,[650528],True,2021-05-12 10:58:33.577000,NM,20,5,mp-1189474,,Y7Rh3,"{'functional': 'PBE', 'labels': ['Y_sv', 'Rh_pv'], 'pot_type': 'paw'}","{'Y': 7.0, 'Rh': 3.0}",GGA,mp-1189474,"['mp-1189474', 'mp-1424013', 'mp-1674914', 'mp-1925718', 'mp-1584496']",0.00017765,"{'Y': 14.0, 'Rh': 6.0}",520.3471877544705,[],NM,False,186,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.82813337635738e-07,0.00017765,0,0.0003553,MP,data/source/MP/cleaned/cifs/MP-mp-1189474.cif,False,,data/final/MP/graphs/Rh3Y7-MP-mp-1189474.json,0,True,6mm,0,5,0,0,0,0,0,1,0,0,0,1.0,False
Au1La1,1,0.0,2.0,False,Au2La2,Au2La2,0.0,Other,True,Au50La50,Au-La,2,Supercon,Au1La1,MP-mp-1002136,La2Au2,Au-La,Au50La50,C m c m,orthorhombic,3.99285199898993,4.864815,6.13987919,data/final/MP/cifs/Au1La1-MP-mp-1002136.cif,data/source/MP/raw/cifs/mp-1002136.cif,mp-1002136,0.0,,2016-07-27 04:06:21,9.89027956504338,10.17188/1274591,"@misc{osti_1274591,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaAu (SG:63) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1274591"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698697'}},0.0,7.02751153,520.0,-19.7036285,-4.925907125,{'tags': ['Gold lanthanum (1/1)']},-19.7036285,-4.925907125,-0.8209628025000004,"['xas', 'elasticity', 'bandstructure']",True,[612099],True,2021-05-12 10:56:08.727000,NM,4,12,mp-1002136,,LaAu,"{'functional': 'PBE', 'labels': ['La', 'Au'], 'pot_type': 'paw'}","{'La': 1.0, 'Au': 1.0}",GGA,mp-1002136,"['mp-1067678', 'mp-1067872', 'mp-1067737', 'mp-1002136', 'mp-1002160', 'mp-1002186', 'mp-1421068', 'mp-1698697', 'mp-1872330', 'mp-1002189', 'mp-1589928', 'mp-1067819']",0.0001239,"{'La': 2.0, 'Au': 2.0}",112.78319049935824,[],NM,False,63,0,"[0, 0, 0, 0]",2.1971359287039327e-06,0.0001239,0,0.0002478,MP,data/source/MP/cleaned/cifs/MP-mp-1002136.cif,False,,data/final/MP/graphs/Au1La1-MP-mp-1002136.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Cd1Mo6S8,1,0.0,1.0,True,Cd1Mo6S8,Cd1Mo6S8,1.8,Chevrel,True,Cd6.667Mo40S53.333,Cd-Mo-S,3,Supercon,Cd1Mo6S8,MP-mp-1104677,Cd1Mo6S8,Cd-Mo-S,Cd6.667Mo40S53.333,R -3,trigonal,6.567543259999999,6.567543259999999,6.56754361,data/final/MP/cifs/Cd1Mo6S8-MP-mp-1104677.cif,data/source/MP/raw/cifs/mp-1104677.cif,mp-1104677,0.0,,2018-07-18 22:49:07,5.553206434903141,,,{'GGA': {'task_id': 'mp-1705676'}},0.0347242440000012,5.65582153,520.0,-108.96217752,-7.264145168,{'tags': ['Cadmium molybdenum sulfide (1/6/8)']},-108.96217752,-7.264145168,-0.926522042999999,['bandstructure'],True,[620169],True,2021-05-12 10:58:20.361000,NM,15,5,mp-1104677,,Cd(Mo3S4)2,"{'functional': 'PBE', 'labels': ['Cd', 'Mo_pv', 'S'], 'pot_type': 'paw'}","{'Cd': 1.0, 'Mo': 6.0, 'S': 8.0}",GGA,mp-1104677,"['mp-1104677', 'mp-1436205', 'mp-1705676', 'mp-1921752', 'mp-1603533']",0.001964,"{'Cd': 1.0, 'Mo': 6.0, 'S': 8.0}",282.4488995797229,[],NM,False,148,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.953470177870703e-06,0.001964,0,0.001964,MP,data/source/MP/cleaned/cifs/MP-mp-1104677.cif,False,,data/final/MP/graphs/Cd1Mo6S8-MP-mp-1104677.json,0,True,-3,0,0,0,0,0,0,2,1,0,0,0,1.0,False
Hf0.834W0.166,3,0.0679999999999999,10.0,False,Hf8.34W1.66,Hf8W2,2.79,Other,True,Hf83.4W16.6,Hf-W,2,Supercon,Hf0.834W0.166,MP-mp-1212292,Hf8W2,Hf-W,Hf80W20,F d -3 m,cubic,7.04020543,7.040205429999999,7.040205429999999,data/final/MP/cifs/Hf0.834W0.166-MP-mp-1212292-synth_doped.cif,data/source/MP/raw/cifs/mp-1212292.cif,mp-1212292,0.0,,2019-01-12 14:30:23.904000,12.084194216893009,,,,1.2247772025000003,3.95269774,520.0,-93.8430902,-9.38430902,"{'tags': ['MgCu2', 'HfW2 rt', 'Friauf-Laves phase, Frank-Kasper phase']}",-93.8430902,-9.38430902,1.1730673539999998,[],False,[],True,2021-05-12 11:00:28.874000,NM,10,2,mp-1212292,,Hf4W,"{'functional': 'PBE', 'labels': ['Hf_pv', 'W_pv'], 'pot_type': 'paw'}","{'Hf': 4.0, 'W': 1.0}",GGA,mp-1212292,"['mp-1212292', 'mp-1932605']",0.09431145,"{'Hf': 8.0, 'W': 2.0}",246.7408165137536,[],NM,False,227,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0007644576307442,0.09431145,0,0.1886229,MP,data/source/MP/cleaned/cifs/MP-mp-1212292.cif,True,,data/final/MP/graphs/Hf0.834W0.166-MP-mp-1212292-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Co1Te1,3,0.0909090909090908,5.0,False,Co5Te5,Co5Te6,0.0,Other,True,Co50Te50,Co-Te,2,Supercon,Co1Te1,MP-mp-1226090,Co5Te6,Co-Te,Co45.455Te54.545,R -3,trigonal,6.61332305,6.613323049999999,6.6133228,data/final/MP/cifs/Co1Te1-MP-mp-1226090-synth_doped.cif,data/source/MP/raw/cifs/mp-1226090.cif,mp-1226090,0.0,,2019-01-13 02:06:32.679000,8.353592421519847,,,{'GGA': {'task_id': 'mp-1742151'}},0.0479241545454529,8.26314572,520.0,-55.73418381,-5.066743982727273,{'tags': []},-55.73418381,-5.066743982727273,-0.3513444777272732,[],False,[],True,2021-05-12 11:00:56.634000,FM,11,4,mp-1226090,,Co5Te6,"{'functional': 'PBE', 'labels': ['Co', 'Te'], 'pot_type': 'paw'}","{'Co': 5.0, 'Te': 6.0}",GGA,mp-1226090,"['mp-1226090', 'mp-1442972', 'mp-1742151', 'mp-1831904']",0.8964674,"{'Co': 5.0, 'Te': 6.0}",210.7611891548228,[],FM,True,148,3,"[0.1, 0.1, 0.1, 0.3, 0.3, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0042534747673181,0.8964674,5,0.8964674,MP,data/source/MP/cleaned/cifs/MP-mp-1226090.cif,True,,data/final/MP/graphs/Co1Te1-MP-mp-1226090-synth_doped.json,0,True,-3,0,0,0,0,0,0,2,1,0,0,0,1.0,False
B0.3Ru0.7,2,1.6653345369377348e-16,20.0,False,B6Ru14,B6Ru14,2.538888889,Other,True,B30Ru70,B-Ru,2,Supercon,B0.3Ru0.7,MP-mp-17535,B6Ru14,B-Ru,B30Ru70,P 63 m c,hexagonal,4.75557,7.519407996267121,7.51940856,data/final/MP/cifs/B0.3Ru0.7-MP-mp-17535.cif,data/source/MP/raw/cifs/mp-17535.cif,mp-17535,0.0,,2014-02-16 04:45:38,10.55273582945268,10.17188/1192559,"@misc{osti_1192559,
    author = ""Persson, Kristin"",
    title = ""Materials Data on B3Ru7 (SG:186) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1192559"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1705767'}},0.0282224314999997,8.35385026,520.0,-172.67019377,-8.6335096885,{'tags': ['Ruthenium boride (7/3)']},-172.67019377,-8.6335096885,-0.1376193987499988,"['xas', 'bandstructure']",True,"[44343, 615355]",True,2021-05-12 10:56:55.092000,NM,20,9,mp-17535,,B3Ru7,"{'functional': 'PBE', 'labels': ['B', 'Ru_pv'], 'pot_type': 'paw'}","{'B': 3.0, 'Ru': 7.0}",GGA,mp-17535,"['mp-928823', 'mp-928309', 'mp-912270', 'mp-17535', 'mp-1115901', 'mp-1427286', 'mp-1705767', 'mp-1776407', 'mp-1603151']",0.0001897,"{'B': 6.0, 'Ru': 14.0}",232.8630352607996,[],NM,False,156,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",1.6292839246687797e-06,0.0001897,0,0.0003794,MP,data/source/MP/cleaned/cifs/MP-mp-17535.cif,False,,data/final/MP/graphs/B0.3Ru0.7-MP-mp-17535.json,0,True,6mm,0,5,0,0,0,0,0,1,0,0,0,1.0,False
C2Pt0.95Rh0.05U2,2,0.02,1.0,True,C2Pt0.95Rh0.05U2,C2Pt1U2,1.41,Heavy_fermion,True,C40Pt19Rh1U40,C-Pt-Rh-U,4,Supercon,U2Pt0.95Rh0.05C2,MP-mp-1068685,U2Pt1C2,C-Pt-U,C40Pt20U40,I 4/m m m,tetragonal,3.523293998450595,3.523293998450595,6.73411484,data/final/MP/cifs/C2Pt0.95Rh0.05U2-MP-mp-1068685-synth_doped.cif,data/source/MP/raw/cifs/mp-1068685.cif,mp-1068685,0.0,,2018-03-21 23:31:09,14.863441200395862,,,{'GGA': {'task_id': 'mp-1678129'}},0.0,10.58963566,520.0,-48.59510218,-9.719020436,"{'tags': ['U2PtC2', 'Platinum uranium carbide (1/2/2)', 'Uranium platinum carbide (2/1/2)', 'Na2HgO2']}",-48.59510218,-9.719020436,-0.2975626099999999,['bandstructure'],True,"[618656, 618660, 618659]",True,2021-05-12 10:58:14.654000,FM,5,16,mp-1068685,,U2PtC2,"{'functional': 'PBE', 'labels': ['U', 'Pt', 'C'], 'pot_type': 'paw'}","{'U': 2.0, 'Pt': 1.0, 'C': 2.0}",GGA,mp-1068685,"['mp-1068685', 'mp-1068739', 'mp-1068893', 'mp-1070007', 'mp-1070048', 'mp-1070082', 'mp-1070138', 'mp-1070185', 'mp-1070251', 'mp-1437934', 'mp-1678129', 'mp-1798891', 'mp-1591066', 'mp-1070208', 'mp-1070148', 'mp-1068837']",2.8448974,"{'U': 2.0, 'Pt': 1.0, 'C': 2.0}",77.66342053028113,[],FM,True,139,1,"[1.3, 1.3, 0.0, 0.0, 0.0]",0.0366311112821868,2.8448974,2,2.8448974,MP,data/source/MP/cleaned/cifs/MP-mp-1068685.cif,True,,data/final/MP/graphs/C2Pt0.95Rh0.05U2-MP-mp-1068685-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B2Re1,1,0.0,2.0,False,B4Re2,B4Re2,6.3,Other,True,B66.667Re33.333,B-Re,2,Supercon,B2Re1,MP-mp-1773,Re2B4,B-Re,B66.667Re33.333,P 63/m m c,hexagonal,2.916969995815963,2.91696989,7.503477,data/final/MP/cifs/B2Re1-MP-mp-1773.cif,data/source/MP/raw/cifs/mp-1773.cif,mp-1773,0.0,,2011-05-12 22:12:57,12.483263837280782,10.17188/1192660,"@misc{osti_1192660,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ReB2 (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1192660"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687639'}},0.0,7.72587596,520.0,-54.17372027,-9.028953378333332,"{'tags': ['Rhenium diboride', 'Rhenium boride (1/2)']}",-54.17372027,-9.028953378333332,-0.4278498027777774,"['xas', 'elasticity', 'bandstructure']",True,"[165834, 615239, 162271, 191915, 23871, 421522]",True,2021-05-12 10:56:14.760000,NM,6,9,mp-1773,,ReB2,"{'functional': 'PBE', 'labels': ['Re_pv', 'B'], 'pot_type': 'paw'}","{'Re': 1.0, 'B': 2.0}",GGA,mp-1773,"['mp-906279', 'mp-920062', 'mp-919071', 'mp-1773', 'mp-1076994', 'mp-1438994', 'mp-1687639', 'mp-1792001', 'mp-1588344']",0.0004223,"{'Re': 2.0, 'B': 4.0}",55.29133697258874,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0]",1.5275449034967618e-05,0.0004223,0,0.0008446,MP,data/source/MP/cleaned/cifs/MP-mp-1773.cif,False,,data/final/MP/graphs/B2Re1-MP-mp-1773.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Mo2O5,1,0.0,2.0,False,Mo4O10,Mo4O10,0.0,Oxide,True,Mo28.571O71.42857142857143,Mo-O,2,Supercon,Mo2O5,MP-mvc-4607,Mo4O10,Mo-O,Mo28.571O71.42857142857143,P m m n,orthorhombic,3.935245,4.373397,12.27074201,data/final/MP/cifs/Mo2O5-MP-mvc-4607.cif,data/source/MP/raw/cifs/mvc-4607.cif,mvc-4607,0.7991999999999999,,2014-02-08 11:33:16,4.275530985374154,10.17188/1321082,"@misc{osti_1321082,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Mo2O5 (SG:59) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1321082"",
    place = ""United States"",
    year = ""2014"",
    month = ""9"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-1727691'}},0.0782332220408132,2.30543408,520.0,-99.62574147,-7.116124390714285,{'tags': []},-99.62574147,-7.116124390714285,-1.8886828071428567,"['xas', 'elasticity']",False,[],True,2021-05-12 10:56:39.288000,FM,14,5,mvc-4607,oxide,Mo2O5,"{'functional': 'PBE', 'labels': ['Mo_pv', 'O'], 'pot_type': 'paw'}","{'Mo': 2.0, 'O': 5.0}",GGA+U,mvc-4607,"['mvc-4607', 'mp-1412716', 'mp-1656583', 'mp-1727691', 'mp-1831059']",2.0000237,"{'Mo': 4.0, 'O': 10.0}",211.18423950352943,[],FM,True,59,2,"[1.0, 1.0, 1.0, 1.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0189410318184901,2.0000237,4,4.0000474,MP,data/source/MP/cleaned/cifs/MP-mvc-4607.cif,False,,data/final/MP/graphs/Mo2O5-MP-mvc-4607.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ba2Cu1Hg1O4.31,2,0.0373044524669073,0.9280185614849188,True,Ba1.856Cu0.928Hg0.928O4,Ba2Cu1Hg1O4,78.0,Cuprate,True,Ba24.067Cu12.034Hg12.034O51.86522262334537,Ba-Cu-Hg-O,4,Supercon,Hg1Ba2Cu1O4.31,MP-mp-6562,Ba2Cu1Hg1O4,Ba-Cu-Hg-O,Ba25Cu12.5Hg12.5O50,P 4/m m m,tetragonal,3.933714,3.933714,9.827602,data/final/MP/cifs/Ba2Cu1Hg1O4.31-MP-mp-6562-synth_doped.cif,data/source/MP/raw/cifs/mp-6562.cif,mp-6562,0.0,,2011-05-13 18:18:06,6.582036471328142,10.17188/1281336,"@misc{osti_1281336,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2CuHgO4 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281336"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697135'}},0.0234340381250053,2.58068675,520.0,-40.91481298,-5.1143516225,"{'tags': ['Mercury dibarium copper oxide', 'High pressure experimental phase']}",-40.91481298,-5.1143516225,-1.953767533125,"['xas', 'bandstructure']",True,"[75722, 75720, 75724, 75721, 75723]",True,2021-05-12 10:57:32.679000,NM,8,8,mp-6562,oxide,Ba2CuHgO4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Cu_pv', 'Hg', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",GGA,mp-6562,"['mp-6562', 'mp-990899', 'mp-992892', 'mp-1435690', 'mp-1697135', 'mp-1878488', 'mp-994198', 'mp-1592659']",0.0003984,"{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",152.07335344042525,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0, 0, 0]",2.619788352047311e-06,0.0003984,0,0.0003984,MP,data/source/MP/cleaned/cifs/MP-mp-6562.cif,True,,data/final/MP/graphs/Ba2Cu1Hg1O4.31-MP-mp-6562-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Bi1.5La4Pb1.5,1,0.0,2.0,False,Bi3La8Pb3,Bi3La8Pb3,2.4,Other,True,Bi21.429La57.143Pb21.429,Bi-La-Pb,3,Supercon,Bi1.5La4Pb1.5,MP-mp-1223136,La8Bi3Pb3,Bi-La-Pb,Bi21.429La57.143Pb21.429,C 1 2 1,monoclinic,8.570216285073428,8.570216285073428,8.57466899,data/final/MP/cifs/Bi1.5La4Pb1.5-MP-mp-1223136.cif,data/source/MP/raw/cifs/mp-1223136.cif,mp-1223136,0.0,,2019-01-12 23:34:22.362000,8.080502256244179,,,,0.0049102567857142,7.47878256,520.0,-73.08331846,-5.220237032857143,{'tags': []},-73.08331846,-5.220237032857143,-0.7705155342857145,[],False,[],True,2021-05-12 11:00:52.054000,NM,14,3,mp-1223136,,La8(BiPb)3,"{'functional': 'PBE', 'labels': ['La', 'Bi', 'Pb_d'], 'pot_type': 'paw'}","{'La': 8.0, 'Bi': 3.0, 'Pb': 3.0}",GGA,mp-1223136,"['mp-1223136', 'mp-1346033', 'mp-1823840']",0.4196313,"{'La': 8.0, 'Bi': 3.0, 'Pb': 3.0}",484.93459819618255,[],NM,False,5,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.000865335865003,0.4196313,0,0.4196313,MP,data/source/MP/cleaned/cifs/MP-mp-1223136.cif,False,,data/final/MP/graphs/Bi1.5La4Pb1.5-MP-mp-1223136.json,0,True,2,0,0,1,0,0,0,0,0,1,0,0,1.0,False
Al0.72Nb3.28,3,0.1399999999999999,2.0,False,Al1.44Nb6.56,Al2Nb6,6.2,Other,True,Al18Nb82,Al-Nb,2,Supercon,Al0.72Nb3.28,MP-mp-796,Nb6Al2,Al-Nb,Al25Nb75,P m -3 n,cubic,5.215254,5.215254,5.215254,data/final/MP/cifs/Al0.72Nb3.28-MP-mp-796-synth_doped.cif,data/source/MP/raw/cifs/mp-796.cif,mp-796,0.0,,2011-05-13 16:07:37,7.157298025966356,,,{'GGA': {'task_id': 'mp-1686893'}},0.0460773865000003,5.52947534,520.0,-69.48918494,-8.6861481175,"{'tags': ['Aluminium niobium (1/3)', 'Niobium aluminide (3/1)', 'Aluminum niobium (1/3)']}",-69.48918494,-8.6861481175,-0.1737753800000003,"['bandstructure', 'elasticity']",True,"[608675, 608654, 608688, 608668, 608669, 608685, 608676, 608683, 58014, 608657, 107856, 608655, 608666, 608691, 608656, 608665, 608673, 608653, 608661]",True,2021-05-12 10:56:31.128000,NM,8,10,mp-796,,Nb3Al,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Al': 1.0}",GGA,mp-796,"['mp-911586', 'mp-927906', 'mp-796', 'mp-927472', 'mp-1260512', 'mp-1440919', 'mp-1686893', 'mp-1927652', 'mp-1591599', 'mp-1587739']",0.16323955,"{'Nb': 6.0, 'Al': 2.0}",141.8490379078192,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0023015954483396,0.16323955,0,0.3264791,MP,data/source/MP/cleaned/cifs/MP-mp-796.cif,True,,data/final/MP/graphs/Al0.72Nb3.28-MP-mp-796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
In1Ni2Ti1,1,0.0,1.0,True,In1Ni2Ti1,In1Ni2Ti1,0.0,Other,True,In25Ni50Ti25,In-Ni-Ti,3,Supercon,Ni2Ti1In1,MP-mp-22463,Ti1In1Ni2,In-Ni-Ti,In25Ni50Ti25,F m -3 m,cubic,4.3319694900000005,4.33196949,4.33196949,data/final/MP/cifs/In1Ni2Ti1-MP-mp-22463.cif,data/source/MP/raw/cifs/mp-22463.cif,mp-22463,0.0,,2014-02-21 09:03:37,8.090536306612785,10.17188/1198305,"@misc{osti_1198305,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TiInNi2 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198305"",
    place = ""United States"",
    year = ""2016"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688260'}},0.0318952136491912,8.53560681,520.0,-23.55888795,-5.8897219875,"{'tags': ['Indium nickel titanium (1/2/1)', 'Titanium nickel indium (1/2/1)', 'Indium nickel titanium  (1/2/1)']}",-23.55888795,-5.8897219875,-0.3378597108333334,"['xas', 'elasticity', 'bandstructure']",True,"[59452, 59451, 54596]",True,2021-05-12 10:56:16.728000,NM,4,8,mp-22463,,TiInNi2,"{'functional': 'PBE', 'labels': ['Ti_pv', 'In_d', 'Ni_pv'], 'pot_type': 'paw'}","{'Ti': 1.0, 'In': 1.0, 'Ni': 2.0}",GGA,mp-22463,"['mp-991770', 'mp-992181', 'mp-22463', 'mp-1439853', 'mp-1688260', 'mp-1795640', 'mp-993815', 'mp-1588417']",0.0007766,"{'Ti': 1.0, 'In': 1.0, 'Ni': 2.0}",57.483230743660044,[],NM,False,225,0,"[0, 0, 0, 0]",1.351002701054086e-05,0.0007766,0,0.0007766,MP,data/source/MP/cleaned/cifs/MP-mp-22463.cif,False,,data/final/MP/graphs/In1Ni2Ti1-MP-mp-22463.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Cl1N1Ti1,1,0.0,2.0,False,Cl2N2Ti2,Cl2N2Ti2,0.0,Other,True,Cl33.333N33.333Ti33.333,Cl-N-Ti,3,Supercon,Ti1N1Cl1,MP-mp-27850,Ti2N2Cl2,Cl-N-Ti,Cl33.333N33.333Ti33.333,P m m n,orthorhombic,3.27536,3.966688,8.402487,data/final/MP/cifs/Cl1N1Ti1-MP-mp-27850.cif,data/source/MP/raw/cifs/mp-27850.cif,mp-27850,0.5605000000000002,,2013-09-21 23:43:52,2.960848314364915,10.17188/1202025,"@misc{osti_1202025,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TiNCl (SG:59) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1202025"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697244'}},0.0,2.16285067,520.0,-45.3694318,-7.561571966666666,{'tags': ['Titanium nitride chloride (1/1/1)']},-45.3694318,-7.561571966666666,-1.859730766111112,"['diel', 'xas', 'elasticity', 'bandstructure']",True,"[290035, 261525, 27396]",True,2021-05-12 10:56:18.721000,NM,6,13,mp-27850,,TiNCl,"{'functional': 'PBE', 'labels': ['Ti_pv', 'N', 'Cl'], 'pot_type': 'paw'}","{'Ti': 1.0, 'N': 1.0, 'Cl': 1.0}",GGA,mp-27850,"['mp-656969', 'mp-661635', 'mp-655366', 'mp-27850', 'mp-1072507', 'mp-1072515', 'mp-1072531', 'mp-1141241', 'mp-1441857', 'mp-1697244', 'mp-1803570', 'mp-1590779', 'mp-1072530']",1.075e-05,"{'Ti': 2.0, 'N': 2.0, 'Cl': 2.0}",109.16789407222552,[],NM,False,59,0,"[0, 0, 0, 0, 0, 0]",1.969443505594749e-07,1.075e-05,0,2.15e-05,MP,data/source/MP/cleaned/cifs/MP-mp-27850.cif,False,,data/final/MP/graphs/Cl1N1Ti1-MP-mp-27850.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ca1.81Cl2Cu1Na0.19O2,3,0.0542857142857144,1.0,True,Ca1.81Cl2Cu1Na0.19O2,Ca2Cl2Cu1O2,27.7,Cuprate,True,Ca25.857Cl28.571Cu14.286Na2.714O28.57142857142857,Ca-Cl-Cu-Na-O,5,Supercon,Ca1.81Na0.19Cu1Cl2O2,MP-mp-23143,Ca2Cu1Cl2O2,Ca-Cl-Cu-O,Ca28.571Cl28.571Cu14.286O28.571428571428573,I 4/m m m,tetragonal,3.88024600076171,3.880246000761709,8.12907187,data/final/MP/cifs/Ca1.81Cl2Cu1Na0.19O2-MP-mp-23143-synth_doped.cif,data/source/MP/raw/cifs/mp-23143.cif,mp-23143,0.0,,2014-02-21 09:50:06,3.554337150605878,10.17188/1199263,"@misc{osti_1199263,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ca2Cu(ClO)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199263"",
    place = ""United States"",
    year = ""2016"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700223'}},0.0191527683333321,4.19679796,520.0,-35.95348475,-5.136212107142858,"{'tags': ['Dicalcium copper dioxide dichloride', 'Dicalcium dichlorodioxocuprate']}",-35.95348475,-5.136212107142858,-2.407440427142858,"['xas', 'elasticity', 'bandstructure']",True,"[1027, 83117, 41581]",True,2021-05-12 10:56:16.728000,NM,7,8,mp-23143,oxide,Ca2Cu(ClO)2,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Cu_pv', 'Cl', 'O'], 'pot_type': 'paw'}","{'Ca': 2.0, 'Cu': 1.0, 'Cl': 2.0, 'O': 2.0}",GGA,mp-23143,"['mp-992231', 'mp-990553', 'mp-23143', 'mp-1436301', 'mp-1700223', 'mp-1803462', 'mp-993865', 'mp-1592909']",0.0134962,"{'Ca': 2.0, 'Cu': 1.0, 'Cl': 2.0, 'O': 2.0}",115.21141865211318,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001171429026557,0.0134962,0,0.0134962,MP,data/source/MP/cleaned/cifs/MP-mp-23143.cif,True,,data/final/MP/graphs/Ca1.81Cl2Cu1Na0.19O2-MP-mp-23143-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ir1La3,3,0.0714285714285715,3.333166666666667,False,Ir3.333La10,Ir4La10,0.0,Other,True,Ir25La75,Ir-La,2,Supercon,Ir1La3,MP-mp-1104396,La10Ir4,Ir-La,Ir28.571La71.429,C 1 2/c 1,monoclinic,6.779574001313821,7.41594157,9.18235801,data/final/MP/cifs/Ir1La3-MP-mp-1104396-synth_doped.cif,data/source/MP/raw/cifs/mp-1104396.cif,mp-1104396,0.0,,2018-07-18 21:52:54,8.40492574386746,,,{'GGA': {'task_id': 'mp-1672565'}},0.0,8.11856843,520.0,-92.53381417,-6.609558155,"{'tags': ['Mn5C2', 'La5Ir2 rt', 'Lanthanum iridium (5/2)']}",-92.53381417,-6.609558155,-0.5585729600000003,['bandstructure'],True,[640756],True,2021-05-12 10:58:20.361000,NM,14,5,mp-1104396,,La5Ir2,"{'functional': 'PBE', 'labels': ['La', 'Ir'], 'pot_type': 'paw'}","{'La': 5.0, 'Ir': 2.0}",GGA,mp-1104396,"['mp-1104396', 'mp-1425840', 'mp-1672565', 'mp-1822030', 'mp-1584250']",0.00412615,"{'La': 10.0, 'Ir': 4.0}",426.3351105353272,[],NM,False,15,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.935636966338055e-05,0.00412615,0,0.0082523,MP,data/source/MP/cleaned/cifs/MP-mp-1104396.cif,True,,data/final/MP/graphs/Ir1La3-MP-mp-1104396-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
Ba2Cu3Nd0.8Pr0.2O7,3,0.0307692307692307,1.0,True,Ba2Cu3Nd0.8Pr0.2O7,Ba2Cu3Nd1O7,31.4,Cuprate,True,Ba15.385Cu23.077Nd6.154Pr1.538O53.84615384615385,Ba-Cu-Nd-Pr-O,5,Supercon,Nd0.8Pr0.2Ba2Cu3O7,MP-mp-22719,Ba2Nd1Cu3O7,Ba-Cu-Nd-O,Ba15.385Cu23.077Nd7.692O53.84615384615385,P m m m,orthorhombic,3.893817,3.958458,11.89947,data/final/MP/cifs/Ba2Cu3Nd0.8Pr0.2O7-MP-mp-22719-synth_doped.cif,data/source/MP/raw/cifs/mp-22719.cif,mp-22719,0.0,,2015-01-22 21:32:23,6.532421108031168,10.17188/1198922,"@misc{osti_1198922,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2NdCu3O7 (SG:47) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198922"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704234'}},0.0180149053205083,3.13221275,520.0,-78.75337907,-6.057952236153846,"{'tags': ['Neodymium barium copper oxide (1/2/3/7)', 'Neodymium dibarium tricopper heptaoxide']}",-78.75337907,-6.057952236153846,-2.155611319615384,"['bandstructure', 'elasticity']",True,"[86960, 81169]",True,2021-05-12 10:56:16.728000,NM,13,8,mp-22719,oxide,Ba2NdCu3O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Nd_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Nd': 1.0, 'Cu': 3.0, 'O': 7.0}",GGA,mp-22719,"['mp-926068', 'mp-925655', 'mp-917559', 'mp-1427130', 'mp-1704234', 'mp-1829984', 'mp-1600543', 'mp-22719']",0.0444215,"{'Ba': 2.0, 'Nd': 1.0, 'Cu': 3.0, 'O': 7.0}",183.4126123839547,[],NM,False,47,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0002421943585155,0.0444215,0,0.0444215,MP,data/source/MP/cleaned/cifs/MP-mp-22719.cif,True,,data/final/MP/graphs/Ba2Cu3Nd0.8Pr0.2O7-MP-mp-22719-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Nb5Sb4,1,0.0,1.0,True,Nb5Sb4,Nb5Sb4,8.6,Other,True,Nb55.556Sb44.444,Nb-Sb,2,Supercon,Nb5Sb4,MP-mp-274,Nb5Sb4,Nb-Sb,Nb55.556Sb44.444,I 4/m,tetragonal,3.5855060018938945,7.583317651338164,7.58331765,data/final/MP/cifs/Nb5Sb4-MP-mp-274.cif,data/source/MP/raw/cifs/mp-274.cif,mp-274,0.0,,2011-05-13 20:58:11,8.117054597246732,10.17188/1201617,"@misc{osti_1201617,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb5Sb4 (SG:87) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201617"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701548'}},0.0,7.0564321,520.0,-69.78755409,-7.754172676666666,"{'tags': ['Niobium antimony (5/4)', 'Niobium antimonide (5/4)']}",-69.78755409,-7.754172676666666,-0.3925582144444443,"['xas', 'elasticity', 'bandstructure']",True,"[154596, 645356, 645351]",True,2021-05-12 10:56:18.721000,NM,9,9,mp-274,,Nb5Sb4,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Sb'], 'pot_type': 'paw'}","{'Nb': 5.0, 'Sb': 4.0}",GGA,mp-274,"['mp-1001196', 'mp-1007571', 'mp-274', 'mp-1079580', 'mp-1432296', 'mp-1701548', 'mp-1832109', 'mp-1012325', 'mp-1587494']",0.0004569,"{'Nb': 5.0, 'Sb': 4.0}",194.66695655401392,[],NM,False,87,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0]",2.347085545939712e-06,0.0004569,0,0.0004569,MP,data/source/MP/cleaned/cifs/MP-mp-274.cif,False,,data/final/MP/graphs/Nb5Sb4-MP-mp-274.json,0,True,4/m,0,0,0,0,3,0,0,0,0,1,0,1.0,False
Ba2Co1Cu2La1O7.01,2,0.0007095133920652,0.9987146932952924,True,Ba1.997Co0.999Cu1.997La0.999O7,Ba2Co1Cu2La1O7,0.0,Cuprate,True,Ba15.373Co7.686Cu15.373La7.686O53.88162951575711,Ba-Co-Cu-La-O,5,Supercon,La1Ba2Cu2Co1O7.01,MP-mp-1214652,Ba2La1Co1Cu2O7,Ba-Co-Cu-La-O,Ba15.385Co7.692Cu15.385La7.692O53.84615384615385,P m m m,orthorhombic,3.932809,3.961428,12.006921,data/final/MP/cifs/Ba2Co1Cu2La1O7.01-MP-mp-1214652-synth_doped.cif,data/source/MP/raw/cifs/mp-1214652.cif,mp-1214652,0.0,,2019-01-12 16:27:34.797000,6.3166503710349255,,,{'GGA+U': {'task_id': 'mp-1741397'}},0.0247075452083302,4.01033439,520.0,-81.01823883,-6.232172217692308,"{'tags': ['Ba2Cu2LaCoO7', 'high-Tc cuprate family', 'Ba2Cu2(Cu0.89Al0.11)YO7']}",-81.01823883,-6.232172217692308,-2.2114486073076924,[],False,[],True,2021-05-12 11:00:37.845000,FM,13,4,mp-1214652,oxide,Ba2LaCoCu2O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'La', 'Co', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'La': 1.0, 'Co': 1.0, 'Cu': 2.0, 'O': 7.0}",GGA+U,mp-1214652,"['mp-1214652', 'mp-1389127', 'mp-1741397', 'mp-1829578']",2.4674875,"{'Ba': 2.0, 'La': 1.0, 'Co': 1.0, 'Cu': 2.0, 'O': 7.0}",187.0623022892272,[],FM,True,47,1,"[0.0, 0.0, 0.0, 2.2, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0131907256021305,2.4674875,1,2.4674875,MP,data/source/MP/cleaned/cifs/MP-mp-1214652.cif,True,,data/final/MP/graphs/Ba2Co1Cu2La1O7.01-MP-mp-1214652-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Au1Zr3,1,0.0,2.0,False,Au2Zr6,Au2Zr6,0.46,Other,True,Au25Zr75,Au-Zr,2,Supercon,Au1Zr3,MP-mp-11263,Zr6Au2,Au-Zr,Au25Zr75,P m -3 n,cubic,5.538043,5.538043,5.538043,data/final/MP/cifs/Au1Zr3-MP-mp-11263.cif,data/source/MP/raw/cifs/mp-11263.cif,mp-11263,0.0,,2011-06-01 13:07:31,9.202326489456334,10.17188/1187686,"@misc{osti_1187686,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Zr3Au (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187686"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702812'}},0.0,4.55231007,520.0,-60.61389967,-7.57673745875,{'tags': ['Gold zirconium (1/3)']},-60.61389967,-7.57673745875,-0.3474916012500006,"['xas', 'elasticity', 'bandstructure']",True,[58630],True,2021-05-12 10:56:10.715000,NM,8,8,mp-11263,,Zr3Au,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Au'], 'pot_type': 'paw'}","{'Zr': 3.0, 'Au': 1.0}",GGA,mp-11263,"['mp-928183', 'mp-11263', 'mp-912075', 'mp-928678', 'mp-1429919', 'mp-1702812', 'mp-1778522', 'mp-1593106']",0.0514421,"{'Zr': 6.0, 'Au': 2.0}",169.85133726099536,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.000605730880069,0.0514421,0,0.1028842,MP,data/source/MP/cleaned/cifs/MP-mp-11263.cif,False,,data/final/MP/graphs/Au1Zr3-MP-mp-11263.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba0.35Bi1K0.65O3,2,0.0066666666666666,3.0,False,Ba1.05Bi3K1.95O9,Ba1Bi3K2O9,1.88,Oxide,True,Ba7Bi20K13O60,Ba-Bi-K-O,4,Supercon,Ba0.35K0.65Bi1O3,MP-mp-1223672,K2Ba1Bi3O9,Ba-Bi-K-O,Ba6.667Bi20K13.333O60,P -3 m 1,trigonal,6.104433996276926,6.1044332,7.481113,data/final/MP/cifs/Ba0.35Bi1K0.65O3-MP-mp-1223672-synth_doped.cif,data/source/MP/raw/cifs/mp-1223672.cif,mp-1223672,0.0,,2019-01-13 00:02:05.715000,6.784857598202287,,,{'GGA': {'task_id': 'mp-1736675'}},0.0209399281666646,2.58339382,520.0,-80.80971432,-5.387314288,{'tags': []},-80.80971432,-5.387314288,-1.7767462414000008,[],False,[],True,2021-05-12 11:00:52.054000,NM,15,4,mp-1223672,oxide,K2Ba(BiO3)3,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Bi', 'O'], 'pot_type': 'paw'}","{'K': 2.0, 'Ba': 1.0, 'Bi': 3.0, 'O': 9.0}",GGA,mp-1223672,"['mp-1223672', 'mp-1408017', 'mp-1736675', 'mp-1774751']",0.001083,"{'K': 2.0, 'Ba': 1.0, 'Bi': 3.0, 'O': 9.0}",241.4279662625217,[],NM,False,164,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.485810060721703e-06,0.001083,0,0.001083,MP,data/source/MP/cleaned/cifs/MP-mp-1223672.cif,True,,data/final/MP/graphs/Ba0.35Bi1K0.65O3-MP-mp-1223672-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Fe22U78,2,0.04,0.0909096736596736,False,Fe2U7.091,Fe2U8,0.98,Heavy_fermion,True,Fe22U78,Fe-U,2,Supercon,Fe22U78,MP-mp-1208119,U8Fe2,Fe-U,Fe20U80,F d -3 m,cubic,6.708592150000001,6.70859215,6.70859215,data/final/MP/cifs/Fe22U78-MP-mp-1208119-synth_doped.cif,data/source/MP/raw/cifs/mp-1208119.cif,mp-1208119,0.0,,2019-01-12 11:05:47.209000,15.679907486627505,,,,0.7489175305000018,11.77745193,520.0,-100.08746937,-10.008746937,"{'tags': ['MgCu2', 'Friauf-Laves phase, Frank-Kasper phase', 'UFe2 rt']}",-100.08746937,-10.008746937,0.7183827610000009,[],False,[],True,2021-05-12 11:00:19.396000,FiM,10,2,mp-1208119,,U4Fe,"{'functional': 'PBE', 'labels': ['U', 'Fe_pv'], 'pot_type': 'paw'}","{'U': 4.0, 'Fe': 1.0}",GGA,mp-1208119,"['mp-1208119', 'mp-1827826']",1.49533795,"{'U': 8.0, 'Fe': 2.0}",213.4908030219682,[],FiM,True,216,2,"[0.5, 0.5, 0.5, 0.4, 0.4, 0.5, 0.4, 0.4, -0.1, -0.2]",0.014008453093374,1.49533795,10,2.9906759,MP,data/source/MP/cleaned/cifs/MP-mp-1208119.cif,True,,data/final/MP/graphs/Fe22U78-MP-mp-1208119-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
La1Ru2Si2,1,0.0,1.0,True,La1Ru2Si2,La1Ru2Si2,3.5,Other,True,La20Ru40Si40,La-Ru-Si,3,Supercon,La1Ru2Si2,MP-mp-5105,La1Si2Ru2,La-Ru-Si,La20Ru40Si40,I 4/m m m,tetragonal,4.247773997067649,4.247773997067649,5.82757063,data/final/MP/cifs/La1Ru2Si2-MP-mp-5105.cif,data/source/MP/raw/cifs/mp-5105.cif,mp-5105,0.0,,2011-05-13 02:28:03,7.320080766535967,10.17188/1262978,"@misc{osti_1262978,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La(SiRu)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1262978"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702140'}},0.0,8.49094234,520.0,-38.80081539,-7.760163078,{'tags': ['Lanthanum ruthenium silicide (1/2/2)']},-38.80081539,-7.760163078,-0.864680186999999,"['xas', 'bandstructure']",True,"[55351, 641785]",True,2021-05-12 10:57:10.838000,NM,5,9,mp-5105,,La(SiRu)2,"{'functional': 'PBE', 'labels': ['La', 'Si', 'Ru_pv'], 'pot_type': 'paw'}","{'La': 1.0, 'Si': 2.0, 'Ru': 2.0}",GGA,mp-5105,"['mp-1007008', 'mp-1000543', 'mp-5105', 'mp-1156207', 'mp-1438173', 'mp-1702140', 'mp-1784486', 'mp-1011744', 'mp-1590710']",0.0007452,"{'La': 1.0, 'Si': 2.0, 'Ru': 2.0}",90.10740282365516,[],NM,False,139,0,"[0, 0, 0, 0, 0]",8.270130717876699e-06,0.0007452,0,0.0007452,MP,data/source/MP/cleaned/cifs/MP-mp-5105.cif,False,,data/final/MP/graphs/La1Ru2Si2-MP-mp-5105.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ge2Pd2Sr1,1,0.0,1.0,True,Ge2Pd2Sr1,Ge2Pd2Sr1,2.892,Other,True,Ge40Pd40Sr20,Ge-Pd-Sr,3,Supercon,Sr1Pd2Ge2,MP-mp-978986,Sr1Ge2Pd2,Ge-Pd-Sr,Ge40Pd40Sr20,I 4/m m m,tetragonal,4.438671999438209,4.438671999438209,6.03054834,data/final/MP/cifs/Ge2Pd2Sr1-MP-mp-978986.cif,data/source/MP/raw/cifs/mp-978986.cif,mp-978986,0.0,,2015-10-09 03:56:43,7.295677176868866,10.17188/1316057,"@misc{osti_1316057,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr(GePd)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1316057"",
    place = ""United States"",
    year = ""2016"",
    month = ""9"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688092'}},0.0,4.0155429,520.0,-24.8627221,-4.97254442,"{'tags': ['Strontium palladium germanide (1/2/2)', 'Strontium palladium germanium (1/2/2)', 'High pressure experimental phase']}",-24.8627221,-4.97254442,-0.7134818633333324,"['xas', 'elasticity', 'bandstructure']",True,"[165985, 181157, 181155, 181156, 168133]",True,2021-05-12 10:56:37.246000,NM,5,9,mp-978986,,Sr(GePd)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ge_d', 'Pd'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Ge': 2.0, 'Pd': 2.0}",GGA,mp-978986,"['mp-1005776', 'mp-978986', 'mp-1005866', 'mp-979737', 'mp-1438850', 'mp-1688092', 'mp-1782349', 'mp-1011093', 'mp-1589601']",0.0012593,"{'Sr': 1.0, 'Ge': 2.0, 'Pd': 2.0}",101.45304755163892,[],NM,False,139,0,"[0, 0, 0, 0, 0]",1.2412638460752248e-05,0.0012593,0,0.0012593,MP,data/source/MP/cleaned/cifs/MP-mp-978986.cif,False,,data/final/MP/graphs/Ge2Pd2Sr1-MP-mp-978986.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Al1Nb2.973Zr0.027,2,0.0135,2.0,False,Al2Nb5.946Zr0.054,Al2Nb6,16.6,Other,True,Al25Nb74.325Zr0.675,Al-Nb-Zr,3,Supercon,Nb2.973Zr0.027Al1,MP-mp-796,Nb6Al2,Al-Nb,Al25Nb75,P m -3 n,cubic,5.215254,5.215254,5.215254,data/final/MP/cifs/Al1Nb2.973Zr0.027-MP-mp-796-synth_doped.cif,data/source/MP/raw/cifs/mp-796.cif,mp-796,0.0,,2011-05-13 16:07:37,7.157298025966356,,,{'GGA': {'task_id': 'mp-1686893'}},0.0460773865000003,5.52947534,520.0,-69.48918494,-8.6861481175,"{'tags': ['Aluminium niobium (1/3)', 'Niobium aluminide (3/1)', 'Aluminum niobium (1/3)']}",-69.48918494,-8.6861481175,-0.1737753800000003,"['bandstructure', 'elasticity']",True,"[608675, 608654, 608688, 608668, 608669, 608685, 608676, 608683, 58014, 608657, 107856, 608655, 608666, 608691, 608656, 608665, 608673, 608653, 608661]",True,2021-05-12 10:56:31.128000,NM,8,10,mp-796,,Nb3Al,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Al': 1.0}",GGA,mp-796,"['mp-911586', 'mp-927906', 'mp-796', 'mp-927472', 'mp-1260512', 'mp-1440919', 'mp-1686893', 'mp-1927652', 'mp-1591599', 'mp-1587739']",0.16323955,"{'Nb': 6.0, 'Al': 2.0}",141.8490379078192,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0023015954483396,0.16323955,0,0.3264791,MP,data/source/MP/cleaned/cifs/MP-mp-796.cif,True,,data/final/MP/graphs/Al1Nb2.973Zr0.027-MP-mp-796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Gd0.037In1La2.963,2,0.0184999999999999,1.0,True,Gd0.037In1La2.963,In1La3,5.04,Other,True,Gd0.925In25La74.075,Gd-In-La,3,Supercon,La2.9628Gd0.0372In1,MP-mp-20909,La3In1,In-La,In25La75,P m -3 m,cubic,5.076766,5.076766,5.076766,data/final/MP/cifs/Gd0.037In1La2.963-MP-mp-20909-synth_doped.cif,data/source/MP/raw/cifs/mp-20909.cif,mp-20909,0.0,,2014-02-21 06:52:52,6.7455760598452565,10.17188/1196104,"@misc{osti_1196104,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La3In (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196104"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671685'}},0.0,8.16935076,520.0,-18.73796121,-4.6844903025,"{'tags': ['Indium lanthanum (1/3)', 'Lanthanum indium (3/1)']}",-18.73796121,-4.6844903025,-0.2945640412500001,"['xas', 'bandstructure']",True,"[639844, 51950, 639851, 639840, 603208, 107019]",True,2021-05-12 10:56:57.051000,NM,4,8,mp-20909,,La3In,"{'functional': 'PBE', 'labels': ['La', 'In_d'], 'pot_type': 'paw'}","{'La': 3.0, 'In': 1.0}",GGA,mp-20909,"['mp-906743', 'mp-921394', 'mp-920373', 'mp-20909', 'mp-1476042', 'mp-1671685', 'mp-1778647', 'mp-1590323']",0.0489742,"{'La': 3.0, 'In': 1.0}",130.84629766481785,[],NM,False,221,0,"[0, 0, 0, 0]",0.0003742880071811,0.0489742,0,0.0489742,MP,data/source/MP/cleaned/cifs/MP-mp-20909.cif,True,,data/final/MP/graphs/Gd0.037In1La2.963-MP-mp-20909-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Br2Ca1.875Cu1Na0.125O2,2,0.0357142857142857,1.0,True,Br2Ca1.875Cu1Na0.125O2,Br2Ca2Cu1O2,0.0,Cuprate,True,Br28.571Ca26.786Cu14.286Na1.786O28.571428571428573,Br-Ca-Cu-Na-O,5,Supercon,Ca1.875Na0.125Cu1Br2O2,MP-mp-545481,Ca2Cu1Br2O2,Br-Ca-Cu-O,Br28.571Ca28.571Cu14.286O28.571428571428573,I 4/m m m,tetragonal,3.8848960001664095,3.8848960001664095,9.26575389,data/final/MP/cifs/Br2Ca1.875Cu1Na0.125O2-MP-mp-545481-synth_doped.cif,data/source/MP/raw/cifs/mp-545481.cif,mp-545481,0.0,,2014-02-21 09:12:30,4.171489837215984,10.17188/1267001,"@misc{osti_1267001,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ca2Cu(BrO)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1267001"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687817'}},0.0,3.0811802,520.0,-34.65890385,-4.9512719785714285,{'tags': ['Dicalcium dibromodioxocuprate']},-34.65890385,-4.9512719785714285,-2.260101375,"['xas', 'elasticity', 'bandstructure']",True,[1028],True,2021-05-12 10:56:22.739000,NM,7,8,mp-545481,oxide,Ca2Cu(BrO)2,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Cu_pv', 'Br', 'O'], 'pot_type': 'paw'}","{'Ca': 2.0, 'Cu': 1.0, 'Br': 2.0, 'O': 2.0}",GGA,mp-545481,"['mp-1000746', 'mp-1007202', 'mp-545481', 'mp-1301034', 'mp-1687817', 'mp-1779505', 'mp-1011944', 'mp-1590430']",0.0093361,"{'Ca': 2.0, 'Cu': 1.0, 'Br': 2.0, 'O': 2.0}",133.55551405583833,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",6.990426464980444e-05,0.0093361,0,0.0093361,MP,data/source/MP/cleaned/cifs/MP-mp-545481.cif,True,,data/final/MP/graphs/Br2Ca1.875Cu1Na0.125O2-MP-mp-545481-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
La2.82Pr0.18S4,3,0.0514285714285714,2.0,False,La5.64Pr0.36S8,La6S8,4.33,Other,True,La40.286Pr2.571S57.143,La-Pr-S,3,Supercon,La2.82Pr0.18S4,MP-mp-567,La6S8,La-S,La42.857S57.143,I -4 3 d,cubic,7.5693010516779955,7.56930105,7.56930105,data/final/MP/cifs/La2.82Pr0.18S4-MP-mp-567-synth_doped.cif,data/source/MP/raw/cifs/mp-567.cif,mp-567,0.0,,2011-05-14 23:37:07,5.421398752978808,10.17188/1273636,"@misc{osti_1273636,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La3S4 (SG:220) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1273636"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698028'}},0.0227546757142862,9.03597254,520.0,-92.96715902,-6.640511358571429,"{'tags': ['Lanthanum sulfide (3/4) - gamma', 'Lanthanum sulfide (3/4)']}",-92.96715902,-6.640511358571429,-2.4488226753571425,"['xas', 'bandstructure']",True,"[641800, 641815, 641829, 641812, 641843, 56782, 641834]",True,2021-05-12 10:57:23.123000,NM,14,5,mp-567,,La3S4,"{'functional': 'PBE', 'labels': ['La', 'S'], 'pot_type': 'paw'}","{'La': 3.0, 'S': 4.0}",GGA,mp-567,"['mp-567', 'mp-1432616', 'mp-1698028', 'mp-1808182', 'mp-1608751']",0.4675276,"{'La': 6.0, 'S': 8.0}",333.84543746507785,[],NM,False,220,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0028008626000701,0.4675276,0,0.9350552,MP,data/source/MP/cleaned/cifs/MP-mp-567.cif,True,,data/final/MP/graphs/La2.82Pr0.18S4-MP-mp-567-synth_doped.json,0,True,-43m,5,0,0,0,0,0,0,0,0,1,0,1.0,False
As2Ba0.3Fe2Na0.7,3,0.0799999999999999,2.0,False,As4Ba0.6Fe4Na1.4,As4Ba1Fe4Na1,24.2,Ferrite,True,As40Ba6Fe40Na14,As-Ba-Fe-Na,4,Supercon,Ba0.3Na0.7Fe2As2,MP-mp-1227868,Ba1Na1Fe4As4,As-Ba-Fe-Na,As40Ba10Fe40Na10,C m m m,orthorhombic,5.458732000131759,5.462821,6.96934908,data/final/MP/cifs/As2Ba0.3Fe2Na0.7-MP-mp-1227868-synth_doped.cif,data/source/MP/raw/cifs/mp-1227868.cif,mp-1227868,0.0,,2019-01-13 03:39:01.428000,5.934244973483095,,,{'GGA': {'task_id': 'mp-1731957'}},0.0195872770000011,4.30353274,520.0,-59.62394279,-5.962394279,{'tags': []},-59.62394279,-5.962394279,-0.3865939246551718,[],False,[],True,2021-05-12 11:00:59.151000,FM,10,4,mp-1227868,,BaNa(FeAs)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Na_pv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Na': 1.0, 'Fe': 4.0, 'As': 4.0}",GGA,mp-1227868,"['mp-1227868', 'mp-1396889', 'mp-1731957', 'mp-1827521']",0.9949323,"{'Ba': 1.0, 'Na': 1.0, 'Fe': 4.0, 'As': 4.0}",191.22642477974767,[],FM,True,65,1,"[0.0, 0.0, 0.3, 0.3, 0.3, 0.3, 0.0, 0.0, 0.0, 0.0]",0.0052029017493055,0.9949323,4,0.9949323,MP,data/source/MP/cleaned/cifs/MP-mp-1227868.cif,True,,data/final/MP/graphs/As2Ba0.3Fe2Na0.7-MP-mp-1227868-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ag3Sn1,1,0.0,2.0,False,Ag6Sn2,Ag6Sn2,0.0,Other,True,Ag75Sn25,Ag-Sn,2,Supercon,Ag3Sn1,MP-mp-611,Ag6Sn2,Ag-Sn,Ag75Sn25,P m m n,orthorhombic,4.928945,5.299566,5.978397,data/final/MP/cifs/Ag3Sn1-MP-mp-611.cif,data/source/MP/raw/cifs/mp-611.cif,mp-611,0.0,,2011-05-14 10:06:42,9.406571034458798,10.17188/1277692,"@misc{osti_1277692,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ag3Sn (SG:59) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277692"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700557'}},0.0,5.26706411,520.0,-25.16803024,-3.14600378,"{'tags': ['Silver tin (3/1)', 'Silver stannide (3/1)']}",-25.16803024,-3.14600378,-0.0191938137500002,"['xas', 'bandstructure']",True,"[239251, 2721, 154084]",True,2021-05-12 10:57:28.836000,NM,8,9,mp-611,,Ag3Sn,"{'functional': 'PBE', 'labels': ['Ag', 'Sn_d'], 'pot_type': 'paw'}","{'Ag': 3.0, 'Sn': 1.0}",GGA,mp-611,"['mp-918763', 'mp-919767', 'mp-905779', 'mp-611', 'mp-1080409', 'mp-1435246', 'mp-1700557', 'mp-1779445', 'mp-1594352']",0.0004274,"{'Ag': 6.0, 'Sn': 2.0}",156.163318245714,[],NM,False,59,0,"[0, 0, 0, 0, 0, 0, 0, 0]",5.473756638899164e-06,0.0004274,0,0.0008548,MP,data/source/MP/cleaned/cifs/MP-mp-611.cif,False,,data/final/MP/graphs/Ag3Sn1-MP-mp-611.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Nb3Os1,1,0.0,2.0,False,Nb6Os2,Nb6Os2,0.663333333,Other,True,Nb75Os25,Nb-Os,2,Supercon,Nb3Os1,MP-mp-1932,Nb6Os2,Nb-Os,Nb75Os25,P m -3 n,cubic,5.179602,5.179602,5.179602,data/final/MP/cifs/Nb3Os1-MP-mp-1932.cif,data/source/MP/raw/cifs/mp-1932.cif,mp-1932,0.0,,2011-05-14 10:15:59,11.20767857188024,10.17188/1194239,"@misc{osti_1194239,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Os (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1194239"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704639'}},0.0,5.61834429,520.0,-84.99595231,-10.62449403875,{'tags': ['Niobium osmium (3/1)']},-84.99595231,-10.62449403875,-0.2416736950000011,"['xas', 'elasticity', 'bandstructure']",True,"[603783, 645150, 105184]",True,2021-05-12 10:56:14.760000,NM,8,8,mp-1932,,Nb3Os,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Os_pv'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Os': 1.0}",GGA,mp-1932,"['mp-912682', 'mp-929065', 'mp-929435', 'mp-1932', 'mp-1427426', 'mp-1704639', 'mp-1789424', 'mp-1593834']",0.00027085,"{'Nb': 6.0, 'Os': 2.0}",138.95979657593512,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",3.898249805683804e-06,0.00027085,0,0.0005417,MP,data/source/MP/cleaned/cifs/MP-mp-1932.cif,False,,data/final/MP/graphs/Nb3Os1-MP-mp-1932.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
La2.7Pr0.3Se4,3,0.0857142857142857,2.0,False,La5.4Pr0.6Se8,La6Se8,3.36,Other,True,La38.571Pr4.286Se57.143,La-Pr-Se,3,Supercon,La2.7Pr0.3Se4,MP-mp-491,La6Se8,La-Se,La42.857Se57.143,I -4 3 d,cubic,7.877519491746323,7.87751949,7.87751949,data/final/MP/cifs/La2.7Pr0.3Se4-MP-mp-491-synth_doped.cif,data/source/MP/raw/cifs/mp-491.cif,mp-491,0.0,,2011-05-14 23:56:19,6.46507544280331,10.17188/1208484,"@misc{osti_1208484,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La3Se4 (SG:220) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208484"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1670698'}},0.0059004883928572,7.97223997,520.0,-85.7790007,-6.127071478571429,{'tags': ['Lanthanum selenide (3/4)']},-85.7790007,-6.127071478571429,-2.283690446339285,"['xas', 'bandstructure']",True,"[60208, 641916, 641938, 641920, 641931]",True,2021-05-12 10:57:08.928000,NM,14,9,mp-491,,La3Se4,"{'functional': 'PBE', 'labels': ['La', 'Se'], 'pot_type': 'paw'}","{'La': 3.0, 'Se': 4.0}",GGA,mp-491,"['mp-922256', 'mp-922010', 'mp-907667', 'mp-491', 'mp-1116362', 'mp-1435004', 'mp-1670698', 'mp-1843423', 'mp-1597749']",0.5037201,"{'La': 6.0, 'Se': 8.0}",376.3107014156632,[],NM,False,220,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0026771500151604,0.5037201,0,1.0074402,MP,data/source/MP/cleaned/cifs/MP-mp-491.cif,True,,data/final/MP/graphs/La2.7Pr0.3Se4-MP-mp-491-synth_doped.json,0,True,-43m,5,0,0,0,0,0,0,0,0,1,0,1.0,False
Ba1.9Ca0.1Cu4Y1O8,2,0.0133333333333333,1.0,True,Ba1.9Ca0.1Cu4Y1O8,Ba2Cu4Y1O8,85.4,Cuprate,True,Ba12.667Ca0.667Cu26.667Y6.667O53.333333333333336,Ba-Ca-Cu-Y-O,5,Supercon,Y1Ba1.9Ca0.1Cu4O8,MP-mp-6790,Ba2Y1Cu4O8,Ba-Cu-Y-O,Ba13.333Cu26.667Y6.667O53.333333333333336,C m m m,orthorhombic,3.889922,3.899603999537882,13.88942687,data/final/MP/cifs/Ba1.9Ca0.1Cu4Y1O8-MP-mp-6790-synth_doped.cif,data/source/MP/raw/cifs/mp-6790.cif,mp-6790,0.0,,2011-05-16 03:21:24,5.936250568336678,10.17188/1283441,"@misc{osti_1283441,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Y(CuO2)4 (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1283441"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686864'}},0.0,3.31391536,520.0,-91.58381472,-6.105587648,"{'tags': ['Yttrium barium copper oxide (1/2/4/8)', 'High pressure experimental phase']}",-91.58381472,-6.105587648,-2.0529924817777783,"['xas', 'bandstructure']",True,"[72261, 85273, 74251, 400273, 85277, 85275, 400280, 67632, 85272, 67631, 83920, 66613, 85279, 400277, 75689, 74259, 85278, 85280, 66603, 94265, 400276, 88873, 71417, 75712, 97052, 66605, 72258, 85281, 85274, 400279, 66604, 69698]",True,2021-05-12 10:57:34.594000,NM,15,10,mp-6790,oxide,Ba2Y(CuO2)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-6790,"['mp-1000664', 'mp-6790', 'mp-1007136', 'mp-1237713', 'mp-1440937', 'mp-1686864', 'mp-1834179', 'mp-1011883', 'mp-1590064', 'mp-1590433']",0.0004643,"{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",208.60454115924333,[],NM,False,65,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.225742533790601e-06,0.0004643,0,0.0004643,MP,data/source/MP/cleaned/cifs/MP-mp-6790.cif,True,,data/final/MP/graphs/Ba1.9Ca0.1Cu4Y1O8-MP-mp-6790-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Nb0.22U0.78,3,0.06,8.0,False,Nb1.76U6.24,Nb2U6,2.01,Heavy_fermion,True,Nb22U78,Nb-U,2,Supercon,Nb0.22U0.78,MP-mp-972551,U6Nb2,Nb-U,Nb25U75,P 63/m m c,hexagonal,5.47549,5.930717999946023,5.930717609999999,data/final/MP/cifs/Nb0.22U0.78-MP-mp-972551-synth_doped.cif,data/source/MP/raw/cifs/mp-972551.cif,mp-972551,0.0,,2015-09-16 01:37:32,16.068701668754734,10.17188/1313878,"@misc{osti_1313878,
    author = ""Persson, Kristin"",
    title = ""Materials Data on U3Nb (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1313878"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1752359'}},0.3415145425000006,12.07866299,520.0,-85.2189538,-10.652369225,{'tags': []},-85.2189538,-10.652369225,0.3415145425000006,"['xas', 'bandstructure']",True,[],True,2021-05-12 10:57:55.580000,NM,8,8,mp-972551,,U3Nb,"{'functional': 'PBE', 'labels': ['U', 'Nb_pv'], 'pot_type': 'paw'}","{'U': 3.0, 'Nb': 1.0}",GGA,mp-972551,"['mp-972719', 'mp-972786', 'mp-972551', 'mp-1386707', 'mp-1752359', 'mp-1827596', 'mp-1655008', 'mp-972844']",0.14362885,"{'U': 6.0, 'Nb': 2.0}",166.789279340187,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0017222791604855,0.14362885,0,0.2872577,MP,data/source/MP/cleaned/cifs/MP-mp-972551.cif,True,,data/final/MP/graphs/Nb0.22U0.78-MP-mp-972551-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Dy3Ge13Ru4,1,0.0,2.0,False,Dy6Ge26Ru8,Dy6Ge26Ru8,0.0,Other,True,Dy15Ge65Ru20,Dy-Ge-Ru,3,Supercon,Dy3Ru4Ge13,MP-mp-1197267,Dy6Ge26Ru8,Dy-Ge-Ru,Dy15Ge65Ru20,P m -3 n,cubic,9.102695,9.102695,9.102695,data/final/MP/cifs/Dy3Ge13Ru4-MP-mp-1197267.cif,data/source/MP/raw/cifs/mp-1197267.cif,mp-1197267,0.0,,2019-01-12 02:16:36.036000,8.084728683713513,,,,0.0201362117499988,4.63789846,520.0,-239.64727485,-5.99118187125,"{'tags': ['Dysprosium ruthenium germanide (3/4/13)', 'Yb3Rh4Sn13', 'Dy3Ru4Ge13']}",-239.64727485,-5.99118187125,-0.4403178085,[],False,[629815],True,2021-05-12 11:00:01.375000,NM,40,3,mp-1197267,,Dy3Ge13Ru4,"{'functional': 'PBE', 'labels': ['Dy_3', 'Ge_d', 'Ru_pv'], 'pot_type': 'paw'}","{'Dy': 3.0, 'Ge': 13.0, 'Ru': 4.0}",GGA,mp-1197267,"['mp-1197267', 'mp-1341972', 'mp-1938458']",0.0119215,"{'Dy': 6.0, 'Ge': 26.0, 'Ru': 8.0}",754.2407171501565,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.16119236973695e-05,0.0119215,0,0.023843,MP,data/source/MP/cleaned/cifs/MP-mp-1197267.cif,False,,data/final/MP/graphs/Dy3Ge13Ru4-MP-mp-1197267.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
As2Ba0.5Fe1.8K0.5Ru0.2,3,0.0799999999999999,2.0,False,As4Ba1Fe3.6K1Ru0.4,As4Ba1Fe4K1,36.5,Ferrite,True,As40Ba10Fe36K10Ru4,As-Ba-Fe-K-Ru,5,Supercon,Ba0.5K0.5Fe1.8Ru0.2As2,MP-mp-1223517,K1Ba1Fe4As4,As-Ba-Fe-K,As40Ba10Fe40K10,C m m m,orthorhombic,5.479027,5.480024002658328,7.13170472,data/final/MP/cifs/As2Ba0.5Fe1.8K0.5Ru0.2-MP-mp-1223517-synth_doped.cif,data/source/MP/raw/cifs/mp-1223517.cif,mp-1223517,0.0,,2019-01-12 23:54:03.876000,5.87534599912672,,,{'GGA': {'task_id': 'mp-1743010'}},0.0132513644999994,4.21185628,520.0,-59.66633886,-5.966633886,{'tags': []},-59.66633886,-5.966633886,-0.4120461663000007,[],False,[],True,2021-05-12 11:00:52.054000,FM,10,4,mp-1223517,,KBa(FeAs)4,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",GGA,mp-1223517,"['mp-1223517', 'mp-1396881', 'mp-1743010', 'mp-1827585']",0.9947188,"{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",197.6961518155852,[],FM,True,65,1,"[0.0, 0.0, 0.3, 0.3, 0.3, 0.3, 0.0, 0.0, 0.0, 0.0]",0.0050315536790412,0.9947188,4,0.9947188,MP,data/source/MP/cleaned/cifs/MP-mp-1223517.cif,True,,data/final/MP/graphs/As2Ba0.5Fe1.8K0.5Ru0.2-MP-mp-1223517-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Cu0.6La2Li0.4O4,2,0.0285714285714285,2.0,False,Cu1.2La4Li0.8O8,Cu1La4Li1O8,0.0,Cuprate,True,Cu8.571La28.571Li5.714O57.142857142857146,Cu-La-Li-O,4,Supercon,La2Cu0.6Li0.4O4,MP-mp-21496,Li1La4Cu1O8,Cu-La-Li-O,Cu7.143La28.571Li7.143O57.142857142857146,C m m m,orthorhombic,5.305003,5.312343996410554,7.11242369,data/final/MP/cifs/Cu0.6La2Li0.4O4-MP-mp-21496-synth_doped.cif,data/source/MP/raw/cifs/mp-21496.cif,mp-21496,0.8123999999999993,,2013-10-01 22:21:11,6.734535403686981,10.17188/1196949,"@misc{osti_1196949,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LiLa4CuO8 (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196949"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698136'}},0.0143939401785697,6.81909937,520.0,-104.18208744,-7.441577674285715,{'tags': ['Lanthanum copper lithium oxide (2/.5/.5/4)']},-104.18208744,-7.441577674285715,-3.1673029602380955,"['xas', 'bandstructure']",True,[202958],True,2021-05-12 10:56:59.077000,NM,14,7,mp-21496,oxide,LiLa4CuO8,"{'functional': 'PBE', 'labels': ['Li_sv', 'La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Li': 1.0, 'La': 4.0, 'Cu': 1.0, 'O': 8.0}",GGA,mp-21496,"['mp-661492', 'mp-671043', 'mp-21496', 'mp-1415128', 'mp-1698136', 'mp-1787372', 'mp-692704']",6.15e-05,"{'Li': 1.0, 'La': 4.0, 'Cu': 1.0, 'O': 8.0}",185.9399661685489,[],NM,False,65,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.307519156169586e-07,6.15e-05,0,6.15e-05,MP,data/source/MP/cleaned/cifs/MP-mp-21496.cif,True,,data/final/MP/graphs/Cu0.6La2Li0.4O4-MP-mp-21496-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Cu1Sr0.85Y0.15O2,3,0.075,2.0,False,Cu2Sr1.7Y0.3O4,Cu2Sr2O4,36.6,Cuprate,True,Cu25Sr21.25Y3.75O50,Cu-Sr-Y-O,4,Supercon,Sr0.85Y0.15Cu1O2,MP-mp-5787,Sr2Cu2O4,Cu-Sr-O,Cu25Sr25O50,C m c m,orthorhombic,3.644437999912225,3.974263,8.32909336,data/final/MP/cifs/Cu1Sr0.85Y0.15O2-MP-mp-5787-synth_doped.cif,data/source/MP/raw/cifs/mp-5787.cif,mp-5787,0.0,,2011-05-13 22:43:08,5.167573150857569,10.17188/1276630,"@misc{osti_1276630,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SrCuO2 (SG:63) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1276630"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703560'}},0.0,3.45760864,520.0,-45.24374469,-5.65546808625,"{'tags': ['Strontium cuprate', 'Strontium copper oxide']}",-45.24374469,-5.65546808625,-2.0778125529166664,"['xas', 'elasticity', 'bandstructure']",True,"[77291, 93653, 202992, 16217, 83051, 77293]",True,2021-05-12 10:56:27.046000,NM,8,8,mp-5787,oxide,SrCuO2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Cu': 1.0, 'O': 2.0}",GGA,mp-5787,"['mp-924142', 'mp-909103', 'mp-5787', 'mp-924940', 'mp-1475985', 'mp-1703560', 'mp-1802910', 'mp-1593696']",4e-07,"{'Sr': 2.0, 'Cu': 2.0, 'O': 4.0}",117.71572347282628,[],NM,False,63,0,"[0, 0, 0, 0, 0, 0, 0, 0]",6.796033498317439e-09,4e-07,0,8e-07,MP,data/source/MP/cleaned/cifs/MP-mp-5787.cif,True,,data/final/MP/graphs/Cu1Sr0.85Y0.15O2-MP-mp-5787-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Rh1Si1Tb1,1,0.0,2.0,False,Rh2Si2Tb2,Rh2Si2Tb2,0.0,Other,True,Rh33.333Si33.333Tb33.333,Rh-Si-Tb,3,Supercon,Tb1Rh1Si1,MP-mp-1239087,Tb4Si4Rh4,Rh-Si-Tb,Rh33.333Si33.333Tb33.333,C m c m,orthorhombic,4.034097,5.337442,5.522988224680775,data/final/MP/cifs/Rh1Si1Tb1-MP-mp-1239087.cif,data/source/MP/raw/cifs/mp-1239087.cif,mp-1239087,0.0,,2019-04-19 18:42:39.414000,8.697277815280595,,,{'GGA': {'task_id': 'mp-1755035'}},0.1567385355952382,6.38023298,520.0,-79.95314098,-6.662761748333334,{'tags': ['Rhodium terbium silicide (1/1/1)']},-79.95314098,-6.662761748333334,-0.8310990849999994,['bandstructure'],True,[52075],True,2021-05-12 10:58:49.477000,NM,12,6,mp-1239087,,TbSiRh,"{'functional': 'PBE', 'labels': ['Tb_3', 'Si', 'Rh_pv'], 'pot_type': 'paw'}","{'Tb': 1.0, 'Si': 1.0, 'Rh': 1.0}",GGA,mp-1239087,"['mp-1239087', 'mp-1409219', 'mp-1755035', 'mp-1785937', 'mp-1874084', 'mp-1619692']",3.94e-05,"{'Tb': 4.0, 'Si': 4.0, 'Rh': 4.0}",221.4106231608504,[],NM,False,11,0,"[0.0, -0.0, 0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",7.117996316080406e-07,3.94e-05,0,0.0001576,MP,data/source/MP/cleaned/cifs/MP-mp-1239087.cif,False,,data/final/MP/graphs/Rh1Si1Tb1-MP-mp-1239087.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
C1Mg1Ni2.967Ru0.033,2,0.0132000000000002,1.0,True,C1Mg1Ni2.967Ru0.033,C1Mg1Ni3,6.1,Other,True,C20Mg20Ni59.34Ru0.66,C-Mg-Ni-Ru,4,Supercon,Mg1C1Ni2.967Ru0.033,MP-mp-10700,Mg1Ni3C1,C-Mg-Ni,C20Mg20Ni60,P m -3 m,cubic,3.810209,3.810209,3.810209,data/final/MP/cifs/C1Mg1Ni2.967Ru0.033-MP-mp-10700-synth_doped.cif,data/source/MP/raw/cifs/mp-10700.cif,mp-10700,0.0,,2011-05-28 10:04:44,6.376007671789427,10.17188/1187303,"@misc{osti_1187303,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MgNi3C (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187303"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678621'}},0.0,6.64260176,520.0,-28.85099542,-5.770199084,{'tags': ['Magnesium nickel carbide (1/3/1)']},-28.85099542,-5.770199084,-0.1367049259999994,"['xas', 'elasticity', 'bandstructure']",True,[77152],True,2021-05-12 10:56:10.715000,NM,5,8,mp-10700,,MgNi3C,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Ni_pv', 'C'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",GGA,mp-10700,"['mp-927245', 'mp-927653', 'mp-911184', 'mp-10700', 'mp-1438083', 'mp-1678621', 'mp-1791467', 'mp-1591421']",0.0387875,"{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",55.31544309398296,[],NM,False,221,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",0.0007012056277683,0.0387875,0,0.0387875,MP,data/source/MP/cleaned/cifs/MP-mp-10700.cif,True,,data/final/MP/graphs/C1Mg1Ni2.967Ru0.033-MP-mp-10700-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Bi2Cu2Er1Sr2O8,1,0.0,1.0,True,Bi2Cu2Er1Sr2O8,Bi2Cu2Er1Sr2O8,0.0,Cuprate,True,Bi13.333Cu13.333Er6.667Sr13.333O53.333333333333336,Bi-Cu-Er-Sr-O,5,Supercon,Bi2Sr2Er1Cu2O8,MP-mp-1208931,Sr2Er1Cu2Bi2O8,Bi-Cu-Er-Sr-O,Bi13.333Cu13.333Er6.667Sr13.333O53.333333333333336,I 4/m m m,tetragonal,3.7804300012984777,3.7804300012984777,15.46020447,data/final/MP/cifs/Bi2Cu2Er1Sr2O8-MP-mp-1208931.cif,data/source/MP/raw/cifs/mp-1208931.cif,mp-1208931,0.0,,2019-01-12 11:45:15.622000,7.748943221248176,,,{'GGA': {'task_id': 'mp-1746367'}},0.1152286431666844,5.2819214,520.0,-90.48520749,-6.032347165999999,"{'tags': ['Ba2CaCu2Tl2O8', 'Sr2Cu2ErBi2O8', 'high-Tc cuprate family']}",-90.48520749,-6.032347165999999,-2.164822118222222,[],False,[],True,2021-05-12 11:00:21.818000,NM,15,4,mp-1208931,oxide,Sr2ErCu2(BiO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Er_3', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Er': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",GGA,mp-1208931,"['mp-1208931', 'mp-1387565', 'mp-1746367', 'mp-1789014']",0.0201699,"{'Sr': 2.0, 'Er': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",217.62392874996405,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",9.268236317511722e-05,0.0201699,0,0.0201699,MP,data/source/MP/cleaned/cifs/MP-mp-1208931.cif,False,,data/final/MP/graphs/Bi2Cu2Er1Sr2O8-MP-mp-1208931.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ir0.95Pd0.05Te2,2,0.0333333333333333,4.0,False,Ir3.8Pd0.2Te8,Ir4Te8,2.5,Other,True,Ir31.667Pd1.667Te66.667,Ir-Pd-Te,3,Supercon,Ir0.95Pd0.05Te2,MP-mp-569322,Te8Ir4,Ir-Te,Ir33.333Te66.667,P n m a,orthorhombic,4.049805,5.441863,13.587474,data/final/MP/cifs/Ir0.95Pd0.05Te2-MP-mp-569322-synth_doped.cif,data/source/MP/raw/cifs/mp-569322.cif,mp-569322,0.0,,2014-02-16 04:48:25,9.924328423353325,10.17188/1275037,"@misc{osti_1275037,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Te2Ir (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1275037"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1746248'}},0.0123894575000003,7.60847828,520.0,-63.94410921,-5.3286757675,{'tags': ['Iridium telluride (1/2)']},-63.94410921,-5.3286757675,-0.5683316741666667,"['xas', 'bandstructure']",True,[93894],True,2021-05-12 10:57:24.969000,NM,12,7,mp-569322,,Te2Ir,"{'functional': 'PBE', 'labels': ['Te', 'Ir'], 'pot_type': 'paw'}","{'Te': 2.0, 'Ir': 1.0}",GGA,mp-569322,"['mp-927873', 'mp-927408', 'mp-569322', 'mp-911451', 'mp-1392626', 'mp-1746248', 'mp-1810340']",0.000153075,"{'Te': 8.0, 'Ir': 4.0}",299.44732816890644,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.0447669503153013e-06,0.000153075,0,0.0006123,MP,data/source/MP/cleaned/cifs/MP-mp-569322.cif,True,,data/final/MP/graphs/Ir0.95Pd0.05Te2-MP-mp-569322-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
B2Mg0.96Mn0.04,2,0.0266666666666666,1.0,True,B2Mg0.96Mn0.04,B2Mg1,32.3,Other,True,B66.667Mg32Mn1.333,B-Mg-Mn,3,Supercon,Mg0.96Mn0.04B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B2Mg0.96Mn0.04-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B2Mg0.96Mn0.04-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Cu0.786Sb0.214,3,0.072,4.0,False,Cu3.144Sb0.856,Cu3Sb1,0.047,Other,True,Cu78.6Sb21.4,Cu-Sb,2,Supercon,Cu0.786Sb0.214,MP-mp-1183969,Cu3Sb1,Cu-Sb,Cu75Sb25,P m -3 m,cubic,3.897337,3.897337,3.897337,data/final/MP/cifs/Cu0.786Sb0.214-MP-mp-1183969-synth_doped.cif,data/source/MP/raw/cifs/mp-1183969.cif,mp-1183969,0.0,,2019-01-11 12:25:50.087000,8.763013093741133,,,{'GGA': {'task_id': 'mp-1732807'}},0.066506673750001,8.48039287,520.0,-16.09072252,-4.02268063,{'tags': []},-16.09072252,-4.02268063,0.0359746825,['bandstructure'],True,[],True,2021-05-12 10:58:27.755000,NM,4,5,mp-1183969,,Cu3Sb,"{'functional': 'PBE', 'labels': ['Cu_pv', 'Sb'], 'pot_type': 'paw'}","{'Cu': 3.0, 'Sb': 1.0}",GGA,mp-1183969,"['mp-1183969', 'mp-1430317', 'mp-1732807', 'mp-1791597', 'mp-1617901']",0.0006487,"{'Cu': 3.0, 'Sb': 1.0}",59.197570262472446,[],NM,False,221,0,"[0, 0, 0, 0]",1.0958220027000587e-05,0.0006487,0,0.0006487,MP,data/source/MP/cleaned/cifs/MP-mp-1183969.cif,True,,data/final/MP/graphs/Cu0.786Sb0.214-MP-mp-1183969-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Er1Pd2Sn1,1,0.0,1.0,True,Er1Pd2Sn1,Er1Pd2Sn1,0.585,Other,True,Er25Pd50Sn25,Er-Pd-Sn,3,Supercon,Er1Pd2Sn1,MP-mp-5850,Er1Sn1Pd2,Er-Pd-Sn,Er25Pd50Sn25,F m -3 m,cubic,4.78219427,4.78219427,4.78219427,data/final/MP/cifs/Er1Pd2Sn1-MP-mp-5850.cif,data/source/MP/raw/cifs/mp-5850.cif,mp-5850,0.0,,2011-05-13 00:05:51,10.71067227167776,10.17188/1277090,"@misc{osti_1277090,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ErSnPd2 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277090"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700202'}},0.0,6.39384258,520.0,-22.50225514,-5.625563785,{'tags': ['Erbium palladium tin (1/2/1)']},-22.50225514,-5.625563785,-0.8913002137499992,"['xas', 'bandstructure']",True,"[103283, 103284]",True,2021-05-12 10:57:26.891000,NM,4,8,mp-5850,,ErSnPd2,"{'functional': 'PBE', 'labels': ['Er_3', 'Sn_d', 'Pd'], 'pot_type': 'paw'}","{'Er': 1.0, 'Sn': 1.0, 'Pd': 2.0}",GGA,mp-5850,"['mp-991640', 'mp-5850', 'mp-993556', 'mp-1438533', 'mp-1700202', 'mp-1801714', 'mp-994862', 'mp-1588611']",0.0008924,"{'Er': 1.0, 'Sn': 1.0, 'Pd': 2.0}",77.33331860614689,[],NM,False,225,0,"[0, 0, 0, 0]",1.1539657370000246e-05,0.0008924,0,0.0008924,MP,data/source/MP/cleaned/cifs/MP-mp-5850.cif,False,,data/final/MP/graphs/Er1Pd2Sn1-MP-mp-5850.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Be1Ta2,1,0.0,2.0,False,Be2Ta4,Be2Ta4,0.0,Other,True,Be33.333Ta66.667,Be-Ta,2,Supercon,Be1Ta2,MP-mp-11278,Ta4Be2,Be-Ta,Be33.333Ta66.667,I 4/m c m,tetragonal,4.905991997042101,4.925782080008417,4.92578208,data/final/MP/cifs/Be1Ta2-MP-mp-11278.cif,data/source/MP/raw/cifs/mp-11278.cif,mp-11278,0.0,,2011-05-28 06:18:23,13.760917565873743,10.17188/1187700,"@misc{osti_1187700,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ta2Be (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187700"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701619'}},0.0,4.89728686,520.0,-55.87168717,-9.311947861666669,{'tags': ['Beryllium tantalum (1/2)']},-55.87168717,-9.311947861666669,-0.1602918200000012,"['xas', 'elasticity', 'bandstructure']",True,[58738],True,2021-05-12 10:56:10.715000,NM,6,8,mp-11278,,Ta2Be,"{'functional': 'PBE', 'labels': ['Ta_pv', 'Be_sv'], 'pot_type': 'paw'}","{'Ta': 2.0, 'Be': 1.0}",GGA,mp-11278,"['mp-11278', 'mp-912100', 'mp-928169', 'mp-928703', 'mp-1427967', 'mp-1701619', 'mp-1783240', 'mp-1593171']",0.00035515,"{'Ta': 4.0, 'Be': 2.0}",89.51541564795357,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0]",7.934946119151916e-06,0.00035515,0,0.0007103,MP,data/source/MP/cleaned/cifs/MP-mp-11278.cif,False,,data/final/MP/graphs/Be1Ta2-MP-mp-11278.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As2Ba1Fe1.125Ru0.875,2,0.05,1.0,True,As2Ba1Fe1.125Ru0.875,As2Ba1Fe1Ru1,22.5,Ferrite,True,As40Ba20Fe22.5Ru17.5,As-Ba-Fe-Ru,4,Supercon,Ba1Fe1.125Ru0.875As2,MP-mp-1227957,Ba1Fe1As2Ru1,As-Ba-Fe-Ru,As40Ba20Fe20Ru20,I -4 m 2,tetragonal,4.094864001738776,4.094864001738776,6.95494631,data/final/MP/cifs/As2Ba1Fe1.125Ru0.875-MP-mp-1227957-synth_doped.cif,data/source/MP/raw/cifs/mp-1227957.cif,mp-1227957,0.0,,2019-01-13 03:43:43.313000,6.954649854678861,,,{'GGA': {'task_id': 'mp-1760595'}},0.0416149764999991,4.99960359,520.0,-31.92363508,-6.384727016,{'tags': []},-31.92363508,-6.384727016,-0.5884058670000002,['bandstructure'],True,[],True,2021-05-12 10:58:49.477000,FM,5,5,mp-1227957,,BaFeAs2Ru,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Fe_pv', 'As', 'Ru_pv'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Fe': 1.0, 'As': 2.0, 'Ru': 1.0}",GGA,mp-1227957,"['mp-1227957', 'mp-1384589', 'mp-1760595', 'mp-1795888', 'mp-1627878']",0.1424858,"{'Ba': 1.0, 'Fe': 1.0, 'As': 2.0, 'Ru': 1.0}",106.03277503651196,[],FM,True,119,1,"[0.0, 0.2, 0.0, 0.0, -0.0]",0.0013437901625316,0.1424858,1,0.1424858,MP,data/source/MP/cleaned/cifs/MP-mp-1227957.cif,True,,data/final/MP/graphs/As2Ba1Fe1.125Ru0.875-MP-mp-1227957-synth_doped.json,0,True,-42m,0,0,0,0,6,0,0,0,0,1,0,1.0,False
Ba0.66Bi1K0.34O3,2,0.0026666666666666,3.0,False,Ba1.98Bi3K1.02O9,Ba2Bi3K1O9,28.1,Oxide,True,Ba13.2Bi20K6.8O60,Ba-Bi-K-O,4,Supercon,Ba0.66K0.34Bi1O3,MP-mp-1223518,K1Ba2Bi3O9,Ba-Bi-K-O,Ba13.333Bi20K6.667O60,P -3 m 1,trigonal,6.18756400330999,6.187564340000001,7.581401,data/final/MP/cifs/Ba0.66Bi1K0.34O3-MP-mp-1223518-synth_doped.cif,data/source/MP/raw/cifs/mp-1223518.cif,mp-1223518,0.0,,2019-01-12 23:54:06.965000,7.16530091201999,,,{'GGA': {'task_id': 'mp-1729135'}},0.001551682833333,3.46143017,520.0,-85.22271396,-5.681514264,{'tags': []},-85.22271396,-5.681514264,-2.0170414252000004,[],False,[],True,2021-05-12 11:00:52.054000,NM,15,4,mp-1223518,oxide,KBa2(BiO3)3,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Bi', 'O'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 2.0, 'Bi': 3.0, 'O': 9.0}",GGA,mp-1223518,"['mp-1223518', 'mp-1391182', 'mp-1729135', 'mp-1775199']",4.99e-05,"{'K': 1.0, 'Ba': 2.0, 'Bi': 3.0, 'O': 9.0}",251.37352739849624,[],NM,False,164,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.9850936777799505e-07,4.99e-05,0,4.99e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1223518.cif,True,,data/final/MP/graphs/Ba0.66Bi1K0.34O3-MP-mp-1223518-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ge0.22Nb1,3,0.1393442622950819,24.0,False,Ge5.28Nb24,Ge8Nb24,5.3,Other,True,Ge18.033Nb81.967,Ge-Nb,2,Supercon,Ge0.22Nb1,MP-mp-1198302,Nb24Ge8,Ge-Nb,Ge25Nb75,P 42/n,tetragonal,5.306278,10.359149,10.359149,data/final/MP/cifs/Ge0.22Nb1-MP-mp-1198302-synth_doped.cif,data/source/MP/raw/cifs/mp-1198302.cif,mp-1198302,0.0,,2019-01-12 03:06:44.296000,8.196948021040575,,,{'GGA': {'task_id': 'mp-1742625'}},0.0019252397916673,5.75996855,520.0,-289.59347082,-9.049795963125,{'tags': ['Niobium germanide (3/1)']},-289.59347082,-9.049795963125,-0.318060219374999,[],False,[637202],True,2021-05-12 11:00:03.538000,NM,32,4,mp-1198302,,Nb3Ge,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Ge_d'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Ge': 1.0}",GGA,mp-1198302,"['mp-1198302', 'mp-1395148', 'mp-1742625', 'mp-1889888']",7.45875e-05,"{'Nb': 24.0, 'Ge': 8.0}",569.4271349573957,[],NM,False,86,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.0478952676616736e-06,7.45875e-05,0,0.0005967,MP,data/source/MP/cleaned/cifs/MP-mp-1198302.cif,True,,data/final/MP/graphs/Ge0.22Nb1-MP-mp-1198302-synth_doped.json,0,True,4/m,0,0,0,0,3,0,0,1,0,0,0,1.0,False
Nb0.45Re0.55,3,0.1,2.0,False,Nb0.9Re1.1,Nb1Re1,6.2,Other,True,Nb45Re55,Nb-Re,2,Supercon,Nb0.45Re0.55,MP-mp-1220322,Nb1Re1,Nb-Re,Nb50Re50,C m m m,orthorhombic,2.780963,2.780963,4.535669,data/final/MP/cifs/Nb0.45Re0.55-MP-mp-1220322-synth_doped.cif,data/source/MP/raw/cifs/mp-1220322.cif,mp-1220322,0.0,,2019-01-12 21:11:16.524000,14.037573111624948,,,{'GGA': {'task_id': 'mp-1674486'}},0.0,6.51687711,520.0,-22.82601076,-11.41300538,{'tags': []},-22.82601076,-11.41300538,-0.1400892675000005,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,2,5,mp-1220322,,NbRe,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Re_pv'], 'pot_type': 'paw'}","{'Nb': 1.0, 'Re': 1.0}",GGA,mp-1220322,"['mp-1220322', 'mp-1422874', 'mp-1674486', 'mp-1794151', 'mp-1610446']",0.0013699,"{'Nb': 1.0, 'Re': 1.0}",33.01700855377558,[],NM,False,65,0,"[0, 0]",4.149073644175884e-05,0.0013699,0,0.0013699,MP,data/source/MP/cleaned/cifs/MP-mp-1220322.cif,True,,data/final/MP/graphs/Nb0.45Re0.55-MP-mp-1220322-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
As2Ba0.875Fe2K0.125,3,0.0833333333333333,3.0,False,As6Ba2.625Fe6K0.375,As6Ba2Fe6K1,0.0,Ferrite,True,As40Ba17.5Fe40K2.5,As-Ba-Fe-K,4,Supercon,Ba0.875K0.125Fe2As2,MP-mp-1223567,K1Ba2Fe6As6,As-Ba-Fe-K,As40Ba13.333Fe40K6.667,C 1 2/m 1,monoclinic,5.48060788,7.102799640000001,8.784942288492543,data/final/MP/cifs/As2Ba0.875Fe2K0.125-MP-mp-1223567-synth_doped.cif,data/source/MP/raw/cifs/mp-1223567.cif,mp-1223567,0.0,,2019-01-12 23:56:38.667000,6.101417464045543,,,,0.0186882046666676,4.38014394,520.0,-90.51509253,-6.034339502,{'tags': []},-90.51509253,-6.034339502,-0.4527993862000007,[],False,[],True,2021-05-12 11:00:52.054000,FM,15,4,mp-1223567,,KBa2(FeAs)6,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 2.0, 'Fe': 6.0, 'As': 6.0}",GGA,mp-1223567,"['mp-1223567', 'mp-1374097', 'mp-1656306', 'mp-1808539']",1.3326448,"{'K': 1.0, 'Ba': 2.0, 'Fe': 6.0, 'As': 6.0}",298.92336486922324,[],FM,True,12,2,"[0.0, 0.0, 0.0, 0.3, 0.3, 0.1, 0.3, 0.1, 0.3, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0044581486649028,1.3326448,6,1.3326448,MP,data/source/MP/cleaned/cifs/MP-mp-1223567.cif,True,,data/final/MP/graphs/As2Ba0.875Fe2K0.125-MP-mp-1223567-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
Ir0.92Pt0.08Te2,3,0.0533333333333333,4.0,False,Ir3.68Pt0.32Te8,Ir4Te8,2.385,Other,True,Ir30.667Pt2.667Te66.667,Ir-Pt-Te,3,Supercon,Ir0.92Pt0.08Te2,MP-mp-569322,Te8Ir4,Ir-Te,Ir33.333Te66.667,P n m a,orthorhombic,4.049805,5.441863,13.587474,data/final/MP/cifs/Ir0.92Pt0.08Te2-MP-mp-569322-synth_doped.cif,data/source/MP/raw/cifs/mp-569322.cif,mp-569322,0.0,,2014-02-16 04:48:25,9.924328423353325,10.17188/1275037,"@misc{osti_1275037,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Te2Ir (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1275037"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1746248'}},0.0123894575000003,7.60847828,520.0,-63.94410921,-5.3286757675,{'tags': ['Iridium telluride (1/2)']},-63.94410921,-5.3286757675,-0.5683316741666667,"['xas', 'bandstructure']",True,[93894],True,2021-05-12 10:57:24.969000,NM,12,7,mp-569322,,Te2Ir,"{'functional': 'PBE', 'labels': ['Te', 'Ir'], 'pot_type': 'paw'}","{'Te': 2.0, 'Ir': 1.0}",GGA,mp-569322,"['mp-927873', 'mp-927408', 'mp-569322', 'mp-911451', 'mp-1392626', 'mp-1746248', 'mp-1810340']",0.000153075,"{'Te': 8.0, 'Ir': 4.0}",299.44732816890644,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.0447669503153013e-06,0.000153075,0,0.0006123,MP,data/source/MP/cleaned/cifs/MP-mp-569322.cif,True,,data/final/MP/graphs/Ir0.92Pt0.08Te2-MP-mp-569322-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Pd2.8S1,3,0.1263157894736842,2.0,False,Pd5.6S2,Pd8S2,1.63,Other,True,Pd73.684S26.316,Pd-S,2,Supercon,Pd2.8S1,MP-mp-7819,Pd8S2,Pd-S,Pd80S20,P -4 21 c,tetragonal,5.197063,5.197063,5.666153,data/final/MP/cifs/Pd2.8S1-MP-mp-7819-synth_doped.cif,data/source/MP/raw/cifs/mp-7819.cif,mp-7819,0.0,,2011-05-30 06:05:46,9.933411845754351,10.17188/1307591,"@misc{osti_1307591,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Pd4S (SG:114) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1307591"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700118'}},0.0,5.53812483,520.0,-51.48905343,-5.148905343,{'tags': ['Palladium sulfide (4/1)']},-51.48905343,-5.148905343,-0.2783099216249994,"['xas', 'elasticity', 'bandstructure']",True,"[648748, 648755, 23865]",True,2021-05-12 10:56:31.128000,NM,10,10,mp-7819,,Pd4S,"{'functional': 'PBE', 'labels': ['Pd', 'S'], 'pot_type': 'paw'}","{'Pd': 4.0, 'S': 1.0}",GGA,mp-7819,"['mp-929271', 'mp-930127', 'mp-913042', 'mp-7819', 'mp-1079490', 'mp-1101064', 'mp-1425982', 'mp-1700118', 'mp-1789606', 'mp-1595537']",0.0004298,"{'Pd': 8.0, 'S': 2.0}",153.03975448590575,[],NM,False,114,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.616841211537393e-06,0.0004298,0,0.0008596,MP,data/source/MP/cleaned/cifs/MP-mp-7819.cif,True,,data/final/MP/graphs/Pd2.8S1-MP-mp-7819-synth_doped.json,0,True,-42m,0,0,0,0,6,0,0,1,0,0,0,1.0,False
B2C1Dy0.2Ni2Tm0.8,3,0.0666666666666666,1.0,True,B2C1Dy0.2Ni2Tm0.8,B2C1Ni2Tm1,9.75,Other,True,B33.333C16.667Dy3.333Ni33.333Tm13.333,B-C-Dy-Ni-Tm,5,Supercon,Dy0.2Tm0.8Ni2B2C1,MP-mp-6754,Tm1Ni2B2C1,B-C-Ni-Tm,B33.333C16.667Ni33.333Tm16.667,I 4/m m m,tetragonal,3.4928639994202824,3.492863999420283,5.7937603300000005,data/final/MP/cifs/B2C1Dy0.2Ni2Tm0.8-MP-mp-6754-synth_doped.cif,data/source/MP/raw/cifs/mp-6754.cif,mp-6754,0.0,,2011-05-13 04:35:22,8.309262229712736,10.17188/1282688,"@misc{osti_1282688,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TmNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1282688"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696752'}},0.0,6.71149537,520.0,-41.76249282,-6.96041547,{'tags': []},-41.76249282,-6.96041547,-0.5234699658333332,"['xas', 'elasticity', 'bandstructure']",True,"[79577, 56652, 164574]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-6754,,TmNi2B2C,"{'functional': 'PBE', 'labels': ['Tm_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Tm': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6754,"['mp-6754', 'mp-1000684', 'mp-1007145', 'mp-1412917', 'mp-1696752', 'mp-1790753', 'mp-1011888', 'mp-1590290']",0.0028138,"{'Tm': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",63.94016944835002,[],NM,False,139,0,"[0.0, -0.0, -0.0, 0.0, 0.0, 0.0]",4.40067648283752e-05,0.0028138,0,0.0028138,MP,data/source/MP/cleaned/cifs/MP-mp-6754.cif,True,,data/final/MP/graphs/B2C1Dy0.2Ni2Tm0.8-MP-mp-6754-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ca1Cu1O2,1,0.0,1.0,True,Ca1Cu1O2,Ca1Cu1O2,0.0,Cuprate,True,Ca25Cu25O50,Ca-Cu-O,3,Supercon,Ca1Cu1O2,MP-mp-4826,Ca1Cu1O2,Ca-Cu-O,Ca25Cu25O50,P 4/m m m,tetragonal,3.209758,3.874978,3.874978,data/final/MP/cifs/Ca1Cu1O2-MP-mp-4826.cif,data/source/MP/raw/cifs/mp-4826.cif,mp-4826,0.0,,2016-01-04 14:41:26,4.672733703518964,10.17188/1208429,"@misc{osti_1208429,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CaCuO2 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208429"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1673419'}},0.0156029366666672,4.13949381,520.0,-23.13425142,-5.783562855,"{'tags': ['Calcium copper oxide', 'Calcium copper dioxide', 'Calcium cuprate']}",-23.13425142,-5.783562855,-2.1268807149999995,"['xas', 'elasticity', 'bandstructure']",True,"[75868, 86544, 93652]",True,2021-05-12 10:56:20.740000,NM,4,9,mp-4826,oxide,CaCuO2,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ca': 1.0, 'Cu': 1.0, 'O': 2.0}",GGA,mp-4826,"['mp-990138', 'mp-990171', 'mp-4826', 'mp-1140641', 'mp-1439582', 'mp-1673419', 'mp-1795363', 'mp-990181', 'mp-1588650']",0.0003672,"{'Ca': 1.0, 'Cu': 1.0, 'O': 2.0}",48.195975206564526,[],NM,False,123,0,"[0, 0, 0, 0]",7.618893453783368e-06,0.0003672,0,0.0003672,MP,data/source/MP/cleaned/cifs/MP-mp-4826.cif,False,,data/final/MP/graphs/Ca1Cu1O2-MP-mp-4826.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
C1Cu1Na0.15Sr1.85O5,2,0.0333333333333333,2.0,False,C2Cu2Na0.3Sr3.7O10,C2Cu2Sr4O10,0.0,Cuprate,True,C11.111Cu11.111Na1.667Sr20.556O55.55555555555556,C-Cu-Na-Sr-O,5,Supercon,Sr1.85Na0.15Cu1C1O5,MP-mp-1147662,Sr4Cu2C2O10,C-Cu-Sr-O,C11.111Cu11.111Sr22.222O55.55555555555556,I -4 2 m,tetragonal,5.556718,5.556718,8.631809904721473,data/final/MP/cifs/C1Cu1Na0.15Sr1.85O5-MP-mp-1147662-synth_doped.cif,data/source/MP/raw/cifs/mp-1147662.cif,mp-1147662,0.0,,2018-12-27 11:40:38.663000,4.629324765530757,,,,0.0444555886111093,3.36507303,520.0,-118.84575437,-6.602541909444444,{'tags': []},-118.84575437,-6.602541909444444,-2.3792330981481475,[],False,[],True,2021-05-12 10:59:37.456000,AFM,18,2,mp-1147662,oxide,Sr2CuCO5,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Cu_pv', 'C', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Cu': 1.0, 'C': 1.0, 'O': 5.0}",GGA,mp-1147662,"['mp-1147662', 'mp-1881214']",0.0031806,"{'Sr': 4.0, 'Cu': 2.0, 'C': 2.0, 'O': 10.0}",237.3114394242258,[],AFM,True,121,2,"[0.0, 0.0, 0.0, 0.0, 0.3, -0.3, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",2.6805281765741217e-05,0.0031806,2,0.0063612,MP,data/source/MP/cleaned/cifs/MP-mp-1147662.cif,True,,data/final/MP/graphs/C1Cu1Na0.15Sr1.85O5-MP-mp-1147662-synth_doped.json,0,True,-42m,0,0,0,0,6,0,0,0,0,1,0,1.0,False
Ce0.11Cu1La1.89O4,2,0.0314285714285714,1.0,True,Ce0.11Cu1La1.89O4,Cu1La2O4,27.1625,Cuprate,True,Ce1.571Cu14.286La27O57.142857142857146,Ce-Cu-La-O,4,Supercon,La1.89Ce0.11Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ce0.11Cu1La1.89O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ce0.11Cu1La1.89O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ta1Te2,1,0.0,9.0,False,Ta9Te18,Ta9Te18,0.0,Other,True,Ta33.333Te66.667,Ta-Te,2,Supercon,Ta1Te2,MP-mp-1967,Ta9Te18,Ta-Te,Ta33.333Te66.667,C 1 2/m 1,monoclinic,9.49552297,9.49552297,9.66882357,data/final/MP/cifs/Ta1Te2-MP-mp-1967.cif,data/source/MP/raw/cifs/mp-1967.cif,mp-1967,0.0,,2011-05-19 12:58:13,8.612117523908868,10.17188/1194879,"@misc{osti_1194879,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TaTe2 (SG:12) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1194879"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1743875'}},0.0,5.95446601,520.0,-173.09591378,-6.410959769629629,{'tags': []},-173.09591378,-6.410959769629629,-0.6441666062962962,"['xas', 'bandstructure']",True,[155326],True,2021-05-12 10:56:57.051000,NM,27,8,mp-1967,,TaTe2,"{'functional': 'PBE', 'labels': ['Ta_pv', 'Te'], 'pot_type': 'paw'}","{'Ta': 1.0, 'Te': 2.0}",GGA,mp-1967,"['mp-1001213', 'mp-1007588', 'mp-1967', 'mp-1442699', 'mp-1743875', 'mp-1876434', 'mp-1654482', 'mp-1012341']",8.863333333333334e-05,"{'Ta': 9.0, 'Te': 18.0}",756.8597762277694,[],NM,False,12,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.0539600928137317e-06,8.863333333333334e-05,0,0.0007977,MP,data/source/MP/cleaned/cifs/MP-mp-1967.cif,False,,data/final/MP/graphs/Ta1Te2-MP-mp-1967.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
Ga0.95Ge0.05Nb3,2,0.025,2.0,False,Ga1.9Ge0.1Nb6,Ga2Nb6,15.35,Other,True,Ga23.75Ge1.25Nb75,Ga-Ge-Nb,3,Supercon,Nb3Ga0.95Ge0.05,MP-mp-2670,Nb6Ga2,Ga-Nb,Ga25Nb75,P m -3 n,cubic,5.189021,5.189021,5.189021,data/final/MP/cifs/Ga0.95Ge0.05Nb3-MP-mp-2670-synth_doped.cif,data/source/MP/raw/cifs/mp-2670.cif,mp-2670,0.0,,2011-05-14 07:55:50,8.28234811962253,10.17188/1201220,"@misc{osti_1201220,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Ga (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201220"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686575'}},0.0550303606249986,4.96610647,520.0,-68.03986833,-8.50498354125,"{'tags': ['Gallium niobium (1/3)', 'Niobium gallide (3/1)']}",-68.03986833,-8.50498354125,-0.1719807556250003,"['xas', 'elasticity', 'bandstructure']",True,"[634772, 634745, 634746, 634774, 634731, 634748, 634762, 634767, 108484, 634734, 634761, 103831]",True,2021-05-12 10:56:18.721000,NM,8,9,mp-2670,,Nb3Ga,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Ga_d'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Ga': 1.0}",GGA,mp-2670,"['mp-928915', 'mp-912435', 'mp-929292', 'mp-2670', 'mp-1078851', 'mp-1440107', 'mp-1686575', 'mp-1781117', 'mp-1594502']",0.0001134,"{'Nb': 6.0, 'Ga': 2.0}",139.71926259628808,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.6232550600794926e-06,0.0001134,0,0.0002268,MP,data/source/MP/cleaned/cifs/MP-mp-2670.cif,True,,data/final/MP/graphs/Ga0.95Ge0.05Nb3-MP-mp-2670-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Cu0.99La2Li0.01O4,2,0.0028571428571428,1.0,True,Cu0.99La2Li0.01O4,Cu1La2O4,0.0,Cuprate,True,Cu14.143La28.571Li0.143O57.142857142857146,Cu-La-Li-O,4,Supercon,La2Cu0.99Li0.01O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu0.99La2Li0.01O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu0.99La2Li0.01O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ca0.17Cu1La1.83O4,3,0.0485714285714285,1.0,True,Ca0.17Cu1La1.83O4,Cu1La2O4,34.0,Cuprate,True,Ca2.429Cu14.286La26.143O57.142857142857146,Ca-Cu-La-O,4,Supercon,La1.83Ca0.17Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ca0.17Cu1La1.83O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ca0.17Cu1La1.83O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ce0.825Co1In5La0.175,3,0.05,1.0,True,Ce0.825Co1In5La0.175,Ce1Co1In5,0.0,Heavy_fermion,True,Ce11.786Co14.286In71.429La2.5,Ce-Co-In-La,4,Supercon,Ce0.825La0.175Co1In5,MP-mp-19961,Ce1In5Co1,Ce-Co-In,Ce14.286Co14.286In71.429,P 4/m m m,tetragonal,4.635989,4.635989,7.564124,data/final/MP/cifs/Ce0.825Co1In5La0.175-MP-mp-19961-synth_doped.cif,data/source/MP/raw/cifs/mp-19961.cif,mp-19961,0.0,,2014-02-21 14:08:25,7.897022127398995,10.17188/1195145,"@misc{osti_1195145,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeIn5Co (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195145"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701944'}},0.0,7.80626318,520.0,-28.52795357,-4.075421938571429,{'tags': ['Cerium cobalt indium (1/1/5)']},-28.52795357,-4.075421938571429,-0.2468754242857146,"['xas', 'bandstructure']",True,[102108],True,2021-05-12 10:56:57.051000,FM,7,8,mp-19961,,CeIn5Co,"{'functional': 'PBE', 'labels': ['Ce', 'In_d', 'Co'], 'pot_type': 'paw'}","{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",GGA,mp-19961,"['mp-928775', 'mp-912209', 'mp-928270', 'mp-19961', 'mp-1504062', 'mp-1701944', 'mp-1785253', 'mp-1593180']",0.9310323,"{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",162.57113333428427,[],FM,True,123,1,"[0.7, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0057269226147644,0.9310323,1,0.9310323,MP,data/source/MP/cleaned/cifs/MP-mp-19961.cif,True,,data/final/MP/graphs/Ce0.825Co1In5La0.175-MP-mp-19961-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ba0.158Cu1La1.842O4,3,0.0451428571428571,1.0,True,Ba0.158Cu1La1.842O4,Cu1La2O4,0.0,Cuprate,True,Ba2.257Cu14.286La26.314O57.142857142857146,Ba-Cu-La-O,4,Supercon,La1.842Ba0.158Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ba0.158Cu1La1.842O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ba0.158Cu1La1.842O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Pd49.75Sb50V0.25,3,0.005,0.04,False,Pd1.99Sb2V0.01,Pd2Sb2,1.13,Other,True,Pd49.75Sb50V0.25,Pd-Sb-V,3,Supercon,Pd49.75V0.25Sb50,MP-mp-1769,Sb2Pd2,Pd-Sb,Pd50Sb50,P 63/m m c,hexagonal,4.14379200150878,4.14379188,5.681682,data/final/MP/cifs/Pd49.75Sb50V0.25-MP-mp-1769-synth_doped.cif,data/source/MP/raw/cifs/mp-1769.cif,mp-1769,0.0,,2011-05-12 20:23:42,8.969190247481327,10.17188/1192632,"@misc{osti_1192632,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SbPd (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1192632"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672236'}},0.0,7.23050119,520.0,-20.38401466,-5.096003665,"{'tags': ['Palladium antimony (1/1)', 'Sudburyite', 'Palladium antimony', 'Palladium antimonide (1/1)']}",-20.38401466,-5.096003665,-0.5375621399999995,"['xas', 'elasticity', 'bandstructure']",True,"[648770, 42598, 648779, 42597]",True,2021-05-12 10:56:14.760000,NM,4,8,mp-1769,,SbPd,"{'functional': 'PBE', 'labels': ['Sb', 'Pd'], 'pot_type': 'paw'}","{'Sb': 1.0, 'Pd': 1.0}",GGA,mp-1769,"['mp-924880', 'mp-925511', 'mp-909858', 'mp-1769', 'mp-1439686', 'mp-1672236', 'mp-1802229', 'mp-1586197']",0.0044707,"{'Sb': 2.0, 'Pd': 2.0}",84.4896347968957,[],NM,False,194,0,"[0, 0, 0, 0]",0.0001058283660651,0.0044707,0,0.0089414,MP,data/source/MP/cleaned/cifs/MP-mp-1769.cif,True,,data/final/MP/graphs/Pd49.75Sb50V0.25-MP-mp-1769-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ru0.47V0.53,3,0.06,2.0,False,Ru0.94V1.06,Ru1V1,4.53,Other,True,Ru47V53,Ru-V,2,Supercon,Ru0.47V0.53,MP-mp-1395,V1Ru1,Ru-V,Ru50V50,P m -3 m,cubic,3.014694,3.014694,3.014694,data/final/MP/cifs/Ru0.47V0.53-MP-mp-1395-synth_doped.cif,data/source/MP/raw/cifs/mp-1395.cif,mp-1395,0.0,,2011-05-12 19:37:14,9.21288886283982,10.17188/1189837,"@misc{osti_1189837,
    author = ""Persson, Kristin"",
    title = ""Materials Data on VRu (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189837"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688485'}},0.0,7.72767567,520.0,-18.82570789,-9.412853945,"{'tags': ['Ruthenium vanadium (1/1)', 'Ruthenium vanadium (1/1) - HT']}",-18.82570789,-9.412853945,-0.2337060825000012,"['xas', 'elasticity', 'bandstructure']",True,"[106010, 106011]",True,2021-05-12 10:56:12.755000,FiM,2,17,mp-1395,,VRu,"{'functional': 'PBE', 'labels': ['V_pv', 'Ru_pv'], 'pot_type': 'paw'}","{'V': 1.0, 'Ru': 1.0}",GGA,mp-1395,"['mp-991544', 'mp-993492', 'mp-2829', 'mp-1395', 'mp-1059722', 'mp-1059669', 'mp-1059766', 'mp-1059703', 'mp-1059619', 'mp-1059801', 'mp-1442257', 'mp-1688485', 'mp-1792970', 'mp-994797', 'mp-1591529', 'mp-1059798', 'mp-1059699']",0.647887,"{'V': 1.0, 'Ru': 1.0}",27.39868439535897,[],FiM,True,221,2,"[0.7, -0.1]",0.023646646337141,0.647887,2,0.647887,MP,data/source/MP/cleaned/cifs/MP-mp-1395.cif,True,,data/final/MP/graphs/Ru0.47V0.53-MP-mp-1395-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ga20.5V79.5,3,0.09,0.08,False,Ga1.64V6.36,Ga2V6,9.7,Other,True,Ga20.5V79.5,Ga-V,2,Supercon,Ga20.5V79.5,MP-mp-22568,V6Ga2,Ga-V,Ga25V75,P m -3 n,cubic,4.789645,4.789645,4.789645,data/final/MP/cifs/Ga20.5V79.5-MP-mp-22568-synth_doped.cif,data/source/MP/raw/cifs/mp-22568.cif,mp-22568,0.0,,2014-02-22 11:36:40,6.726541666276222,10.17188/1198793,"@misc{osti_1198793,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Ga (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198793"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686867'}},0.0,5.67452231,520.0,-61.95244347,-7.74405543375,{'tags': ['Gallium vanadium (1/3)']},-61.95244347,-7.74405543375,-0.1741018756249994,"['xas', 'elasticity', 'bandstructure']",True,"[635643, 635628, 635619, 635634, 104021, 635646, 635604, 635610, 635617, 635624, 635626, 635605, 635631, 635625, 635636, 635603, 104020, 635616, 635607]",True,2021-05-12 10:56:16.728000,FM,8,9,mp-22568,,V3Ga,"{'functional': 'PBE', 'labels': ['V_pv', 'Ga_d'], 'pot_type': 'paw'}","{'V': 3.0, 'Ga': 1.0}",GGA,mp-22568,"['mp-941343', 'mp-941663', 'mp-934924', 'mp-22568', 'mp-1440749', 'mp-1686867', 'mp-1804076', 'mp-1593784', 'mp-1595713']",0.09063635,"{'V': 6.0, 'Ga': 2.0}",109.87780534443452,[],FM,True,131,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.0, -0.0, -0.0]",0.0016497662965852,0.09063635,2,0.1812727,MP,data/source/MP/cleaned/cifs/MP-mp-22568.cif,True,,data/final/MP/graphs/Ga20.5V79.5-MP-mp-22568-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
B4Ru4U1,1,0.0,4.0,False,B16Ru16U4,B16Ru16U4,0.0,Heavy_fermion,True,B44.444Ru44.444U11.111,B-Ru-U,3,Supercon,U1Ru4B4,MP-mp-15355,U4B16Ru16,B-Ru-U,B44.444Ru44.444U11.111,I 41/a c d,tetragonal,7.476233997091541,7.476233997091541,9.19614569,data/final/MP/cifs/B4Ru4U1-MP-mp-15355.cif,data/source/MP/raw/cifs/mp-15355.cif,mp-15355,0.0,,2011-08-10 17:13:16,10.82658449228261,10.17188/1191140,"@misc{osti_1191140,
    author = ""Persson, Kristin"",
    title = ""Materials Data on U(BRu)4 (SG:142) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191140"",
    place = ""United States"",
    year = ""2015"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1753658'}},0.0,9.51188867,520.0,-315.67228407,-8.768674557499999,"{'tags': ['Uranium tetraruthenium tetraboride', 'Uranium ruthenium boride (1/4/4)']}",-315.67228407,-8.768674557499999,-0.4235039226851853,"['xas', 'bandstructure']",True,"[100718, 657090]",True,2021-05-12 10:56:53.126000,FM,36,8,mp-15355,,U(BRu)4,"{'functional': 'PBE', 'labels': ['U', 'B', 'Ru_pv'], 'pot_type': 'paw'}","{'U': 1.0, 'B': 4.0, 'Ru': 4.0}",GGA,mp-15355,"['mp-916863', 'mp-939987', 'mp-937485', 'mp-15355', 'mp-1205106', 'mp-1397702', 'mp-1753658', 'mp-1814860']",0.9771639,"{'U': 4.0, 'B': 16.0, 'Ru': 16.0}",420.58966614550593,[],FM,True,22,1,"[1.2, 0.0, 1.3, 1.3, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0092932754050304,0.9771639,3,3.9086556,MP,data/source/MP/cleaned/cifs/MP-mp-15355.cif,False,,data/final/MP/graphs/B4Ru4U1-MP-mp-15355.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B0.039C0.961Si1,2,0.039,1.0,True,B0.039C0.961Si1,C1Si1,1.4,Other,True,B1.95C48.05Si50,B-C-Si,3,Supercon,B0.039C0.961Si1,MP-mp-8062,Si1C1,C-Si,C50Si50,F -4 3 m,cubic,3.09681657,3.09681657,3.09681657,data/final/MP/cifs/B0.039C0.961Si1-MP-mp-8062-synth_doped.cif,data/source/MP/raw/cifs/mp-8062.cif,mp-8062,1.5936000000000003,,2011-05-27 17:01:47,3.170449665845912,10.17188/1282015,"@misc{osti_1282015,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SiC (SG:216) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1282015"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686898'}},0.0011095605000006,7.94044828,520.0,-15.0593168,-7.5296584,"{'tags': ['Silicon carbide - 3.13% Cr-doped', 'Silicon carbide (1/1)', 'Silicon carbide - ZB-type', 'Moissanite 3C', 'Silicon carbide - 3C', 'Silicon carbide']}",-15.0593168,-7.5296584,-0.2036110399999993,"['piezo', 'xas', 'bandstructure', 'diel', 'phonons', 'elasticity']",True,"[618779, 24217, 182361, 164975, 28389, 603798, 181128, 164973, 164974, 28895]",True,2021-05-12 10:56:31.128000,NM,2,18,mp-8062,,SiC,"{'functional': 'PBE', 'labels': ['Si', 'C'], 'pot_type': 'paw'}","{'Si': 1.0, 'C': 1.0}",GGA,mp-8062,"['mp-654784', 'mp-8062', 'mp-655663', 'mp-656232', 'mp-1057248', 'mp-1057252', 'mp-1057256', 'mp-1138724', 'mp-1140991', 'mp-1146095', 'mp-1119872', 'mp-1263783', 'mp-1440786', 'mp-1686898', 'mp-1792766', 'mp-1594629', 'mp-1592761', 'mp-1057260']",0.0014896,"{'Si': 1.0, 'C': 1.0}",21.0005877839547,[],NM,False,216,0,"[0, 0]",7.093134798532234e-05,0.0014896,0,0.0014896,MP,data/source/MP/cleaned/cifs/MP-mp-8062.cif,True,,data/final/MP/graphs/B0.039C0.961Si1-MP-mp-8062-synth_doped.json,0,True,-43m,5,0,0,0,0,0,0,0,0,0,1,1.0,False
Ba0.5Bi1K0.5O3,3,0.0666666666666666,3.0,False,Ba1.5Bi3K1.5O9,Ba2Bi3K1O9,19.66428571,Oxide,True,Ba10Bi20K10O60,Ba-Bi-K-O,4,Supercon,Ba0.5K0.5Bi1O3,MP-mp-1223518,K1Ba2Bi3O9,Ba-Bi-K-O,Ba13.333Bi20K6.667O60,P -3 m 1,trigonal,6.18756400330999,6.187564340000001,7.581401,data/final/MP/cifs/Ba0.5Bi1K0.5O3-MP-mp-1223518-synth_doped.cif,data/source/MP/raw/cifs/mp-1223518.cif,mp-1223518,0.0,,2019-01-12 23:54:06.965000,7.16530091201999,,,{'GGA': {'task_id': 'mp-1729135'}},0.001551682833333,3.46143017,520.0,-85.22271396,-5.681514264,{'tags': []},-85.22271396,-5.681514264,-2.0170414252000004,[],False,[],True,2021-05-12 11:00:52.054000,NM,15,4,mp-1223518,oxide,KBa2(BiO3)3,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Bi', 'O'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 2.0, 'Bi': 3.0, 'O': 9.0}",GGA,mp-1223518,"['mp-1223518', 'mp-1391182', 'mp-1729135', 'mp-1775199']",4.99e-05,"{'K': 1.0, 'Ba': 2.0, 'Bi': 3.0, 'O': 9.0}",251.37352739849624,[],NM,False,164,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.9850936777799505e-07,4.99e-05,0,4.99e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1223518.cif,True,,data/final/MP/graphs/Ba0.5Bi1K0.5O3-MP-mp-1223518-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
K1Nb0.008Ta0.992O3,2,0.0032,1.0,True,K1Nb0.008Ta0.992O3,K1Ta1O3,0.0,Oxide,True,K20Nb0.16Ta19.84O60,K-Nb-Ta-O,4,Supercon,K1Ta0.992Nb0.008O3,MP-mp-3614,K1Ta1O3,K-Ta-O,K20Ta20O60,P m -3 m,cubic,4.030839,4.030839,4.030839,data/final/MP/cifs/K1Nb0.008Ta0.992O3-MP-mp-3614-synth_doped.cif,data/source/MP/raw/cifs/mp-3614.cif,mp-3614,2.1532,,2011-05-12 22:13:37,6.796251592212529,10.17188/1207137,"@misc{osti_1207137,
    author = ""Persson, Kristin"",
    title = ""Materials Data on KTaO3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207137"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686512'}},0.0,1.55797225,520.0,-41.13911957,-8.227823914,{'tags': ['Potassium tantalate']},-41.13911957,-8.227823914,-3.0776119956000003,"['xas', 'bandstructure', 'diel', 'phonons', 'elasticity']",True,"[39673, 184922, 56439, 181838, 56440, 39905, 280424]",True,2021-05-12 10:56:20.740000,NM,5,17,mp-3614,oxide,KTaO3,"{'functional': 'PBE', 'labels': ['K_sv', 'Ta_pv', 'O'], 'pot_type': 'paw'}","{'K': 1.0, 'Ta': 1.0, 'O': 3.0}",GGA,mp-3614,"['mp-664976', 'mp-669248', 'mp-3614', 'mp-1068712', 'mp-1068716', 'mp-1068728', 'mp-1076849', 'mp-1076850', 'mp-1076851', 'mp-1140169', 'mp-1440109', 'mp-1686512', 'mp-1782459', 'mp-1597006', 'mp-1068733', 'mp-1076852', 'mp-691387']",8.85e-05,"{'K': 1.0, 'Ta': 1.0, 'O': 3.0}",65.49171385629549,[],NM,False,221,0,"[0, 0, 0, 0, 0]",1.351315987762821e-06,8.85e-05,0,8.85e-05,MP,data/source/MP/cleaned/cifs/MP-mp-3614.cif,True,,data/final/MP/graphs/K1Nb0.008Ta0.992O3-MP-mp-3614-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ce0.25Cu1Pr1.75O4,3,0.0714285714285714,1.0,True,Ce0.25Cu1Pr1.75O4,Cu1Pr2O4,0.0,Cuprate,True,Ce3.571Cu14.286Pr25O57.142857142857146,Ce-Cu-Pr-O,4,Supercon,Pr1.75Ce0.25Cu1O4,MP-mp-4181,Pr2Cu1O4,Cu-Pr-O,Cu14.286Pr28.571O57.142857142857146,I 4/m m m,tetragonal,3.995734002478021,3.995734002478021,6.85109716,data/final/MP/cifs/Ce0.25Cu1Pr1.75O4-MP-mp-4181-synth_doped.cif,data/source/MP/raw/cifs/mp-4181.cif,mp-4181,0.0,,2011-05-13 10:21:01,6.821515862307185,10.17188/1207928,"@misc{osti_1207928,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Pr2CuO4 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207928"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-669887'}},0.0,3.15418113,520.0,-51.2919541,-7.327422014285714,"{'tags': ['Dipraseodymium cuprate', 'Dipraseodymium copper oxide', 'Praseodymium cuprate', 'Dipraseodymium copper tetraoxide']}",-51.2919541,-7.327422014285714,-2.9410150171428566,"['xas', 'elasticity', 'bandstructure']",True,"[91071, 261374, 71180, 186589, 185267, 185268, 65925, 65924, 191813, 261373, 202884, 72241]",True,2021-05-12 10:56:20.740000,NM,7,12,mp-4181,oxide,Pr2CuO4,"{'functional': 'PBE', 'labels': ['Pr_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Pr': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-4181,"['mp-669887', 'mp-660138', 'mp-4181', 'mp-1077961', 'mp-1077976', 'mp-1077987', 'mp-1078042', 'mp-1442060', 'mp-1687781', 'mp-1797293', 'mp-1589370', 'mp-688743']",0.0084498,"{'Pr': 2.0, 'Cu': 1.0, 'O': 4.0}",99.64888441679796,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",8.479573102552068e-05,0.0084498,0,0.0084498,MP,data/source/MP/cleaned/cifs/MP-mp-4181.cif,True,,data/final/MP/graphs/Ce0.25Cu1Pr1.75O4-MP-mp-4181-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
U1,1,0.0,2.0,False,U2,U2,0.581666667,Heavy_fermion,True,U100,U,1,Supercon,U1,MP-mp-44,U2,U,U100,C m c m,orthorhombic,2.8086280012982923,3.2210211,4.909646,data/final/MP/cifs/U1-MP-mp-44.cif,data/source/MP/raw/cifs/mp-44.cif,mp-44,0.0,,2011-05-12 20:18:04,19.776541402477005,10.17188/1208125,"@misc{osti_1208125,
    author = ""Persson, Kristin"",
    title = ""Materials Data on U (SG:63) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208125"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686787'}},0.0,15.0930719,520.0,-22.58282002,-11.29141001,"{'tags': ['Uranium - alpha', 'Uranium']}",-22.58282002,-11.29141001,0.0,"['eos', 'elasticity', 'bandstructure', 'xas']",True,"[16057, 106205, 43341, 16056, 43339, 653370, 44475, 653381, 182486, 248402, 160449, 653373, 168169, 43340, 654164, 43419, 653376, 16058, 653368, 173998, 106204]",True,2021-05-12 10:56:20.740000,NM,2,18,mp-44,,U,"{'functional': 'PBE', 'labels': ['U'], 'pot_type': 'paw'}",{'U': 1.0},GGA,mp-44,"['mp-906099', 'mp-918946', 'mp-919949', 'mp-44', 'mp-1058584', 'mp-1058822', 'mp-1059388', 'mp-1059105', 'mp-1059588', 'mp-1059937', 'mp-1076911', 'mp-1440819', 'mp-1686787', 'mp-1795422', 'mp-1594309', 'mp-1594827', 'mp-1059672', 'mp-1058888']",0.00011055,{'U': 2.0},39.97223740908606,[],NM,False,63,0,"[0, 0]",5.531339107621279e-06,0.00011055,0,0.0002211,MP,data/source/MP/cleaned/cifs/MP-mp-44.cif,False,,data/final/MP/graphs/U1-MP-mp-44.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Nb1S1,1,0.0,2.0,False,Nb2S2,Nb2S2,0.0,Other,True,Nb50S50,Nb-S,2,Supercon,Nb1S1,MP-mp-647,Nb2S2,Nb-S,Nb50S50,P 63/m m c,hexagonal,3.310030002498044,3.31003081,6.669122,data/final/MP/cifs/Nb1S1-MP-mp-647.cif,data/source/MP/raw/cifs/mp-647.cif,mp-647,0.0,,2011-05-12 21:02:34,6.558829836098991,10.17188/1280662,"@misc{osti_1280662,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbS (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1280662"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678635'}},0.0657296840548777,8.21815925,520.0,-32.08134983,-8.0203374575,"{'tags': ['Niobium sulfide (1/1)', 'Niobium(II) sulfide']}",-32.08134983,-8.0203374575,-1.1529600040625,"['xas', 'elasticity', 'bandstructure']",True,"[44992, 645304]",True,2021-05-12 10:56:27.046000,NM,4,8,mp-647,,NbS,"{'functional': 'PBE', 'labels': ['Nb_pv', 'S'], 'pot_type': 'paw'}","{'Nb': 1.0, 'S': 1.0}",GGA,mp-647,"['mp-647', 'mp-910183', 'mp-926092', 'mp-925613', 'mp-1437777', 'mp-1678635', 'mp-1783821', 'mp-1593108']",1.855e-05,"{'Nb': 2.0, 'S': 2.0}",63.27953732074284,[],NM,False,194,0,"[0, 0, 0, 0]",5.862874725513951e-07,1.855e-05,0,3.71e-05,MP,data/source/MP/cleaned/cifs/MP-mp-647.cif,False,,data/final/MP/graphs/Nb1S1-MP-mp-647.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
C1Nb0.8W0.2,1,0.0,5.0,False,C5Nb4W1,C5Nb4W1,13.2,Other,True,C50Nb40W10,C-Nb-W,3,Supercon,Nb0.8W0.2C1,MP-mp-1220459,Nb4W1C5,C-Nb-W,C50Nb40W10,R -3 m,trigonal,3.1614416712151847,3.1614416712151847,13.0722524,data/final/MP/cifs/C1Nb0.8W0.2-MP-mp-1220459.cif,data/source/MP/raw/cifs/mp-1220459.cif,mp-1220459,0.0,,2019-01-12 21:18:09.325000,9.122512662938584,,,{'GGA': {'task_id': 'mp-1752906'}},0.1091400146666661,7.81841146,520.0,-102.65112705,-10.265112705,{'tags': []},-102.65112705,-10.265112705,-0.3153876920000001,[],False,[],True,2021-05-12 11:00:44.908000,NM,10,4,mp-1220459,,Nb4WC5,"{'functional': 'PBE', 'labels': ['Nb_pv', 'W_pv', 'C'], 'pot_type': 'paw'}","{'Nb': 4.0, 'W': 1.0, 'C': 5.0}",GGA,mp-1220459,"['mp-1220459', 'mp-1404451', 'mp-1752906', 'mp-1805570']",0.0003397,"{'Nb': 4.0, 'W': 1.0, 'C': 5.0}",112.04077393038176,[],NM,False,166,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.031931930522702e-06,0.0003397,0,0.0003397,MP,data/source/MP/cleaned/cifs/MP-mp-1220459.cif,False,,data/final/MP/graphs/C1Nb0.8W0.2-MP-mp-1220459.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
B2Er0.2Lu0.8Ru1,3,0.0999999999999999,4.0,False,B8Er0.8Lu3.2Ru4,B8Lu4Ru4,7.85,Other,True,B50Er5Lu20Ru25,B-Er-Lu-Ru,4,Supercon,Lu0.8Er0.2Ru1B2,MP-mp-29239,Lu4B8Ru4,B-Lu-Ru,B50Lu25Ru25,P n m a,orthorhombic,5.262881,5.829858,6.288542,data/final/MP/cifs/B2Er0.2Lu0.8Ru1-MP-mp-29239-synth_doped.cif,data/source/MP/raw/cifs/mp-29239.cif,mp-29239,0.0,,2014-02-24 06:45:28,10.246997128776938,10.17188/1203618,"@misc{osti_1203618,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LuB2Ru (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1203618"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677301'}},0.0,6.02142224,520.0,-119.30016105,-7.456260065625,"{'tags': ['Lutetium ruthenium(III) boride', 'Lutetium ruthenium boride (1/1/2)']}",-119.30016105,-7.456260065625,-0.6677291364583331,"['xas', 'bandstructure']",True,"[614715, 100774]",True,2021-05-12 10:57:03.017000,NM,16,8,mp-29239,,LuB2Ru,"{'functional': 'PBE', 'labels': ['Lu_3', 'B', 'Ru_pv'], 'pot_type': 'paw'}","{'Lu': 1.0, 'B': 2.0, 'Ru': 1.0}",GGA,mp-29239,"['mp-909473', 'mp-925177', 'mp-924466', 'mp-29239', 'mp-1381674', 'mp-1677301', 'mp-1784701', 'mp-1603819']",4.565e-05,"{'Lu': 4.0, 'B': 8.0, 'Ru': 4.0}",192.9440954509509,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",9.4638812124945e-07,4.565e-05,0,0.0001826,MP,data/source/MP/cleaned/cifs/MP-mp-29239.cif,True,,data/final/MP/graphs/B2Er0.2Lu0.8Ru1-MP-mp-29239-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ba2Cu3S1Y1O6,1,0.0,1.0,True,Ba2Cu3S1Y1O6,Ba2Cu3S1Y1O6,89.5,Cuprate,True,Ba15.385Cu23.077S7.692Y7.692O46.15384615384615,Ba-Cu-S-Y-O,5,Supercon,Y1Ba2Cu3S1O6,MP-mp-1214650,Ba2Y1Cu3S1O6,Ba-Cu-S-Y-O,Ba15.385Cu23.077S7.692Y7.692O46.15384615384615,P m m m,orthorhombic,3.797492,4.171633,12.117872,data/final/MP/cifs/Ba2Cu3S1Y1O6-MP-mp-1214650.cif,data/source/MP/raw/cifs/mp-1214650.cif,mp-1214650,0.0,,2019-01-12 16:27:28.931000,5.901592346718841,,,{'GGA': {'task_id': 'mp-1736928'}},0.3753510333653835,3.50922769,520.0,-77.77924098,-5.983018536923077,"{'tags': ['Ba2Cu3YO7', 'high-Tc cuprate family', 'Ba2Cu3YSO6 m']}",-77.77924098,-5.983018536923077,-1.9983070999839745,[],False,[],True,2021-05-12 11:00:37.845000,NM,13,5,mp-1214650,oxide,Ba2YCu3SO6,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Cu_pv', 'S', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Cu': 3.0, 'S': 1.0, 'O': 6.0}",GGA,mp-1214650,"['mp-1214650', 'mp-1238612', 'mp-1385121', 'mp-1736928', 'mp-1830460']",0.3974072,"{'Ba': 2.0, 'Y': 1.0, 'Cu': 3.0, 'S': 1.0, 'O': 6.0}",191.96821325757853,[],NM,False,47,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0020701718959417,0.3974072,0,0.3974072,MP,data/source/MP/cleaned/cifs/MP-mp-1214650.cif,False,,data/final/MP/graphs/Ba2Cu3S1Y1O6-MP-mp-1214650.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Pd5Th3,3,0.1071428571428571,1.6,False,Pd8Th4.8,Pd8Th6,0.0,Other,True,Pd62.5Th37.5,Pd-Th,2,Supercon,Pd5Th3,MP-mp-1105083,Th6Pd8,Pd-Th,Pd57.143Th42.857,R -3,trigonal,5.841680665658298,8.2243769,8.2243769,data/final/MP/cifs/Pd5Th3-MP-mp-1105083-synth_doped.cif,data/source/MP/raw/cifs/mp-1105083.cif,mp-1105083,0.0,,2018-07-19 01:00:46,11.533786651550937,,,{'GGA': {'task_id': 'mp-1669360'}},0.0,6.82164488,520.0,-97.45048242,-6.9607487442857146,{'tags': ['Thorium palladium (3/4)']},-97.45048242,-6.9607487442857146,-0.8234484599999996,['bandstructure'],True,[649031],True,2021-05-12 10:58:20.361000,NM,14,5,mp-1105083,,Th3Pd4,"{'functional': 'PBE', 'labels': ['Th', 'Pd'], 'pot_type': 'paw'}","{'Th': 3.0, 'Pd': 4.0}",GGA,mp-1105083,"['mp-1105083', 'mp-1427429', 'mp-1669360', 'mp-1813227', 'mp-1599501']",0.00028965,"{'Th': 6.0, 'Pd': 8.0}",323.0132682095391,[],NM,False,148,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.7934247816229252e-06,0.00028965,0,0.0005793,MP,data/source/MP/cleaned/cifs/MP-mp-1105083.cif,True,,data/final/MP/graphs/Pd5Th3-MP-mp-1105083-synth_doped.json,0,True,-3,0,0,0,0,0,0,2,1,0,0,0,1.0,False
Ga0.3Nb0.7,3,0.1,8.0,False,Ga2.4Nb5.6,Ga2Nb6,16.3,Other,True,Ga30Nb70,Ga-Nb,2,Supercon,Ga0.3Nb0.7,MP-mp-2670,Nb6Ga2,Ga-Nb,Ga25Nb75,P m -3 n,cubic,5.189021,5.189021,5.189021,data/final/MP/cifs/Ga0.3Nb0.7-MP-mp-2670-synth_doped.cif,data/source/MP/raw/cifs/mp-2670.cif,mp-2670,0.0,,2011-05-14 07:55:50,8.28234811962253,10.17188/1201220,"@misc{osti_1201220,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Ga (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201220"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686575'}},0.0550303606249986,4.96610647,520.0,-68.03986833,-8.50498354125,"{'tags': ['Gallium niobium (1/3)', 'Niobium gallide (3/1)']}",-68.03986833,-8.50498354125,-0.1719807556250003,"['xas', 'elasticity', 'bandstructure']",True,"[634772, 634745, 634746, 634774, 634731, 634748, 634762, 634767, 108484, 634734, 634761, 103831]",True,2021-05-12 10:56:18.721000,NM,8,9,mp-2670,,Nb3Ga,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Ga_d'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Ga': 1.0}",GGA,mp-2670,"['mp-928915', 'mp-912435', 'mp-929292', 'mp-2670', 'mp-1078851', 'mp-1440107', 'mp-1686575', 'mp-1781117', 'mp-1594502']",0.0001134,"{'Nb': 6.0, 'Ga': 2.0}",139.71926259628808,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.6232550600794926e-06,0.0001134,0,0.0002268,MP,data/source/MP/cleaned/cifs/MP-mp-2670.cif,True,,data/final/MP/graphs/Ga0.3Nb0.7-MP-mp-2670-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Cu1La2O4.066,2,0.0080061461323844,0.9839226102639778,True,Cu0.984La1.968O4,Cu1La2O4,38.0,Cuprate,True,Cu14.152La28.305O57.543164449476365,Cu-La-O,3,Supercon,La2Cu1O4.066,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La2O4.066-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La2O4.066-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ba2Ca1Cu1.98Fe0.02Tl2O8,2,0.0026666666666666,1.0,True,Ba2Ca1Cu1.98Fe0.02Tl2O8,Ba2Ca1Cu2Tl2O8,106.0,Cuprate,True,Ba13.333Ca6.667Cu13.2Fe0.133Tl13.333O53.333333333333336,Ba-Ca-Cu-Fe-Tl-O,6,Supercon,Tl2Ba2Ca1Cu1.98Fe0.02O8,MP-mp-6885,Ba2Ca1Tl2Cu2O8,Ba-Ca-Cu-Tl-O,Ba13.333Ca6.667Cu13.333Tl13.333O53.333333333333336,I 4/m m m,tetragonal,3.8887880015527454,3.8887880015527454,15.44888372,data/final/MP/cifs/Ba2Ca1Cu1.98Fe0.02Tl2O8-MP-mp-6885-synth_doped.cif,data/source/MP/raw/cifs/mp-6885.cif,mp-6885,0.0,,2011-05-16 00:12:29,7.06827160481344,10.17188/1284435,"@misc{osti_1284435,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2CaTl2(CuO4)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1284435"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1676611'}},0.0059098983148224,4.22920004,520.0,-81.10596699,-5.407064466,"{'tags': ['Dithallium(III) dibarium calcium dicopper oxide', 'Dithallium dibarium calcium dicopper oxide']}",-81.10596699,-5.407064466,-1.8834025184444445,"['xas', 'bandstructure']",True,"[78592, 78593, 65554]",True,2021-05-12 10:57:38.495000,NM,15,8,mp-6885,oxide,Ba2CaTl2(CuO4)2,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ca_sv', 'Tl_d', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Ca': 1.0, 'Tl': 2.0, 'Cu': 2.0, 'O': 8.0}",GGA,mp-6885,"['mp-6885', 'mp-556042', 'mvc-16338', 'mp-1423335', 'mp-1676611', 'mp-1777344', 'mp-1931767', 'mp-1607471']",0.0018692,"{'Ba': 2.0, 'Ca': 1.0, 'Tl': 2.0, 'Cu': 2.0, 'O': 8.0}",229.8977800758837,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",8.130570027179132e-06,0.0018692,0,0.0018692,MP,data/source/MP/cleaned/cifs/MP-mp-6885.cif,True,,data/final/MP/graphs/Ba2Ca1Cu1.98Fe0.02Tl2O8-MP-mp-6885-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ce1Pt1Si2,1,0.0,2.0,False,Ce2Pt2Si4,Ce2Pt2Si4,0.14,Heavy_fermion,True,Ce25Pt25Si50,Ce-Pt-Si,3,Supercon,Ce1Pt1Si2,MP-mp-3284,Ce2Si4Pt2,Ce-Pt-Si,Ce25Pt25Si50,C m c m,orthorhombic,4.247021,4.269302000624754,8.59967238,data/final/MP/cifs/Ce1Pt1Si2-MP-mp-3284.cif,data/source/MP/raw/cifs/mp-3284.cif,mp-3284,0.0,,2011-05-13 09:34:49,8.605064498996002,10.17188/1206417,"@misc{osti_1206417,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeSi2Pt (SG:63) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1206417"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672161'}},0.0,8.39100711,520.0,-53.69743659,-6.71217957375,{'tags': ['Cerium platinum silicide (1/1/2)']},-53.69743659,-6.71217957375,-0.9630233475,"['xas', 'bandstructure']",True,"[106420, 603067, 246169]",True,2021-05-12 10:57:06.958000,NM,8,9,mp-3284,,CeSi2Pt,"{'functional': 'PBE', 'labels': ['Ce', 'Si', 'Pt'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Si': 2.0, 'Pt': 1.0}",GGA,mp-3284,"['mp-920329', 'mp-921349', 'mp-906660', 'mp-3284', 'mp-1144512', 'mp-1301081', 'mp-1672161', 'mp-1865182', 'mp-1592616']",0.0015469,"{'Ce': 2.0, 'Si': 4.0, 'Pt': 2.0}",151.04752209820953,[],NM,False,63,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",2.048229561811973e-05,0.0015469,0,0.0030938,MP,data/source/MP/cleaned/cifs/MP-mp-3284.cif,False,,data/final/MP/graphs/Ce1Pt1Si2-MP-mp-3284.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Be12W1,1,0.0,1.0,True,Be12W1,Be12W1,0.0,Other,True,Be92.308W7.692,Be-W,2,Supercon,Be12W1,MP-mp-568827,Be12W1,Be-W,Be92.308W7.692,I 4/m m m,tetragonal,4.19607800048678,5.513410630939341,5.51341063,data/final/MP/cifs/Be12W1-MP-mp-568827.cif,data/source/MP/raw/cifs/mp-568827.cif,mp-568827,0.0,,2014-02-24 18:47:45,4.444905200504028,10.17188/1274716,"@misc{osti_1274716,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Be12W (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1274716"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700746'}},0.0,5.11884662,520.0,-59.18454541,-4.552657339230769,{'tags': ['Beryllium tungsten (12/1)']},-59.18454541,-4.552657339230769,-0.1041126584615389,"['xas', 'elasticity', 'bandstructure']",True,"[616498, 109316]",True,2021-05-12 10:56:22.739000,NM,13,8,mp-568827,,Be12W,"{'functional': 'PBE', 'labels': ['Be_sv', 'W_pv'], 'pot_type': 'paw'}","{'Be': 12.0, 'W': 1.0}",GGA,mp-568827,"['mp-568827', 'mp-930197', 'mp-929688', 'mp-913146', 'mp-1424031', 'mp-1700746', 'mp-1803056', 'mp-1602553']",0.0038083,"{'Be': 12.0, 'W': 1.0}",109.08094628980524,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0]",3.49126050839543e-05,0.0038083,0,0.0038083,MP,data/source/MP/cleaned/cifs/MP-mp-568827.cif,False,,data/final/MP/graphs/Be12W1-MP-mp-568827.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ba0.01Cu1La1.99O4,2,0.0028571428571428,1.0,True,Ba0.01Cu1La1.99O4,Cu1La2O4,0.0,Cuprate,True,Ba0.143Cu14.286La28.429O57.142857142857146,Ba-Cu-La-O,4,Supercon,La1.99Ba0.01Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ba0.01Cu1La1.99O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ba0.01Cu1La1.99O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As2Fe1.78Ni0.22Sr1,3,0.088,1.0,True,As2Fe1.78Ni0.22Sr1,As2Fe2Sr1,2.305,Ferrite,True,As40Fe35.6Ni4.4Sr20,As-Fe-Ni-Sr,4,Supercon,Sr1Fe1.78Ni0.22As2,MP-mp-4488,Sr1Fe2As2,As-Fe-Sr,As40Fe40Sr20,I 4/m m m,tetragonal,3.9729799997357778,3.9729799997357778,6.45523327,data/final/MP/cifs/As2Fe1.78Ni0.22Sr1-MP-mp-4488-synth_doped.cif,data/source/MP/raw/cifs/mp-4488.cif,mp-4488,0.0,,2011-05-13 03:37:13,6.319998834487784,10.17188/1208187,"@misc{osti_1208187,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr(FeAs)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208187"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672865'}},0.0,5.13397273,520.0,-30.61898897,-6.123797794,"{'tags': ['Strontium diiron arsenide - HT', 'Strontium diiron arsenide', 'Strontium diiron diarsenide', 'Iron strontium arsenide (2/1/2)', 'Strontium diiron arsenide - LT']}",-30.61898897,-6.123797794,-0.5342483613333335,"['xas', 'elasticity', 'bandstructure']",True,"[182330, 181993, 610527, 163209, 163208, 163869]",True,2021-05-12 10:56:20.740000,NM,5,8,mp-4488,,Sr(FeAs)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Fe': 2.0, 'As': 2.0}",GGA,mp-4488,"['mp-906356', 'mp-920135', 'mp-919110', 'mp-4488', 'mp-1439153', 'mp-1672865', 'mp-1873948', 'mp-1592272']",0.0029206,"{'Sr': 1.0, 'Fe': 2.0, 'As': 2.0}",91.7377588211838,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",3.183640016422098e-05,0.0029206,0,0.0029206,MP,data/source/MP/cleaned/cifs/MP-mp-4488.cif,True,,data/final/MP/graphs/As2Fe1.78Ni0.22Sr1-MP-mp-4488-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ce0.86Ru2Tb0.14,3,0.0933333333333333,2.0,False,Ce1.72Ru4Tb0.28,Ce2Ru4,4.51,Heavy_fermion,True,Ce28.667Ru66.667Tb4.667,Ce-Ru-Tb,3,Supercon,Ce0.86Tb0.14Ru2,MP-mp-607,Ce2Ru4,Ce-Ru,Ce33.333Ru66.667,F d -3 m,cubic,5.35903077,5.35903077,5.35903077,data/final/MP/cifs/Ce0.86Ru2Tb0.14-MP-mp-607-synth_doped.cif,data/source/MP/raw/cifs/mp-607.cif,mp-607,0.0,,2011-05-13 22:34:26,10.444470046690055,10.17188/1277529,"@misc{osti_1277529,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeRu2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277529"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686879'}},0.0,8.61419203,520.0,-50.66413619,-8.444022698333333,"{'tags': ['Cerium ruthenium (1/2)', 'Cerium ruthenium hydride (1/2/4)']}",-50.66413619,-8.444022698333333,-0.2833998766666663,"['xas', 'elasticity', 'bandstructure']",True,"[621326, 656077, 621978, 621973, 621980, 621984, 102277, 621972, 621976, 621979, 604113, 621977, 621982, 621983, 102276, 656078]",True,2021-05-12 10:56:27.046000,NM,6,14,mp-607,,CeRu2,"{'functional': 'PBE', 'labels': ['Ce', 'Ru_pv'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Ru': 2.0}",GGA,mp-607,"['mp-928203', 'mp-912221', 'mp-928809', 'mp-607', 'mp-1071462', 'mp-1071593', 'mp-1071613', 'mp-1077792', 'mp-1440763', 'mp-1686879', 'mp-1803198', 'mp-1591928', 'mp-1591642', 'mp-1071635']",1.005e-05,"{'Ce': 2.0, 'Ru': 4.0}",108.82877852828122,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",1.846937939745105e-07,1.005e-05,0,2.01e-05,MP,data/source/MP/cleaned/cifs/MP-mp-607.cif,True,,data/final/MP/graphs/Ce0.86Ru2Tb0.14-MP-mp-607-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ge4Ru3Yb2,1,0.0,4.0,False,Ge16Ru12Yb8,Ge16Ru12Yb8,0.0,Heavy_fermion,True,Ge44.444Ru33.333Yb22.222,Ge-Ru-Yb,3,Supercon,Yb2Ru3Ge4,MP-mp-642651,Yb8Ge16Ru12,Ge-Ru-Yb,Ge44.444Ru33.333Yb22.222,C 1 2/c 1,monoclinic,5.554076000437147,10.45297379,11.433050232189409,data/final/MP/cifs/Ge4Ru3Yb2-MP-mp-642651.cif,data/source/MP/raw/cifs/mp-642651.cif,mp-642651,0.0,,2013-06-28 07:23:56,10.128360207501672,10.17188/1280140,"@misc{osti_1280140,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Yb2Ge4Ru3 (SG:15) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1280140"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1733400'}},0.0,6.10793456,520.0,-218.41506328,-6.067085091111111,{'tags': ['Diyttrium triruthenium tetragermanide']},-218.41506328,-6.067085091111111,-0.5788076527777777,"['xas', 'bandstructure']",True,[416964],True,2021-05-12 10:57:30.779000,NM,36,7,mp-642651,,Yb2Ge4Ru3,"{'functional': 'PBE', 'labels': ['Yb_2', 'Ge_d', 'Ru_pv'], 'pot_type': 'paw'}","{'Yb': 2.0, 'Ge': 4.0, 'Ru': 3.0}",GGA,mp-642651,"['mp-642651', 'mp-932151', 'mp-931298', 'mp-915315', 'mp-1396110', 'mp-1733400', 'mp-1887489']",0.00154975,"{'Yb': 8.0, 'Ge': 16.0, 'Ru': 12.0}",616.3515553438128,[],NM,False,15,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",1.0057571764448743e-05,0.00154975,0,0.006199,MP,data/source/MP/cleaned/cifs/MP-mp-642651.cif,False,,data/final/MP/graphs/Ge4Ru3Yb2-MP-mp-642651.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
B4Co4Y1,1,0.0,2.0,False,B8Co8Y2,B8Co8Y2,0.0,Other,True,B44.444Co44.444Y11.111,B-Co-Y,3,Supercon,Y1Co4B4,MP-mp-1105964,Y2Co8B8,B-Co-Y,B44.444Co44.444Y11.111,P 42/n m c,tetragonal,4.99895,4.99895,6.979675,data/final/MP/cifs/B4Co4Y1-MP-mp-1105964.cif,data/source/MP/raw/cifs/mp-1105964.cif,mp-1105964,0.0,,2018-07-19 07:02:54,7.00479756942573,,,,0.0,6.36308273,520.0,-132.19306893,-7.344059385,{'tags': ['Yttrium cobalt boride (1/4/4)']},-132.19306893,-7.344059385,-0.4976916764814818,[],False,"[613439, 613410]",True,2021-05-12 10:59:33.162000,NM,18,4,mp-1105964,,Y(CoB)4,"{'functional': 'PBE', 'labels': ['Y_sv', 'Co', 'B'], 'pot_type': 'paw'}","{'Y': 1.0, 'Co': 4.0, 'B': 4.0}",GGA,mp-1105964,"['mp-1105964', 'mp-1189778', 'mp-1832828', 'mp-1982153']",0.0170935,"{'Y': 2.0, 'Co': 8.0, 'B': 8.0}",174.41859610759167,[],NM,False,137,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001960054762676,0.0170935,0,0.034187,MP,data/source/MP/cleaned/cifs/MP-mp-1105964.cif,False,,data/final/MP/graphs/B4Co4Y1-MP-mp-1105964.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
As1Zn1,1,0.0,8.0,False,As8Zn8,As8Zn8,0.0,Other,True,As50Zn50,As-Zn,2,Supercon,As1Zn1,MP-mp-7372,Zn8As8,As-Zn,As50Zn50,P b c a,orthorhombic,5.749606,7.339193,7.659209,data/final/MP/cifs/As1Zn1-MP-mp-7372.cif,data/source/MP/raw/cifs/mp-7372.cif,mp-7372,0.4504000000000001,,2011-06-04 19:52:33,5.767945556922724,10.17188/1287869,"@misc{osti_1287869,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZnAs (SG:61) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1287869"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1705475'}},0.0191857386328124,3.26415648,520.0,-49.46212553,-3.091382845625,{'tags': ['Zinc arsenide (1/1)']},-49.46212553,-3.091382845625,-0.131951838125,"['diel', 'bandstructure']",True,"[427612, 427613, 431]",True,2021-05-12 10:56:47.291000,NM,16,11,mp-7372,,ZnAs,"{'functional': 'PBE', 'labels': ['Zn', 'As'], 'pot_type': 'paw'}","{'Zn': 1.0, 'As': 1.0}",GGA,mp-7372,"['mp-680880', 'mp-657930', 'mp-7372', 'mp-665676', 'mp-1105205', 'mp-1105226', 'mp-1140864', 'mp-1434426', 'mp-1705475', 'mp-1811964', 'mp-1603786']",5.925e-06,"{'Zn': 8.0, 'As': 8.0}",323.1992275096849,[],NM,False,61,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.4665876637523717e-07,5.925e-06,0,4.74e-05,MP,data/source/MP/cleaned/cifs/MP-mp-7372.cif,False,,data/final/MP/graphs/As1Zn1-MP-mp-7372.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ce0.06Cu1La1.94O4,2,0.0171428571428571,1.0,True,Ce0.06Cu1La1.94O4,Cu1La2O4,0.0,Cuprate,True,Ce0.857Cu14.286La27.714O57.142857142857146,Ce-Cu-La-O,4,Supercon,La1.94Ce0.06Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ce0.06Cu1La1.94O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ce0.06Cu1La1.94O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ni2P1,1,0.0,3.0,False,Ni6P3,Ni6P3,0.0,Ferrite,True,Ni66.667P33.333,Ni-P,2,Supercon,Ni2P1,MP-mp-21167,Ni6P3,Ni-P,Ni66.667P33.333,P -6 2 m,hexagonal,3.34933,5.872756001468988,5.8727561,data/final/MP/cifs/Ni2P1-MP-mp-21167.cif,data/source/MP/raw/cifs/mp-21167.cif,mp-21167,0.0,,2014-02-16 14:13:50,7.387820358381179,10.17188/1183670,"@misc{osti_1183670,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ni2P (SG:189) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1183670"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700797'}},0.0,10.17567334,520.0,-55.2167917,-6.135199077777778,"{'tags': ['Nickel phosphide (2/1)', 'Dinickel phosphide *']}",-55.2167917,-6.135199077777778,-0.477340455555555,"['xas', 'elasticity', 'bandstructure']",True,"[27162, 601077, 646108, 646102, 105306, 43395]",True,2021-05-12 10:56:16.728000,NM,9,11,mp-21167,,Ni2P,"{'functional': 'PBE', 'labels': ['Ni_pv', 'P'], 'pot_type': 'paw'}","{'Ni': 2.0, 'P': 1.0}",GGA,mp-21167,"['mp-992235', 'mp-990510', 'mp-570439', 'mp-21167', 'mp-1079616', 'mp-1116037', 'mp-1476147', 'mp-1700797', 'mp-1868003', 'mp-993868', 'mp-1592573']",0.0001030333333333,"{'Ni': 6.0, 'P': 3.0}",100.03972641169374,[],NM,False,189,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0]",3.089772544238676e-06,0.0001030333333333,0,0.0003091,MP,data/source/MP/cleaned/cifs/MP-mp-21167.cif,False,,data/final/MP/graphs/Ni2P1-MP-mp-21167.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
As2Co0.084Fe1.916Sr1,2,0.0336,1.0,True,As2Co0.084Fe1.916Sr1,As2Fe2Sr1,2.0,Ferrite,True,As40Co1.68Fe38.32Sr20,As-Co-Fe-Sr,4,Supercon,Sr1Fe1.916Co0.084As2,MP-mp-4488,Sr1Fe2As2,As-Fe-Sr,As40Fe40Sr20,I 4/m m m,tetragonal,3.9729799997357778,3.9729799997357778,6.45523327,data/final/MP/cifs/As2Co0.084Fe1.916Sr1-MP-mp-4488-synth_doped.cif,data/source/MP/raw/cifs/mp-4488.cif,mp-4488,0.0,,2011-05-13 03:37:13,6.319998834487784,10.17188/1208187,"@misc{osti_1208187,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr(FeAs)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208187"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672865'}},0.0,5.13397273,520.0,-30.61898897,-6.123797794,"{'tags': ['Strontium diiron arsenide - HT', 'Strontium diiron arsenide', 'Strontium diiron diarsenide', 'Iron strontium arsenide (2/1/2)', 'Strontium diiron arsenide - LT']}",-30.61898897,-6.123797794,-0.5342483613333335,"['xas', 'elasticity', 'bandstructure']",True,"[182330, 181993, 610527, 163209, 163208, 163869]",True,2021-05-12 10:56:20.740000,NM,5,8,mp-4488,,Sr(FeAs)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Fe': 2.0, 'As': 2.0}",GGA,mp-4488,"['mp-906356', 'mp-920135', 'mp-919110', 'mp-4488', 'mp-1439153', 'mp-1672865', 'mp-1873948', 'mp-1592272']",0.0029206,"{'Sr': 1.0, 'Fe': 2.0, 'As': 2.0}",91.7377588211838,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",3.183640016422098e-05,0.0029206,0,0.0029206,MP,data/source/MP/cleaned/cifs/MP-mp-4488.cif,True,,data/final/MP/graphs/As2Co0.084Fe1.916Sr1-MP-mp-4488-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Nb2.85Sn1V0.15,3,0.0749999999999999,2.0,False,Nb5.7Sn2V0.3,Nb6Sn2,17.1,Other,True,Nb71.25Sn25V3.75,Nb-Sn-V,3,Supercon,Nb2.85V0.15Sn1,MP-mp-1326,Nb6Sn2,Nb-Sn,Nb75Sn25,P m -3 n,cubic,5.334611,5.334611,5.334611,data/final/MP/cifs/Nb2.85Sn1V0.15-MP-mp-1326-synth_doped.cif,data/source/MP/raw/cifs/mp-1326.cif,mp-1326,0.0,,2011-05-14 09:51:48,8.694218121896231,10.17188/1189484,"@misc{osti_1189484,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Sn (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189484"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668415'}},0.0,6.59372491,520.0,-69.93787048,-8.74223381,{'tags': ['Niobium tin (3/1)']},-69.93787048,-8.74223381,-0.163862066250001,"['xas', 'elasticity', 'bandstructure']",True,"[105230, 645503, 645489, 105231, 645498, 645485, 645474, 645496, 645480, 645488, 645482, 645487, 645500, 645493, 645477, 645484, 645502, 645483, 150878, 645479, 645481, 645486, 645473]",True,2021-05-12 10:56:12.755000,NM,8,9,mp-1326,,Nb3Sn,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Sn_d'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Sn': 1.0}",GGA,mp-1326,"['mp-930046', 'mp-913770', 'mp-930577', 'mp-1326', 'mp-1440651', 'mp-1668415', 'mp-1880085', 'mp-1594093', 'mp-1594507']",0.62023085,"{'Nb': 6.0, 'Sn': 2.0}",151.81275738025872,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0081709977567491,0.62023085,0,1.2404617,MP,data/source/MP/cleaned/cifs/MP-mp-1326.cif,True,,data/final/MP/graphs/Nb2.85Sn1V0.15-MP-mp-1326-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
As1Ru1Zr1,1,0.0,3.0,False,As3Ru3Zr3,As3Ru3Zr3,8.716666667,Other,True,As33.333Ru33.333Zr33.333,As-Ru-Zr,3,Supercon,Zr1Ru1As1,MP-mp-8221,Zr3As3Ru3,As-Ru-Zr,As33.333Ru33.333Zr33.333,P -6 2 m,hexagonal,3.944384,6.641202001828062,6.64120231,data/final/MP/cifs/As1Ru1Zr1-MP-mp-8221.cif,data/source/MP/raw/cifs/mp-8221.cif,mp-8221,0.0,,2011-06-01 13:52:49,8.835455291988726,10.17188/1307975,"@misc{osti_1307975,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrAsRu (SG:189) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1307975"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704416'}},0.0,7.28128643,520.0,-75.14451364,-8.349390404444444,"{'tags': ['Ruthenium zirconium arsenide (1/1/1)', 'Zirconium(II) ruthenium(I) arsenide']}",-75.14451364,-8.349390404444444,-0.8556541744444451,"['bandstructure', 'elasticity']",True,"[611301, 35593]",True,2021-05-12 10:56:31.128000,NM,9,8,mp-8221,,ZrAsRu,"{'functional': 'PBE', 'labels': ['Zr_sv', 'As', 'Ru_pv'], 'pot_type': 'paw'}","{'Zr': 1.0, 'As': 1.0, 'Ru': 1.0}",GGA,mp-8221,"['mp-8221', 'mp-1000580', 'mp-1007053', 'mp-1417304', 'mp-1704416', 'mp-1779814', 'mp-1011793', 'mp-1589377']",0.0069644999999999,"{'Zr': 3.0, 'As': 3.0, 'Ru': 3.0}",150.66182613383486,[],NM,False,189,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001386781279382,0.0069644999999999,0,0.0208935,MP,data/source/MP/cleaned/cifs/MP-mp-8221.cif,False,,data/final/MP/graphs/As1Ru1Zr1-MP-mp-8221.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Ce0.225Co1In5Yb0.775,3,0.0642857142857142,1.0,True,Ce0.225Co1In5Yb0.775,Co1In5Yb1,0.0,Heavy_fermion,True,Ce3.214Co14.286In71.429Yb11.071,Ce-Co-In-Yb,4,Supercon,Ce0.225Yb0.775Co1In5,MP-mp-20972,Yb1In5Co1,Co-In-Yb,Co14.286In71.429Yb14.286,P 4/m m m,tetragonal,4.590853,4.590853,7.607487,data/final/MP/cifs/Ce0.225Co1In5Yb0.775-MP-mp-20972-synth_doped.cif,data/source/MP/raw/cifs/mp-20972.cif,mp-20972,0.0,,2014-12-22 16:06:00,8.348149091373244,10.17188/1196207,"@misc{osti_1196207,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YbIn5Co (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196207"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701266'}},0.0026085400000015,6.87126236,520.0,-23.81858389,-3.402654841428572,"{'tags': ['Ytterbium cobalt indium (1/1/5)', 'Ytterbium cobalt pentaindium']}",-23.81858389,-3.402654841428572,-0.2017484521428575,"['xas', 'bandstructure']",True,"[163767, 412910]",True,2021-05-12 10:56:57.051000,NM,7,8,mp-20972,,YbIn5Co,"{'functional': 'PBE', 'labels': ['Yb_2', 'In_d', 'Co'], 'pot_type': 'paw'}","{'Yb': 1.0, 'In': 5.0, 'Co': 1.0}",GGA,mp-20972,"['mp-911825', 'mp-927970', 'mp-20972', 'mp-1436288', 'mp-1701266', 'mp-1787075', 'mp-928520', 'mp-1593315']",0.0001036,"{'Yb': 1.0, 'In': 5.0, 'Co': 1.0}",160.334873131229,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0, 0]",6.461476407269596e-07,0.0001036,0,0.0001036,MP,data/source/MP/cleaned/cifs/MP-mp-20972.cif,True,,data/final/MP/graphs/Ce0.225Co1In5Yb0.775-MP-mp-20972-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ba2Cu3Pr0.43Y0.57O7,2,0.0107692307692307,2.0,False,Ba4Cu6Pr0.86Y1.14O14,Ba4Cu6Pr1Y1O14,22.0,Cuprate,True,Ba15.385Cu23.077Pr3.308Y4.385O53.84615384615385,Ba-Cu-Pr-Y-O,5,Supercon,Y0.57Pr0.43Ba2Cu3O7,MP-mp-1228182,Ba4Pr1Y1Cu6O14,Ba-Cu-Pr-Y-O,Ba15.385Cu23.077Pr3.846Y3.846O53.84615384615385,C m m m,orthorhombic,3.949929,7.74232199751255,12.49432076,data/final/MP/cifs/Ba2Cu3Pr0.43Y0.57O7-MP-mp-1228182-synth_doped.cif,data/source/MP/raw/cifs/mp-1228182.cif,mp-1228182,0.0,,2019-01-13 03:55:31.194000,6.327747434820984,,,,0.0237480683814448,3.26863064,520.0,-159.60355051,-6.138598096538461,{'tags': []},-159.60355051,-6.138598096538461,-2.1704462631410246,[],False,[],True,2021-05-12 11:00:59.151000,NM,26,3,mp-1228182,oxide,Ba4PrY(Cu3O7)2,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Pr_3', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 4.0, 'Pr': 1.0, 'Y': 1.0, 'Cu': 6.0, 'O': 14.0}",GGA,mp-1228182,"['mp-1228182', 'mp-1368338', 'mp-1838576']",0.0118757,"{'Ba': 4.0, 'Pr': 1.0, 'Y': 1.0, 'Cu': 6.0, 'O': 14.0}",363.293922142809,[],NM,False,65,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",3.268895865351615e-05,0.0118757,0,0.0118757,MP,data/source/MP/cleaned/cifs/MP-mp-1228182.cif,True,,data/final/MP/graphs/Ba2Cu3Pr0.43Y0.57O7-MP-mp-1228182-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
C0.977Mg1Ni3,2,0.0073940124573035,1.0,True,C0.977Mg1Ni3,C1Mg1Ni3,7.0,Other,True,C19.63Mg20.092Ni60.277,C-Mg-Ni,3,Supercon,Mg1C0.977Ni3,MP-mp-10700,Mg1Ni3C1,C-Mg-Ni,C20Mg20Ni60,P m -3 m,cubic,3.810209,3.810209,3.810209,data/final/MP/cifs/C0.977Mg1Ni3-MP-mp-10700-synth_doped.cif,data/source/MP/raw/cifs/mp-10700.cif,mp-10700,0.0,,2011-05-28 10:04:44,6.376007671789427,10.17188/1187303,"@misc{osti_1187303,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MgNi3C (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187303"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678621'}},0.0,6.64260176,520.0,-28.85099542,-5.770199084,{'tags': ['Magnesium nickel carbide (1/3/1)']},-28.85099542,-5.770199084,-0.1367049259999994,"['xas', 'elasticity', 'bandstructure']",True,[77152],True,2021-05-12 10:56:10.715000,NM,5,8,mp-10700,,MgNi3C,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Ni_pv', 'C'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",GGA,mp-10700,"['mp-927245', 'mp-927653', 'mp-911184', 'mp-10700', 'mp-1438083', 'mp-1678621', 'mp-1791467', 'mp-1591421']",0.0387875,"{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",55.31544309398296,[],NM,False,221,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",0.0007012056277683,0.0387875,0,0.0387875,MP,data/source/MP/cleaned/cifs/MP-mp-10700.cif,True,,data/final/MP/graphs/C0.977Mg1Ni3-MP-mp-10700-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Br2Cu1,1,0.0,1.0,True,Br2Cu1,Br2Cu1,0.0,Other,True,Br66.667Cu33.333,Br-Cu,2,Supercon,Br2Cu1,MP-mp-23219,Cu1Br2,Br-Cu,Br66.667Cu33.333,C 1 2/m 1,monoclinic,3.492558002908769,4.22377869,6.451834286288937,data/final/MP/cifs/Br2Cu1-MP-mp-23219.cif,data/source/MP/raw/cifs/mp-23219.cif,mp-23219,0.0,,2014-02-21 07:33:48,4.4577848621327,10.17188/1199337,"@misc{osti_1199337,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CuBr2 (SG:12) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199337"",
    place = ""United States"",
    year = ""2016"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688187'}},0.0,0.97092026,520.0,-8.29652563,-2.765508543333333,"{'tags': ['Copper(I) bromide', 'Copper bromide']}",-8.29652563,-2.765508543333333,-0.6638177249999998,"['xas', 'elasticity', 'bandstructure']",True,"[22079, 409450]",True,2021-05-12 10:56:16.728000,FM,3,8,mp-23219,,CuBr2,"{'functional': 'PBE', 'labels': ['Cu_pv', 'Br'], 'pot_type': 'paw'}","{'Cu': 1.0, 'Br': 2.0}",GGA,mp-23219,"['mp-990872', 'mp-992859', 'mp-23219', 'mp-1437862', 'mp-1688187', 'mp-1799826', 'mp-994171', 'mp-1593359']",0.8298588,"{'Cu': 1.0, 'Br': 2.0}",83.2000767538018,[],FM,True,12,1,"[0.4, 0.0, 0.0]",0.0099742552216104,0.8298588,1,0.8298588,MP,data/source/MP/cleaned/cifs/MP-mp-23219.cif,False,,data/final/MP/graphs/Br2Cu1-MP-mp-23219.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
Ge12La1Pt4,1,0.0,1.0,True,Ge12La1Pt4,Ge12La1Pt4,8.253333333,Other,True,Ge70.588La5.882Pt23.529,Ge-La-Pt,3,Supercon,La1Pt4Ge12,MP-mp-1188305,La1Ge12Pt4,Ge-La-Pt,Ge70.588La5.882Pt23.529,I m -3,cubic,7.590844301682771,7.5908443,7.5908443,data/final/MP/cifs/Ge12La1Pt4-MP-mp-1188305.cif,data/source/MP/raw/cifs/mp-1188305.cif,mp-1188305,0.0,,2019-01-11 19:20:34.433000,8.832370544717328,,,{'GGA': {'task_id': 'mp-1705501'}},0.0,4.5992043,520.0,-91.72170297,-5.3953942923529405,{'tags': ['Lanthanum platinum germanide (1/4/12)']},-91.72170297,-5.3953942923529405,-0.4132782802941172,['bandstructure'],True,[174552],True,2021-05-12 10:58:31.620000,NM,17,5,mp-1188305,,La(Ge3Pt)4,"{'functional': 'PBE', 'labels': ['La', 'Ge_d', 'Pt'], 'pot_type': 'paw'}","{'La': 1.0, 'Ge': 12.0, 'Pt': 4.0}",GGA,mp-1188305,"['mp-1188305', 'mp-1414924', 'mp-1705501', 'mp-1806915', 'mp-1637926']",0.0002676,"{'La': 1.0, 'Ge': 12.0, 'Pt': 4.0}",336.7040650175617,[],NM,False,204,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",7.947631995059003e-07,0.0002676,0,0.0002676,MP,data/source/MP/cleaned/cifs/MP-mp-1188305.cif,False,,data/final/MP/graphs/Ge12La1Pt4-MP-mp-1188305.json,0,True,m-3,2,0,0,0,0,0,0,0,0,1,0,1.0,False
Cl1Cu3Pb3Sr3O8,1,0.0,1.0,True,Cl1Cu3Pb3Sr3O8,Cl1Cu3Pb3Sr3O8,0.0,Cuprate,True,Cl5.556Cu16.667Pb16.667Sr16.667O44.44444444444444,Cl-Cu-Pb-Sr-O,5,Supercon,Pb3Sr3Cu3Cl1O8,MP-mp-1218799,Sr3Cu3Pb3Cl1O8,Cl-Cu-Pb-Sr-O,Cl5.556Cu16.667Pb16.667Sr16.667O44.44444444444444,P 1 m 1,monoclinic,3.870427,3.909287,19.93454326,data/final/MP/cifs/Cl1Cu3Pb3Sr3O8-MP-mp-1218799.cif,data/source/MP/raw/cifs/mp-1218799.cif,mp-1218799,0.0,,2019-01-12 19:54:30.504000,6.819462375104591,,,,0.0263856249363412,4.4313939,520.0,-97.40075045,-5.411152802777778,{'tags': []},-97.40075045,-5.411152802777778,-1.865249120555556,[],False,[],True,2021-05-12 11:00:42.526000,NM,18,3,mp-1218799,oxide,Sr3Cu3Pb3ClO8,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Cu_pv', 'Pb_d', 'Cl', 'O'], 'pot_type': 'paw'}","{'Sr': 3.0, 'Cu': 3.0, 'Pb': 3.0, 'Cl': 1.0, 'O': 8.0}",GGA,mp-1218799,"['mp-1218799', 'mp-1341933', 'mp-1809878']",0.003276,"{'Sr': 3.0, 'Cu': 3.0, 'Pb': 3.0, 'Cl': 1.0, 'O': 8.0}",301.5859957519648,[],NM,False,6,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.086257334937495e-05,0.003276,0,0.003276,MP,data/source/MP/cleaned/cifs/MP-mp-1218799.cif,False,,data/final/MP/graphs/Cl1Cu3Pb3Sr3O8-MP-mp-1218799.json,0,True,m,0,0,5,0,0,0,0,1,0,0,0,1.0,False
B2Os1,1,0.0,2.0,False,B4Os2,B4Os2,1.5975,Other,True,B66.667Os33.333,B-Os,2,Supercon,B2Os1,MP-mp-2850,B4Os2,B-Os,B66.667Os33.333,P m m n,orthorhombic,2.887289,4.091241,4.709187,data/final/MP/cifs/B2Os1-MP-mp-2850.cif,data/source/MP/raw/cifs/mp-2850.cif,mp-2850,0.0,,2011-05-12 22:54:32,12.647957738388936,10.17188/1202594,"@misc{osti_1202594,
    author = ""Persson, Kristin"",
    title = ""Materials Data on B2Os (SG:59) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1202594"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1674202'}},0.0,8.69541043,520.0,-50.45030917,-8.408384861666667,"{'tags': ['Osmium diboride', 'Osmium boride (1/2)']}",-50.45030917,-8.408384861666667,-0.2130015961111103,"['xas', 'elasticity', 'bandstructure']",True,"[615115, 421523, 615117, 43316]",True,2021-05-12 10:56:18.721000,NM,6,9,mp-2850,,B2Os,"{'functional': 'PBE', 'labels': ['B', 'Os_pv'], 'pot_type': 'paw'}","{'B': 2.0, 'Os': 1.0}",GGA,mp-2850,"['mp-909985', 'mp-925537', 'mp-925953', 'mp-2850', 'mp-1077481', 'mp-1438735', 'mp-1674202', 'mp-1793940', 'mp-1593440']",0.0009291,"{'B': 4.0, 'Os': 2.0}",55.62771944906151,[],NM,False,59,0,"[0, 0, 0, 0, 0, 0]",3.340420959916504e-05,0.0009291,0,0.0018582,MP,data/source/MP/cleaned/cifs/MP-mp-2850.cif,False,,data/final/MP/graphs/B2Os1-MP-mp-2850.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
In0.2Si0.8V3,3,0.0999999999999999,2.0,False,In0.4Si1.6V6,Si2V6,16.2,Other,True,In5Si20V75,In-Si-V,3,Supercon,In0.2Si0.8V3,MP-mp-2567,V6Si2,Si-V,Si25V75,P m -3 n,cubic,4.702381,4.702381,4.702381,data/final/MP/cifs/In0.2Si0.8V3-MP-mp-2567-synth_doped.cif,data/source/MP/raw/cifs/mp-2567.cif,mp-2567,0.0,,2011-05-13 19:15:43,5.778142190030859,10.17188/1200874,"@misc{osti_1200874,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Si (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1200874"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668672'}},0.0,7.30599425,520.0,-69.05773321,-8.63221665125,{'tags': ['Vanadium silicide (3/1)']},-69.05773321,-8.63221665125,-0.4452085937499994,"['xas', 'elasticity', 'bandstructure']",True,"[652491, 87328, 652522, 652502, 652510, 652520, 600518, 186003, 652507, 652513, 652497, 601150, 652514, 652487, 22412, 652509, 652529, 652532, 652499, 652539, 652537, 652533, 652512, 652538, 652490, 652493, 652494, 652511, 652519, 87329, 652526, 652500]",True,2021-05-12 10:56:18.721000,FM,8,13,mp-2567,,V3Si,"{'functional': 'PBE', 'labels': ['V_pv', 'Si'], 'pot_type': 'paw'}","{'V': 3.0, 'Si': 1.0}",GGA,mp-2567,"['mp-920081', 'mp-906309', 'mp-919083', 'mp-2567', 'mp-1078474', 'mp-1078852', 'mp-1138781', 'mp-1145907', 'mp-1440678', 'mp-1668672', 'mp-1795955', 'mp-1593554', 'mp-1596575']",0.8382519,"{'V': 6.0, 'Si': 2.0}",103.98086881866836,[],FM,True,131,1,"[0.2, 0.3, 0.3, 0.2, 0.3, 0.3, 0.0, 0.0]",0.0161231947669493,0.8382519,6,1.6765038,MP,data/source/MP/cleaned/cifs/MP-mp-2567.cif,True,,data/final/MP/graphs/In0.2Si0.8V3-MP-mp-2567-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ce1Ge3Ir1,1,0.0,1.0,True,Ce1Ge3Ir1,Ce1Ge3Ir1,0.805,Heavy_fermion,True,Ce20Ge60Ir20,Ce-Ge-Ir,3,Supercon,Ce1Ir1Ge3,MP-mp-13122,Ce1Ge3Ir1,Ce-Ge-Ir,Ce20Ge60Ir20,I 4 m m,tetragonal,4.434898001260037,4.434898001260037,5.94364659,data/final/MP/cifs/Ce1Ge3Ir1-MP-mp-13122.cif,data/source/MP/raw/cifs/mp-13122.cif,mp-13122,0.0,,2011-05-28 13:58:22,9.201014003416708,10.17188/1189397,"@misc{osti_1189397,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeGe3Ir (SG:107) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189397"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704031'}},0.0,6.52406018,520.0,-31.91866718,-6.383733436,{'tags': ['Cerium iridium germanide (1/1/3)']},-31.91866718,-6.383733436,-0.6556128079999993,"['xas', 'bandstructure']",True,[161868],True,2021-05-12 10:56:53.126000,FM,5,7,mp-13122,,CeGe3Ir,"{'functional': 'PBE', 'labels': ['Ce', 'Ge_d', 'Ir'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Ge': 3.0, 'Ir': 1.0}",GGA,mp-13122,"['mp-1001224', 'mp-1007584', 'mp-13122', 'mp-1422954', 'mp-1704031', 'mp-1783992', 'mp-1592645']",0.7745734,"{'Ce': 1.0, 'Ge': 3.0, 'Ir': 1.0}",99.30607677311978,[],FM,True,107,1,"[0.7, 0.0, 0.0, 0.0, 0.0]",0.0077998590334973,0.7745734,1,0.7745734,MP,data/source/MP/cleaned/cifs/MP-mp-13122.cif,False,,data/final/MP/graphs/Ce1Ge3Ir1-MP-mp-13122.json,0,True,4mm,0,0,0,0,5,0,0,0,0,1,0,1.0,False
B1.991C0.009Mg1,2,0.0059999999999999,1.0,True,B1.991C0.009Mg1,B2Mg1,38.5,Other,True,B66.367C0.3Mg33.333,B-C-Mg,3,Supercon,Mg1B1.9906C0.0094,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B1.991C0.009Mg1-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B1.991C0.009Mg1-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Co1Hf2,1,0.0,8.0,False,Co8Hf16,Co8Hf16,0.56,Other,True,Co33.333Hf66.667,Co-Hf,2,Supercon,Co1Hf2,MP-mp-1190841,Hf16Co8,Co-Hf,Co33.333Hf66.667,F d -3 m,cubic,8.49719754,8.49719754,8.49719754,data/final/MP/cifs/Co1Hf2-MP-mp-1190841.cif,data/source/MP/raw/cifs/mp-1190841.cif,mp-1190841,0.0,,2019-01-11 21:15:16.922000,12.73589990798073,,,{'GGA': {'task_id': 'mp-1711577'}},0.0,5.05497448,520.0,-223.18956261,-9.29956510875,"{'tags': ['Hafnium cobalt hydride (2/1/4)', 'Hafnium cobalt (2/1)', 'Hafnium cobalt hydride (1/0.5/1.83)']}",-223.18956261,-9.29956510875,-0.2919999437499996,['bandstructure'],True,"[623691, 623689, 623763, 623774]",True,2021-05-12 10:58:33.577000,NM,24,8,mp-1190841,,Hf2Co,"{'functional': 'PBE', 'labels': ['Hf_pv', 'Co'], 'pot_type': 'paw'}","{'Hf': 2.0, 'Co': 1.0}",GGA,mp-1190841,"['mp-1190841', 'mp-1191742', 'mp-1191808', 'mp-1191984', 'mp-1382234', 'mp-1711577', 'mp-1822483', 'mp-1607887']",0.00011205,"{'Hf': 16.0, 'Co': 8.0}",433.8225731055855,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.0662825209462545e-06,0.00011205,0,0.0008964,MP,data/source/MP/cleaned/cifs/MP-mp-1190841.cif,False,,data/final/MP/graphs/Co1Hf2-MP-mp-1190841.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Al1Ce1Rh1,1,0.0,8.0,False,Al8Ce8Rh8,Al8Ce8Rh8,0.0,Heavy_fermion,True,Al33.333Ce33.333Rh33.333,Al-Ce-Rh,3,Supercon,Ce1Rh1Al1,MP-mp-3344,Ce8Al8Rh8,Al-Ce-Rh,Al33.333Ce33.333Rh33.333,P n m a,orthorhombic,4.210016,7.124038,15.873667,data/final/MP/cifs/Al1Ce1Rh1-MP-mp-3344.cif,data/source/MP/raw/cifs/mp-3344.cif,mp-3344,0.0,,2011-05-20 19:56:34,7.533911201638003,10.17188/1206579,"@misc{osti_1206579,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeAlRh (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1206579"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1730408'}},0.0,7.82060357,520.0,-156.70140986,-6.529225410833334,{'tags': ['Cerium rhodium aluminium (1/1/1)']},-156.70140986,-6.529225410833334,-0.8482344591666665,"['xas', 'bandstructure']",True,"[55623, 160052]",True,2021-05-12 10:57:06.958000,FM,24,8,mp-3344,,CeAlRh,"{'functional': 'PBE', 'labels': ['Ce', 'Al', 'Rh_pv'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Al': 1.0, 'Rh': 1.0}",GGA,mp-3344,"['mp-904684', 'mp-919272', 'mp-918258', 'mp-3344', 'mp-1261881', 'mp-1445624', 'mp-1730408', 'mp-1816490']",0.2865019375,"{'Ce': 8.0, 'Al': 8.0, 'Rh': 8.0}",476.0880044336372,[],FM,True,62,2,"[0.4, 0.4, 0.4, 0.4, 0.1, 0.1, 0.1, 0.1, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0048142685357649,0.2865019375,8,2.2920155,MP,data/source/MP/cleaned/cifs/MP-mp-3344.cif,False,,data/final/MP/graphs/Al1Ce1Rh1-MP-mp-3344.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Al2Au1,1,0.0,1.0,True,Al2Au1,Al2Au1,0.0475,Other,True,Al66.667Au33.333,Al-Au,2,Supercon,Al2Au1,MP-mp-2647,Al2Au1,Al-Au,Al66.667Au33.333,F m -3 m,cubic,4.28744014,4.28744014,4.28744014,data/final/MP/cifs/Al2Au1-MP-mp-2647.cif,data/source/MP/raw/cifs/mp-2647.cif,mp-2647,0.0,,2011-05-12 18:06:31,7.476904945279304,10.17188/1201176,"@misc{osti_1201176,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Al2Au (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201176"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686809'}},0.0,6.29523805,520.0,-12.03419975,-4.011399916666667,"{'tags': ['Aluminium gold (2/1)', 'Gold aluminium (1/2)', 'Gold aluminide (1/2)']}",-12.03419975,-4.011399916666667,-0.4230555166666671,"['xas', 'elasticity', 'bandstructure']",True,"[606031, 606033, 57501, 606029, 184454, 606022, 606036, 151405]",True,2021-05-12 10:56:18.721000,NM,3,14,mp-2647,,Al2Au,"{'functional': 'PBE', 'labels': ['Al', 'Au'], 'pot_type': 'paw'}","{'Al': 2.0, 'Au': 1.0}",GGA,mp-2647,"['mp-990528', 'mp-992202', 'mp-2647', 'mp-1063123', 'mp-1063132', 'mp-1063154', 'mp-1253199', 'mp-1442121', 'mp-1686809', 'mp-1791663', 'mp-993832', 'mp-1596230', 'mp-1592986', 'mp-1063158']",0.0001161,"{'Al': 2.0, 'Au': 1.0}",55.72873849978455,[],NM,False,225,0,"[0, 0, 0]",2.083305725652642e-06,0.0001161,0,0.0001161,MP,data/source/MP/cleaned/cifs/MP-mp-2647.cif,False,,data/final/MP/graphs/Al2Au1-MP-mp-2647.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ag0.4Sn0.6Te1,3,0.0999999999999999,2.0,False,Ag0.8Sn1.2Te2,Ag1Sn1Te2,1.95,Other,True,Ag20Sn30Te50,Ag-Sn-Te,3,Supercon,Sn0.6Ag0.4Te1,MP-mp-1229006,Ag1Sn1Te2,Ag-Sn-Te,Ag25Sn25Te50,P 4/m m m,tetragonal,4.34439,4.34439,6.074553,data/final/MP/cifs/Ag0.4Sn0.6Te1-MP-mp-1229006-synth_doped.cif,data/source/MP/raw/cifs/mp-1229006.cif,mp-1229006,0.0,,2019-01-13 04:39:05.516000,6.977893003537542,,,{'GGA': {'task_id': 'mp-1732744'}},0.0364139496875002,5.54955594,520.0,-13.64719625,-3.4117990625,{'tags': []},-13.64719625,-3.4117990625,-0.3406166329166669,['bandstructure'],True,[],True,2021-05-12 10:58:49.477000,NM,4,5,mp-1229006,,AgSnTe2,"{'functional': 'PBE', 'labels': ['Ag', 'Sn_d', 'Te'], 'pot_type': 'paw'}","{'Ag': 1.0, 'Sn': 1.0, 'Te': 2.0}",GGA,mp-1229006,"['mp-1229006', 'mp-1445755', 'mp-1732744', 'mp-1803164', 'mp-1584969']",0.0064562,"{'Ag': 1.0, 'Sn': 1.0, 'Te': 2.0}",114.64943961316844,[],NM,False,123,0,"[0, 0, 0, 0]",5.631252993284104e-05,0.0064562,0,0.0064562,MP,data/source/MP/cleaned/cifs/MP-mp-1229006.cif,True,,data/final/MP/graphs/Ag0.4Sn0.6Te1-MP-mp-1229006-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Au0.988Ga2Pd0.012,2,0.008,1.0,True,Au0.988Ga2Pd0.012,Au1Ga2,1.25,Other,True,Au32.933Ga66.667Pd0.4,Au-Ga-Pd,3,Supercon,Au0.988Pd0.012Ga2,MP-mp-2776,Ga2Au1,Au-Ga,Au33.333Ga66.667,F m -3 m,cubic,4.40327555,4.40327555,4.40327555,data/final/MP/cifs/Au0.988Ga2Pd0.012-MP-mp-2776-synth_doped.cif,data/source/MP/raw/cifs/mp-2776.cif,mp-2776,0.0,,2011-05-12 21:57:19,9.253557284351938,10.17188/1201942,"@misc{osti_1201942,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ga2Au (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201942"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687524'}},0.0,3.58527429,520.0,-10.04441228,-3.3481374266666664,"{'tags': ['Gold gallium (1/2)', 'Gallium gold (2/1)']}",-10.04441228,-3.3481374266666664,-0.2381128983333328,"['xas', 'elasticity', 'bandstructure']",True,"[611874, 611864, 150958, 58458]",True,2021-05-12 10:56:18.721000,NM,3,8,mp-2776,,Ga2Au,"{'functional': 'PBE', 'labels': ['Ga_d', 'Au'], 'pot_type': 'paw'}","{'Ga': 2.0, 'Au': 1.0}",GGA,mp-2776,"['mp-991379', 'mp-2776', 'mp-993315', 'mp-1439079', 'mp-1687524', 'mp-1795480', 'mp-994626', 'mp-1589089']",0.000866,"{'Ga': 2.0, 'Au': 1.0}",60.36880695215696,[],NM,False,225,0,"[0, 0, 0]",1.4345156774198237e-05,0.000866,0,0.000866,MP,data/source/MP/cleaned/cifs/MP-mp-2776.cif,True,,data/final/MP/graphs/Au0.988Ga2Pd0.012-MP-mp-2776-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
In0.1Nb3Sn0.9,2,0.0499999999999999,2.0,False,In0.2Nb6Sn1.8,Nb6Sn2,18.1,Other,True,In2.5Nb75Sn22.5,In-Nb-Sn,3,Supercon,Nb3Sn0.9In0.1,MP-mp-1326,Nb6Sn2,Nb-Sn,Nb75Sn25,P m -3 n,cubic,5.334611,5.334611,5.334611,data/final/MP/cifs/In0.1Nb3Sn0.9-MP-mp-1326-synth_doped.cif,data/source/MP/raw/cifs/mp-1326.cif,mp-1326,0.0,,2011-05-14 09:51:48,8.694218121896231,10.17188/1189484,"@misc{osti_1189484,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Sn (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189484"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668415'}},0.0,6.59372491,520.0,-69.93787048,-8.74223381,{'tags': ['Niobium tin (3/1)']},-69.93787048,-8.74223381,-0.163862066250001,"['xas', 'elasticity', 'bandstructure']",True,"[105230, 645503, 645489, 105231, 645498, 645485, 645474, 645496, 645480, 645488, 645482, 645487, 645500, 645493, 645477, 645484, 645502, 645483, 150878, 645479, 645481, 645486, 645473]",True,2021-05-12 10:56:12.755000,NM,8,9,mp-1326,,Nb3Sn,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Sn_d'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Sn': 1.0}",GGA,mp-1326,"['mp-930046', 'mp-913770', 'mp-930577', 'mp-1326', 'mp-1440651', 'mp-1668415', 'mp-1880085', 'mp-1594093', 'mp-1594507']",0.62023085,"{'Nb': 6.0, 'Sn': 2.0}",151.81275738025872,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0081709977567491,0.62023085,0,1.2404617,MP,data/source/MP/cleaned/cifs/MP-mp-1326.cif,True,,data/final/MP/graphs/In0.1Nb3Sn0.9-MP-mp-1326-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba0.8Bi1K0.2O3,3,0.0799999999999999,4.0,False,Ba3.2Bi4K0.8O12,Ba4Bi4O12,0.0,Oxide,True,Ba16Bi20K4O60,Ba-Bi-K-O,4,Supercon,Ba0.8K0.2Bi1O3,MP-mp-559051,Ba4Bi4O12,Ba-Bi-O,Ba20Bi20O60,P 1 21/c 1,monoclinic,6.244045,6.28001,8.808393428799683,data/final/MP/cifs/Ba0.8Bi1K0.2O3-MP-mp-559051-synth_doped.cif,data/source/MP/raw/cifs/mp-559051.cif,mp-559051,0.0769000000000001,,2015-02-15 08:08:39,7.5826930836026865,10.17188/1270621,"@misc{osti_1270621,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BaBiO3 (SG:14) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1270621"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1709167'}},0.0,3.73830111,520.0,-119.03610928,-5.951805464,"{'tags': ['Barium bismuth(III) bismuth(V) oxide', 'Perovskite, double']}",-119.03610928,-5.951805464,-2.2334278330000004,"['xas', 'elasticity', 'bandstructure']",True,[172756],True,2021-05-12 10:56:22.739000,NM,20,8,mp-559051,oxide,BaBiO3,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Bi': 1.0, 'O': 3.0}",GGA,mp-559051,"['mp-944043', 'mp-933995', 'mp-944705', 'mp-559051', 'mp-1422516', 'mp-1709167', 'mp-1843835', 'mp-1607458']",9.0625e-05,"{'Ba': 4.0, 'Bi': 4.0, 'O': 12.0}",345.39699590112576,[],NM,False,14,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.0495169451438142e-06,9.0625e-05,0,0.0003625,MP,data/source/MP/cleaned/cifs/MP-mp-559051.cif,True,,data/final/MP/graphs/Ba0.8Bi1K0.2O3-MP-mp-559051-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,1,0,0,0,1.0,False
As1F0.1Fe1La0.5Y0.5O0.9,2,0.0499999999999999,2.0,False,As2F0.2Fe2La1Y1O1.8,As2Fe2La1Y1O2,31.4,Ferrite,True,As25F2.5Fe25La12.5Y12.5O22.5,As-F-Fe-La-Y-O,6,Supercon,La0.5Y0.5Fe1As1F0.1O0.9,MP-mp-1222786,La1Y1Fe2As2O2,As-Fe-La-Y-O,As25Fe25La12.5Y12.5O25,P 4 m m,tetragonal,4.113923,4.113923,8.980687,data/final/MP/cifs/As1F0.1Fe1La0.5Y0.5O0.9-MP-mp-1222786-synth_doped.cif,data/source/MP/raw/cifs/mp-1222786.cif,mp-1222786,0.0,,2019-01-12 23:16:19.599000,5.695751494849528,,,{'GGA+U': {'task_id': 'mp-1754089'}},0.2822735440104154,5.1653492,520.0,-55.19504052,-6.899380065,{'tags': []},-55.19504052,-6.899380065,-1.6905483227083336,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,FM,8,5,mp-1222786,oxide,LaYFe2(AsO)2,"{'functional': 'PBE', 'labels': ['La', 'Y_sv', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'La': 1.0, 'Y': 1.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",GGA+U,mp-1222786,"['mp-1222786', 'mp-1398732', 'mp-1754089', 'mp-1779506', 'mp-1619122']",7.653468,"{'La': 1.0, 'Y': 1.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",151.99240183736552,[],FM,True,99,1,"[0.0, 0.0, 3.6, 3.6, 0.0, 0.0, 0.0, 0.0]",0.0503542802632288,7.653468,2,7.653468,MP,data/source/MP/cleaned/cifs/MP-mp-1222786.cif,True,,data/final/MP/graphs/As1F0.1Fe1La0.5Y0.5O0.9-MP-mp-1222786-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
Al0.01B2Mg0.99,2,0.0066666666666666,1.0,True,Al0.01B2Mg0.99,B2Mg1,37.95,Other,True,Al0.333B66.667Mg33,Al-B-Mg,3,Supercon,Mg0.99Al0.01B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/Al0.01B2Mg0.99-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/Al0.01B2Mg0.99-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Mo0.2Zr0.8,1,0.0,10.0,False,Mo2Zr8,Mo2Zr8,4.64,Other,True,Mo20Zr80,Mo-Zr,2,Supercon,Zr0.8Mo0.2,MP-mp-1207454,Zr8Mo2,Mo-Zr,Mo20Zr80,F d -3 m,cubic,7.0560828,7.0560828,7.0560828,data/final/MP/cifs/Mo0.2Zr0.8-MP-mp-1207454.cif,data/source/MP/raw/cifs/mp-1207454.cif,mp-1207454,0.0,,2019-01-12 10:33:39.471000,6.160975519984532,,,{'GGA': {'task_id': 'mp-1744128'}},0.9514992149999985,3.91284758,520.0,-80.97364846,-8.097364846000001,"{'tags': ['MgCu2', 'ZrMo2 rt', 'Friauf-Laves phase, Frank-Kasper phase']}",-80.97364846,-8.097364846000001,0.9099242639999986,[],False,[],True,2021-05-12 11:00:19.396000,NM,10,4,mp-1207454,,Zr4Mo,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Mo_pv'], 'pot_type': 'paw'}","{'Zr': 4.0, 'Mo': 1.0}",GGA,mp-1207454,"['mp-1207454', 'mp-1408901', 'mp-1744128', 'mp-1928538']",0.0042847,"{'Zr': 8.0, 'Mo': 2.0}",248.41396587714368,[],NM,False,227,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",3.449645018846527e-05,0.0042847,0,0.0085694,MP,data/source/MP/cleaned/cifs/MP-mp-1207454.cif,False,,data/final/MP/graphs/Mo0.2Zr0.8-MP-mp-1207454.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
B1C1Mo2,1,0.0,2.0,False,B2C2Mo4,B2C2Mo4,6.7166666665,Other,True,B25C25Mo50,B-C-Mo,3,Supercon,Mo2B1C1,MP-mp-4472,B2Mo4C2,B-C-Mo,B25C25Mo50,C m c m,orthorhombic,3.076998,3.1153799991719664,8.90755537,data/final/MP/cifs/B1C1Mo2-MP-mp-4472.cif,data/source/MP/raw/cifs/mp-4472.cif,mp-4472,0.0,,2011-05-13 10:02:08,8.481290426631558,10.17188/1208175,"@misc{osti_1208175,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BMo2C (SG:63) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208175"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699021'}},0.0480347625000003,9.59275252,520.0,-77.15853903,-9.64481737875,{'tags': ['Molybdenum boride carbide (2/1/1)']},-77.15853903,-9.64481737875,-0.245452746041666,"['xas', 'elasticity', 'bandstructure']",True,"[23188, 43318, 612644]",True,2021-05-12 10:56:20.740000,NM,8,8,mp-4472,,BMo2C,"{'functional': 'PBE', 'labels': ['B', 'Mo_pv', 'C'], 'pot_type': 'paw'}","{'B': 1.0, 'Mo': 2.0, 'C': 1.0}",GGA,mp-4472,"['mp-909977', 'mp-925545', 'mp-925948', 'mp-4472', 'mp-1427000', 'mp-1699021', 'mp-1782768', 'mp-1594269']",6.9e-06,"{'B': 2.0, 'Mo': 4.0, 'C': 2.0}",84.07224433582554,[],NM,False,63,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.6414454150737397e-07,6.9e-06,0,1.38e-05,MP,data/source/MP/cleaned/cifs/MP-mp-4472.cif,False,,data/final/MP/graphs/B1C1Mo2-MP-mp-4472.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
In1Te1,1,0.0,1.0,True,In1Te1,In1Te1,2.206,Other,True,In50Te50,In-Te,2,Supercon,In1Te1,MP-mp-2597,In1Te1,In-Te,In50Te50,F m -3 m,cubic,4.44363296,4.44363296,4.44363296,data/final/MP/cifs/In1Te1-MP-mp-2597.cif,data/source/MP/raw/cifs/mp-2597.cif,mp-2597,0.0,,2011-05-12 18:35:42,6.488053472608879,10.17188/1201088,"@misc{osti_1201088,
    author = ""Persson, Kristin"",
    title = ""Materials Data on InTe (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201088"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668520'}},0.0,6.3140604,520.0,-6.47268679,-3.236343395,"{'tags': ['Indium telluride (1/1)', 'Indium tellurium (1/1) - HP, HT', 'High pressure experimental phase', 'Indium telluride  - II']}",-6.47268679,-3.236343395,-0.4998510649999996,"['xas', 'elasticity', 'bandstructure']",True,"[169425, 44653, 169422, 59547, 169428, 640620, 640614, 169431, 169419, 640622]",True,2021-05-12 10:56:18.721000,NM,2,9,mp-2597,,InTe,"{'functional': 'PBE', 'labels': ['In_d', 'Te'], 'pot_type': 'paw'}","{'In': 1.0, 'Te': 1.0}",GGA,mp-2597,"['mp-1000805', 'mp-1007252', 'mp-2597', 'mp-1440879', 'mp-1668520', 'mp-1793575', 'mp-1011993', 'mp-1588148', 'mp-1589064']",0.0001824,"{'In': 1.0, 'Te': 1.0}",62.04396451824765,[],NM,False,225,0,"[0, 0]",2.939850820563773e-06,0.0001824,0,0.0001824,MP,data/source/MP/cleaned/cifs/MP-mp-2597.cif,False,,data/final/MP/graphs/In1Te1-MP-mp-2597.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ni0.05Pd0.95Te2,2,0.0333333333333333,1.0,True,Ni0.05Pd0.95Te2,Pd1Te2,1.4,Other,True,Ni1.667Pd31.667Te66.667,Ni-Pd-Te,3,Supercon,Ni0.05Pd0.95Te2,MP-mp-782,Te2Pd1,Pd-Te,Pd33.333Te66.667,P -3 m 1,trigonal,4.116332001551086,4.11633193,5.170725,data/final/MP/cifs/Ni0.05Pd0.95Te2-MP-mp-782-synth_doped.cif,data/source/MP/raw/cifs/mp-782.cif,mp-782,0.0,,2011-05-12 19:10:21,7.914048115404642,10.17188/1307608,"@misc{osti_1307608,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Te2Pd (SG:164) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1307608"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671974'}},0.0,6.78872762,520.0,-12.46921459,-4.156404863333333,"{'tags': ['Merenskyite', 'Palladium(IV) telluride', 'Palladium telluride (1/2) - 2H', 'Palladium telluride (1/2)']}",-12.46921459,-4.156404863333333,-0.6155769733333329,"['xas', 'elasticity', 'bandstructure']",True,"[41387, 648995, 649013, 649016, 42555, 42554, 83642]",True,2021-05-12 10:56:31.128000,NM,3,8,mp-782,,Te2Pd,"{'functional': 'PBE', 'labels': ['Te', 'Pd'], 'pot_type': 'paw'}","{'Te': 2.0, 'Pd': 1.0}",GGA,mp-782,"['mp-908021', 'mp-923293', 'mp-922494', 'mp-782', 'mp-1442195', 'mp-1671974', 'mp-1800542', 'mp-1587195']",4.83e-05,"{'Te': 2.0, 'Pd': 1.0}",75.87572485123682,[],NM,False,164,0,"[0, 0, 0]",6.365672300949712e-07,4.83e-05,0,4.83e-05,MP,data/source/MP/cleaned/cifs/MP-mp-782.cif,True,,data/final/MP/graphs/Ni0.05Pd0.95Te2-MP-mp-782-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Hf0.9N1Nb0.1,3,0.0999999999999999,1.0,True,Hf0.9N1Nb0.1,Hf1N1,5.47,Other,True,Hf45N50Nb5,Hf-N-Nb,3,Supercon,Nb0.1Hf0.9N1,MP-mp-2828,Hf1N1,Hf-N,Hf50N50,F m -3 m,cubic,3.2086681400000003,3.208668139999999,3.208668139999999,data/final/MP/cifs/Hf0.9N1Nb0.1-MP-mp-2828-synth_doped.cif,data/source/MP/raw/cifs/mp-2828.cif,mp-2828,0.0,,2011-05-12 17:40:50,13.68399724663909,10.17188/1202411,"@misc{osti_1202411,
    author = ""Persson, Kristin"",
    title = ""Materials Data on HfN (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1202411"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686752'}},0.0,8.29873188,520.0,-21.78975196,-10.89487598,"{'tags': ['Hafnium nitride (1/1)', 'Hafnium(III) nitride', 'Hafnium nitride - B1, NP', 'Hafnium nitride (1/1) - rocksalt type', 'Hafnium nitride']}",-21.78975196,-10.89487598,-1.9285340925000007,"['xas', 'elasticity', 'bandstructure']",True,"[638651, 187190, 638654, 53026, 167859, 186385, 183419, 638655, 192050, 638652, 76129, 181797, 658397, 638656, 658335, 638649, 53025, 638657, 638660, 638650]",True,2021-05-12 10:56:18.721000,NM,2,25,mp-2828,,HfN,"{'functional': 'PBE', 'labels': ['Hf_pv', 'N'], 'pot_type': 'paw'}","{'Hf': 1.0, 'N': 1.0}",GGA,mp-2828,"['mp-1000866', 'mp-1007308', 'mp-2828', 'mp-1057010', 'mp-1057058', 'mp-1057028', 'mp-1058002', 'mp-1058045', 'mp-1058108', 'mp-1058016', 'mp-1058092', 'mp-1058128', 'mp-1058950', 'mp-1058967', 'mp-1059002', 'mp-1440960', 'mp-1686752', 'mp-1793787', 'mp-1012051', 'mp-1595739', 'mp-1596504', 'mp-1058993', 'mp-1058122', 'mp-1058043', 'mp-1057049']",0.000136,"{'Hf': 1.0, 'N': 1.0}",23.35927761313228,[],NM,False,225,0,"[0, 0]",5.822097851328356e-06,0.000136,0,0.000136,MP,data/source/MP/cleaned/cifs/MP-mp-2828.cif,True,,data/final/MP/graphs/Hf0.9N1Nb0.1-MP-mp-2828-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
As2Co0.174Fe1.826Sr1,3,0.0695999999999999,1.0,True,As2Co0.174Fe1.826Sr1,As2Fe2Sr1,9.5,Ferrite,True,As40Co3.48Fe36.52Sr20,As-Co-Fe-Sr,4,Supercon,Sr1Fe1.826Co0.174As2,MP-mp-4488,Sr1Fe2As2,As-Fe-Sr,As40Fe40Sr20,I 4/m m m,tetragonal,3.9729799997357778,3.9729799997357778,6.45523327,data/final/MP/cifs/As2Co0.174Fe1.826Sr1-MP-mp-4488-synth_doped.cif,data/source/MP/raw/cifs/mp-4488.cif,mp-4488,0.0,,2011-05-13 03:37:13,6.319998834487784,10.17188/1208187,"@misc{osti_1208187,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr(FeAs)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208187"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672865'}},0.0,5.13397273,520.0,-30.61898897,-6.123797794,"{'tags': ['Strontium diiron arsenide - HT', 'Strontium diiron arsenide', 'Strontium diiron diarsenide', 'Iron strontium arsenide (2/1/2)', 'Strontium diiron arsenide - LT']}",-30.61898897,-6.123797794,-0.5342483613333335,"['xas', 'elasticity', 'bandstructure']",True,"[182330, 181993, 610527, 163209, 163208, 163869]",True,2021-05-12 10:56:20.740000,NM,5,8,mp-4488,,Sr(FeAs)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Fe': 2.0, 'As': 2.0}",GGA,mp-4488,"['mp-906356', 'mp-920135', 'mp-919110', 'mp-4488', 'mp-1439153', 'mp-1672865', 'mp-1873948', 'mp-1592272']",0.0029206,"{'Sr': 1.0, 'Fe': 2.0, 'As': 2.0}",91.7377588211838,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",3.183640016422098e-05,0.0029206,0,0.0029206,MP,data/source/MP/cleaned/cifs/MP-mp-4488.cif,True,,data/final/MP/graphs/As2Co0.174Fe1.826Sr1-MP-mp-4488-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Al0.3Ba2Cu2La2Ti1.7O10.86,3,0.0680805938494167,0.5,False,Al0.15Ba1Cu1La1Ti0.85O5.43,Ba1Cu1La1Ti1O6,0.0,Cuprate,True,Al1.591Ba10.604Cu10.604La10.604Ti9.014O57.582184517497346,Al-Ba-Cu-La-Ti-O,6,Supercon,La2Ba2Cu2Ti1.7Al0.3O10.86,MP-mp-1227852,Ba1La1Ti1Cu1O6,Ba-Cu-La-Ti-O,Ba10Cu10La10Ti10O60,F -4 3 m,cubic,5.61997722,5.619977219999999,5.619977219999999,data/final/MP/cifs/Al0.3Ba2Cu2La2Ti1.7O10.86-MP-mp-1227852-synth_doped.cif,data/source/MP/raw/cifs/mp-1227852.cif,mp-1227852,0.0,,2019-01-13 03:38:10.917000,6.398590577851808,,,{'GGA': {'task_id': 'mp-1734188'}},0.1228187138579528,4.96777084,520.0,-72.7941219,-7.279412189999999,{'tags': []},-72.7941219,-7.279412189999999,-2.8378679248333327,['bandstructure'],True,[],True,2021-05-12 10:58:49.477000,FM,10,5,mp-1227852,oxide,BaLaTiCuO6,"{'functional': 'PBE', 'labels': ['Ba_sv', 'La', 'Ti_pv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 1.0, 'La': 1.0, 'Ti': 1.0, 'Cu': 1.0, 'O': 6.0}",GGA,mp-1227852,"['mp-1227852', 'mp-1389128', 'mp-1734188', 'mp-1805149', 'mp-1621737']",1.9113509,"{'Ba': 1.0, 'La': 1.0, 'Ti': 1.0, 'Cu': 1.0, 'O': 6.0}",125.51298752546604,[],FM,True,216,1,"[0.0, 0.0, 0.0, 0.9, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0152283117283954,1.9113509,1,1.9113509,MP,data/source/MP/cleaned/cifs/MP-mp-1227852.cif,True,,data/final/MP/graphs/Al0.3Ba2Cu2La2Ti1.7O10.86-MP-mp-1227852-synth_doped.json,0,True,-43m,5,0,0,0,0,0,0,0,0,0,1,1.0,False
C1Fe0.025Mg1Ni2.975,2,0.0099999999999999,1.0,True,C1Fe0.025Mg1Ni2.975,C1Mg1Ni3,5.17,Other,True,C20Fe0.5Mg20Ni59.5,C-Fe-Mg-Ni,4,Supercon,Mg1C1Ni2.975Fe0.025,MP-mp-10700,Mg1Ni3C1,C-Mg-Ni,C20Mg20Ni60,P m -3 m,cubic,3.810209,3.810209,3.810209,data/final/MP/cifs/C1Fe0.025Mg1Ni2.975-MP-mp-10700-synth_doped.cif,data/source/MP/raw/cifs/mp-10700.cif,mp-10700,0.0,,2011-05-28 10:04:44,6.376007671789427,10.17188/1187303,"@misc{osti_1187303,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MgNi3C (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187303"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678621'}},0.0,6.64260176,520.0,-28.85099542,-5.770199084,{'tags': ['Magnesium nickel carbide (1/3/1)']},-28.85099542,-5.770199084,-0.1367049259999994,"['xas', 'elasticity', 'bandstructure']",True,[77152],True,2021-05-12 10:56:10.715000,NM,5,8,mp-10700,,MgNi3C,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Ni_pv', 'C'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",GGA,mp-10700,"['mp-927245', 'mp-927653', 'mp-911184', 'mp-10700', 'mp-1438083', 'mp-1678621', 'mp-1791467', 'mp-1591421']",0.0387875,"{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",55.31544309398296,[],NM,False,221,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",0.0007012056277683,0.0387875,0,0.0387875,MP,data/source/MP/cleaned/cifs/MP-mp-10700.cif,True,,data/final/MP/graphs/C1Fe0.025Mg1Ni2.975-MP-mp-10700-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Cr0.82Ir0.18,3,0.1399999999999999,8.0,False,Cr6.56Ir1.44,Cr6Ir2,0.75,Other,True,Cr82Ir18,Cr-Ir,2,Supercon,Cr0.82Ir0.18,MP-mp-1609,Cr6Ir2,Cr-Ir,Cr75Ir25,P m -3 n,cubic,4.649853,4.649853,4.649853,data/final/MP/cifs/Cr0.82Ir0.18-MP-mp-1609-synth_doped.cif,data/source/MP/raw/cifs/mp-1609.cif,mp-1609,0.0,,2011-05-14 06:37:35,11.502620729111474,10.17188/1191557,"@misc{osti_1191557,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Cr3Ir (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191557"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700096'}},0.0183214725000002,7.78335882,520.0,-76.09006936,-9.51125867,{'tags': ['Chromium iridium (3/1)']},-76.09006936,-9.51125867,-0.0618654625000001,"['xas', 'elasticity', 'bandstructure']",True,"[102780, 102779]",True,2021-05-12 10:56:12.755000,NM,8,8,mp-1609,,Cr3Ir,"{'functional': 'PBE', 'labels': ['Cr_pv', 'Ir'], 'pot_type': 'paw'}","{'Cr': 3.0, 'Ir': 1.0}",GGA,mp-1609,"['mp-912358', 'mp-928869', 'mp-928340', 'mp-1609', 'mp-1414364', 'mp-1700096', 'mp-1797142', 'mp-1590447']",0.005854,"{'Cr': 6.0, 'Ir': 2.0}",100.5350897789424,[],NM,False,223,0,"[-0.0, -0.0, -0.0, -0.0, -0.0, -0.0, 0.0, 0.0]",0.0001164568512918,0.005854,0,0.011708,MP,data/source/MP/cleaned/cifs/MP-mp-1609.cif,True,,data/final/MP/graphs/Cr0.82Ir0.18-MP-mp-1609-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
La0.48Y0.52,2,0.04,4.0,False,La1.92Y2.08,La2Y2,1.0,Other,True,La48Y52,La-Y,2,Supercon,La0.48Y0.52,MP-mp-1222741,La2Y2,La-Y,La50Y50,P 63/m m c,hexagonal,3.6760980005898656,3.67609778,11.912622,data/final/MP/cifs/La0.48Y0.52-MP-mp-1222741-synth_doped.cif,data/source/MP/raw/cifs/mp-1222741.cif,mp-1222741,0.0,,2019-01-12 23:14:02.199000,5.426780728814685,,,{'GGA': {'task_id': 'mp-1761312'}},0.0388361416666658,5.67618061,520.0,-22.64961187,-5.6624029675,{'tags': []},-22.64961187,-5.6624029675,0.0388361416666658,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,4,5,mp-1222741,,LaY,"{'functional': 'PBE', 'labels': ['La', 'Y_sv'], 'pot_type': 'paw'}","{'La': 1.0, 'Y': 1.0}",GGA,mp-1222741,"['mp-1222741', 'mp-1404821', 'mp-1761312', 'mp-1867766', 'mp-1626047']",0.0267894,"{'La': 2.0, 'Y': 2.0}",139.41583991595687,[],NM,False,194,0,"[0, 0, 0, 0]",0.0003843092724061,0.0267894,0,0.0535788,MP,data/source/MP/cleaned/cifs/MP-mp-1222741.cif,True,,data/final/MP/graphs/La0.48Y0.52-MP-mp-1222741-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Nb3Pb0.15Sn0.85,3,0.075,2.0,False,Nb6Pb0.3Sn1.7,Nb6Sn2,18.2,Other,True,Nb75Pb3.75Sn21.25,Nb-Pb-Sn,3,Supercon,Nb3Pb0.15Sn0.85,MP-mp-1326,Nb6Sn2,Nb-Sn,Nb75Sn25,P m -3 n,cubic,5.334611,5.334611,5.334611,data/final/MP/cifs/Nb3Pb0.15Sn0.85-MP-mp-1326-synth_doped.cif,data/source/MP/raw/cifs/mp-1326.cif,mp-1326,0.0,,2011-05-14 09:51:48,8.694218121896231,10.17188/1189484,"@misc{osti_1189484,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Sn (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189484"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668415'}},0.0,6.59372491,520.0,-69.93787048,-8.74223381,{'tags': ['Niobium tin (3/1)']},-69.93787048,-8.74223381,-0.163862066250001,"['xas', 'elasticity', 'bandstructure']",True,"[105230, 645503, 645489, 105231, 645498, 645485, 645474, 645496, 645480, 645488, 645482, 645487, 645500, 645493, 645477, 645484, 645502, 645483, 150878, 645479, 645481, 645486, 645473]",True,2021-05-12 10:56:12.755000,NM,8,9,mp-1326,,Nb3Sn,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Sn_d'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Sn': 1.0}",GGA,mp-1326,"['mp-930046', 'mp-913770', 'mp-930577', 'mp-1326', 'mp-1440651', 'mp-1668415', 'mp-1880085', 'mp-1594093', 'mp-1594507']",0.62023085,"{'Nb': 6.0, 'Sn': 2.0}",151.81275738025872,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0081709977567491,0.62023085,0,1.2404617,MP,data/source/MP/cleaned/cifs/MP-mp-1326.cif,True,,data/final/MP/graphs/Nb3Pb0.15Sn0.85-MP-mp-1326-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Fe1Te0.92,2,0.0416666666666666,2.0,False,Fe2Te1.84,Fe2Te2,0.0,Ferrite,True,Fe52.083Te47.917,Fe-Te,2,Supercon,Fe1Te0.92,MP-mp-21273,Fe2Te2,Fe-Te,Fe50Te50,P 4/n m m,tetragonal,3.65601,3.65601,6.514508,data/final/MP/cifs/Fe1Te0.92-MP-mp-21273-synth_doped.cif,data/source/MP/raw/cifs/mp-21273.cif,mp-21273,0.0,,2015-11-26 15:42:53,6.996625048410066,10.17188/1196541,"@misc{osti_1196541,
    author = ""Persson, Kristin"",
    title = ""Materials Data on FeTe (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196541"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687548'}},0.0764545287500002,6.29104431,520.0,-23.46280856,-5.86570214,"{'tags': ['Iron telluride', 'Iron telluride - beta', 'Iron telluride (1/1)']}",-23.46280856,-5.86570214,-0.2700474499999998,"['xas', 'elasticity', 'bandstructure']",True,"[44753, 633877, 180602, 169974]",True,2021-05-12 10:56:16.728000,FM,4,9,mp-21273,,FeTe,"{'functional': 'PBE', 'labels': ['Fe_pv', 'Te'], 'pot_type': 'paw'}","{'Fe': 1.0, 'Te': 1.0}",GGA,mp-21273,"['mp-991220', 'mp-987578', 'mp-992375', 'mp-21273', 'mp-1439792', 'mp-1687548', 'mp-1800961', 'mp-993959', 'mp-1596778']",1.99364605,"{'Fe': 2.0, 'Te': 2.0}",87.07557914416442,[],FM,True,129,1,"[2.0, 2.0, 0.0, 0.0]",0.0457911637130606,1.99364605,2,3.9872921,MP,data/source/MP/cleaned/cifs/MP-mp-21273.cif,True,,data/final/MP/graphs/Fe1Te0.92-MP-mp-21273-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ca1.9Cl2Cu1O2,2,0.0207039337474119,1.0,True,Ca1.9Cl2Cu1O2,Ca2Cl2Cu1O2,15.0,Cuprate,True,Ca27.536Cl28.986Cu14.493O28.98550724637681,Ca-Cl-Cu-O,4,Supercon,Ca1.9Cu1Cl2O2,MP-mp-23143,Ca2Cu1Cl2O2,Ca-Cl-Cu-O,Ca28.571Cl28.571Cu14.286O28.571428571428573,I 4/m m m,tetragonal,3.88024600076171,3.880246000761709,8.12907187,data/final/MP/cifs/Ca1.9Cl2Cu1O2-MP-mp-23143-synth_doped.cif,data/source/MP/raw/cifs/mp-23143.cif,mp-23143,0.0,,2014-02-21 09:50:06,3.554337150605878,10.17188/1199263,"@misc{osti_1199263,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ca2Cu(ClO)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199263"",
    place = ""United States"",
    year = ""2016"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700223'}},0.0191527683333321,4.19679796,520.0,-35.95348475,-5.136212107142858,"{'tags': ['Dicalcium copper dioxide dichloride', 'Dicalcium dichlorodioxocuprate']}",-35.95348475,-5.136212107142858,-2.407440427142858,"['xas', 'elasticity', 'bandstructure']",True,"[1027, 83117, 41581]",True,2021-05-12 10:56:16.728000,NM,7,8,mp-23143,oxide,Ca2Cu(ClO)2,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Cu_pv', 'Cl', 'O'], 'pot_type': 'paw'}","{'Ca': 2.0, 'Cu': 1.0, 'Cl': 2.0, 'O': 2.0}",GGA,mp-23143,"['mp-992231', 'mp-990553', 'mp-23143', 'mp-1436301', 'mp-1700223', 'mp-1803462', 'mp-993865', 'mp-1592909']",0.0134962,"{'Ca': 2.0, 'Cu': 1.0, 'Cl': 2.0, 'O': 2.0}",115.21141865211318,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001171429026557,0.0134962,0,0.0134962,MP,data/source/MP/cleaned/cifs/MP-mp-23143.cif,True,,data/final/MP/graphs/Ca1.9Cl2Cu1O2-MP-mp-23143-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Mo6Se8,1,0.0,1.0,True,Mo6Se8,Mo6Se8,6.255238095,Chevrel,True,Mo42.857Se57.143,Mo-Se,2,Supercon,Mo6Se8,MP-mp-21021,Mo6Se8,Mo-Se,Mo42.857Se57.143,R -3,trigonal,6.7534215,6.7534215,6.75342214,data/final/MP/cifs/Mo6Se8-MP-mp-21021.cif,data/source/MP/raw/cifs/mp-21021.cif,mp-21021,0.0,,2014-02-22 14:27:35,6.516933641366628,10.17188/1196264,"@misc{osti_1196264,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Mo3Se4 (SG:148) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196264"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677111'}},0.0608704235714308,4.33620381,520.0,-100.26563329,-7.161830949285714,"{'tags': ['Molybdenum selenide (3/4)', 'Molybdenum(II/III) selenide (3/4)']}",-100.26563329,-7.161830949285714,-0.785748806339285,"['xas', 'bandstructure']",True,"[644336, 600386, 644355, 16316, 654967, 603589, 644349]",True,2021-05-12 10:56:57.051000,NM,14,11,mp-21021,,Mo3Se4,"{'functional': 'PBE', 'labels': ['Mo_pv', 'Se'], 'pot_type': 'paw'}","{'Mo': 3.0, 'Se': 4.0}",GGA,mp-21021,"['mp-924175', 'mp-924970', 'mp-909151', 'mp-21021', 'mp-1103542', 'mp-1104094', 'mp-1105017', 'mp-1237198', 'mp-1381593', 'mp-1677111', 'mp-1600330']",9.54e-05,"{'Mo': 6.0, 'Se': 8.0}",307.6296516450482,[],NM,False,148,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.202262980167804e-07,9.54e-05,0,0.0001908,MP,data/source/MP/cleaned/cifs/MP-mp-21021.cif,False,,data/final/MP/graphs/Mo6Se8-MP-mp-21021.json,0,True,-3,0,0,0,0,0,0,2,1,0,0,0,1.0,False
Al1Th2,1,0.0,2.0,False,Al2Th4,Al2Th4,0.045,Other,True,Al33.333Th66.667,Al-Th,2,Supercon,Al1Th2,MP-mp-1651,Th4Al2,Al-Th,Al33.333Th66.667,I 4/m c m,tetragonal,5.719784001260375,6.14221423085353,6.14221423,data/final/MP/cifs/Al1Th2-MP-mp-1651.cif,data/source/MP/raw/cifs/mp-1651.cif,mp-1651,0.0,,2011-05-13 05:38:02,9.64953989169472,10.17188/1191962,"@misc{osti_1191962,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Th2Al (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191962"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701458'}},0.0,7.13306838,520.0,-38.51891458,-6.419819096666667,"{'tags': ['Thorium aluminide (2/1)', 'Aluminium thorium (1/2)', 'Thorium aluminium hydride (2/1/2.5)', 'Aluminum thorium (1/2)']}",-38.51891458,-6.419819096666667,-0.228721653333333,"['xas', 'elasticity', 'bandstructure']",True,"[608057, 609498, 609491, 609517, 609510, 58180]",True,2021-05-12 10:56:14.760000,NM,6,14,mp-1651,,Th2Al,"{'functional': 'PBE', 'labels': ['Th', 'Al'], 'pot_type': 'paw'}","{'Th': 2.0, 'Al': 1.0}",GGA,mp-1651,"['mp-928096', 'mp-928622', 'mp-912001', 'mp-1651', 'mp-1071562', 'mp-1071579', 'mp-1071608', 'mp-1077507', 'mp-1254460', 'mp-1441255', 'mp-1701458', 'mp-1835099', 'mp-1593045', 'mp-1071607']",0.0006176,"{'Th': 4.0, 'Al': 2.0}",169.00711022714177,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0]",7.308568251003872e-06,0.0006176,0,0.0012352,MP,data/source/MP/cleaned/cifs/MP-mp-1651.cif,False,,data/final/MP/graphs/Al1Th2-MP-mp-1651.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As1.792Ba1Ni2P0.208,3,0.0831999999999999,1.0,True,As1.792Ba1Ni2P0.208,As2Ba1Ni2,3.24,Ferrite,True,As35.84Ba20Ni40P4.16,As-Ba-Ni-P,4,Supercon,Ba1Ni2As1.792P0.208,MP-mp-568280,Ba1Ni2As2,As-Ba-Ni,As40Ba20Ni40,I 4/m m m,tetragonal,4.156554001148825,4.156554001148825,6.57789079,data/final/MP/cifs/As1.792Ba1Ni2P0.208-MP-mp-568280-synth_doped.cif,data/source/MP/raw/cifs/mp-568280.cif,mp-568280,0.0,,2014-02-16 06:02:25,6.607461026403792,10.17188/1274340,"@misc{osti_1274340,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba(NiAs)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1274340"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698065'}},0.0,5.18272169,520.0,-26.07345637,-5.214691274,"{'tags': ['Barium nickel arsenide (1/2/2)', 'Barium dinickel diarsenide']}",-26.07345637,-5.214691274,-0.6551950740000002,"['xas', 'elasticity', 'bandstructure']",True,"[185463, 609856, 164197]",True,2021-05-12 10:56:22.739000,NM,5,10,mp-568280,,Ba(NiAs)2,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ni_pv', 'As'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Ni': 2.0, 'As': 2.0}",GGA,mp-568280,"['mp-568280', 'mp-1069503', 'mp-1069542', 'mp-1069572', 'mp-1441346', 'mp-1698065', 'mp-1795849', 'mp-1923070', 'mp-1595137', 'mp-1069566']",0.0042893,"{'Ba': 1.0, 'Ni': 2.0, 'As': 2.0}",101.67032396892152,[],NM,False,139,0,"[0, 0, 0, 0, 0]",4.218831840558656e-05,0.0042893,0,0.0042893,MP,data/source/MP/cleaned/cifs/MP-mp-568280.cif,True,,data/final/MP/graphs/As1.792Ba1Ni2P0.208-MP-mp-568280-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ir4Si10Yb5,1,0.0,2.0,False,Ir8Si20Yb10,Ir8Si20Yb10,0.0,Heavy_fermion,True,Ir21.053Si52.632Yb26.316,Ir-Si-Yb,3,Supercon,Yb5Ir4Si10,MP-mp-1207588,Yb10Si20Ir8,Ir-Si-Yb,Ir21.053Si52.632Yb26.316,P 4/m b m,tetragonal,4.301544,12.620698,12.620698,data/final/MP/cifs/Ir4Si10Yb5-MP-mp-1207588.cif,data/source/MP/raw/cifs/mp-1207588.cif,mp-1207588,0.0,,2019-01-12 10:40:06.941000,9.281951390175529,,,,0.0,6.04537795,520.0,-220.59012437,-5.805003272894737,"{'tags': ['Yb5Ir4Si10 lt', 'Sc5Co4Si10']}",-220.59012437,-5.805003272894737,-0.6463241528947372,[],False,[],True,2021-05-12 11:00:19.396000,NM,38,2,mp-1207588,,Yb5(Si5Ir2)2,"{'functional': 'PBE', 'labels': ['Yb_2', 'Si', 'Ir'], 'pot_type': 'paw'}","{'Yb': 5.0, 'Si': 10.0, 'Ir': 4.0}",GGA,mp-1207588,"['mp-1207588', 'mp-1379309']",0.0030237,"{'Yb': 10.0, 'Si': 20.0, 'Ir': 8.0}",685.1586088667804,[],NM,False,127,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",8.826277480483111e-06,0.0030237,0,0.0060474,MP,data/source/MP/cleaned/cifs/MP-mp-1207588.cif,False,,data/final/MP/graphs/Ir4Si10Yb5-MP-mp-1207588.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ir0.75Mo0.25,1,0.0,8.0,False,Ir6Mo2,Ir6Mo2,0.13,Other,True,Ir75Mo25,Ir-Mo,2,Supercon,Ir0.75Mo0.25,MP-mp-11482,Mo2Ir6,Ir-Mo,Ir75Mo25,P 63/m m c,hexagonal,4.423083,5.546684001093023,5.54668465,data/final/MP/cifs/Ir0.75Mo0.25-MP-mp-11482.cif,data/source/MP/raw/cifs/mp-11482.cif,mp-11482,0.0,,2011-05-29 09:22:08,18.95428940976868,10.17188/1187875,"@misc{osti_1187875,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MoIr3 (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187875"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700599'}},0.0,9.7847681,520.0,-77.45417496,-9.68177187,{'tags': ['Iridium molybdenum (3/1) - HT']},-77.45417496,-9.68177187,-0.3415382975000014,"['xas', 'elasticity', 'bandstructure']",True,[104506],True,2021-05-12 10:56:12.755000,NM,8,8,mp-11482,,MoIr3,"{'functional': 'PBE', 'labels': ['Mo_pv', 'Ir'], 'pot_type': 'paw'}","{'Mo': 1.0, 'Ir': 3.0}",GGA,mp-11482,"['mp-929010', 'mp-912589', 'mp-929388', 'mp-11482', 'mp-1432173', 'mp-1700599', 'mp-1804366', 'mp-1596011']",2.88e-05,"{'Mo': 2.0, 'Ir': 6.0}",117.84811418653877,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",4.88764715477979e-07,2.88e-05,0,5.76e-05,MP,data/source/MP/cleaned/cifs/MP-mp-11482.cif,False,,data/final/MP/graphs/Ir0.75Mo0.25-MP-mp-11482.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Al2Os1,1,0.0,1.0,True,Al2Os1,Al2Os1,0.0,Other,True,Al66.667Os33.333,Al-Os,2,Supercon,Al2Os1,MP-mp-7188,Al2Os1,Al-Os,Al66.667Os33.333,I 4/m m m,tetragonal,3.1838079989825228,3.1838079989825228,4.7370304,data/final/MP/cifs/Al2Os1-MP-mp-7188.cif,data/source/MP/raw/cifs/mp-7188.cif,mp-7188,0.3106000000000009,,2011-05-27 16:38:41,9.597862886389052,10.17188/1287101,"@misc{osti_1287101,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Al2Os (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1287101"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-662842'}},0.0,9.05033514,520.0,-20.40479948,-6.801599826666667,{'tags': ['Aluminium osmium (2/1)']},-20.40479948,-6.801599826666667,-0.5620938550000005,"['diel', 'bandstructure', 'elasticity', 'phonons']",True,[58108],True,2021-05-12 10:56:29.056000,NM,3,9,mp-7188,,Al2Os,"{'functional': 'PBE', 'labels': ['Al', 'Os_pv'], 'pot_type': 'paw'}","{'Al': 2.0, 'Os': 1.0}",GGA,mp-7188,"['mp-662842', 'mp-7188', 'mp-658200', 'mp-678015', 'mp-1141925', 'mp-1251514', 'mp-1437952', 'mp-1794211', 'mp-1591652']",6e-06,"{'Al': 2.0, 'Os': 1.0}",42.24817016910164,[],NM,False,139,0,"[0, 0, 0]",1.420179850626554e-07,6e-06,0,6e-06,MP,data/source/MP/cleaned/cifs/MP-mp-7188.cif,False,,data/final/MP/graphs/Al2Os1-MP-mp-7188.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As2Ba0.5Cu0.1Fe1.9K0.5,2,0.04,2.0,False,As4Ba1Cu0.2Fe3.8K1,As4Ba1Fe4K1,22.29,Ferrite,True,As40Ba10Cu2Fe38K10,As-Ba-Cu-Fe-K,5,Supercon,Ba0.5K0.5Fe1.9Cu0.1As2,MP-mp-1223517,K1Ba1Fe4As4,As-Ba-Fe-K,As40Ba10Fe40K10,C m m m,orthorhombic,5.479027,5.480024002658328,7.13170472,data/final/MP/cifs/As2Ba0.5Cu0.1Fe1.9K0.5-MP-mp-1223517-synth_doped.cif,data/source/MP/raw/cifs/mp-1223517.cif,mp-1223517,0.0,,2019-01-12 23:54:03.876000,5.87534599912672,,,{'GGA': {'task_id': 'mp-1743010'}},0.0132513644999994,4.21185628,520.0,-59.66633886,-5.966633886,{'tags': []},-59.66633886,-5.966633886,-0.4120461663000007,[],False,[],True,2021-05-12 11:00:52.054000,FM,10,4,mp-1223517,,KBa(FeAs)4,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",GGA,mp-1223517,"['mp-1223517', 'mp-1396881', 'mp-1743010', 'mp-1827585']",0.9947188,"{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",197.6961518155852,[],FM,True,65,1,"[0.0, 0.0, 0.3, 0.3, 0.3, 0.3, 0.0, 0.0, 0.0, 0.0]",0.0050315536790412,0.9947188,4,0.9947188,MP,data/source/MP/cleaned/cifs/MP-mp-1223517.cif,True,,data/final/MP/graphs/As2Ba0.5Cu0.1Fe1.9K0.5-MP-mp-1223517-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Al1Nb2.85Ta0.15,3,0.0749999999999999,2.0,False,Al2Nb5.7Ta0.3,Al2Nb6,16.8,Other,True,Al25Nb71.25Ta3.75,Al-Nb-Ta,3,Supercon,Nb2.85Ta0.15Al1,MP-mp-796,Nb6Al2,Al-Nb,Al25Nb75,P m -3 n,cubic,5.215254,5.215254,5.215254,data/final/MP/cifs/Al1Nb2.85Ta0.15-MP-mp-796-synth_doped.cif,data/source/MP/raw/cifs/mp-796.cif,mp-796,0.0,,2011-05-13 16:07:37,7.157298025966356,,,{'GGA': {'task_id': 'mp-1686893'}},0.0460773865000003,5.52947534,520.0,-69.48918494,-8.6861481175,"{'tags': ['Aluminium niobium (1/3)', 'Niobium aluminide (3/1)', 'Aluminum niobium (1/3)']}",-69.48918494,-8.6861481175,-0.1737753800000003,"['bandstructure', 'elasticity']",True,"[608675, 608654, 608688, 608668, 608669, 608685, 608676, 608683, 58014, 608657, 107856, 608655, 608666, 608691, 608656, 608665, 608673, 608653, 608661]",True,2021-05-12 10:56:31.128000,NM,8,10,mp-796,,Nb3Al,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Al': 1.0}",GGA,mp-796,"['mp-911586', 'mp-927906', 'mp-796', 'mp-927472', 'mp-1260512', 'mp-1440919', 'mp-1686893', 'mp-1927652', 'mp-1591599', 'mp-1587739']",0.16323955,"{'Nb': 6.0, 'Al': 2.0}",141.8490379078192,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0023015954483396,0.16323955,0,0.3264791,MP,data/source/MP/cleaned/cifs/MP-mp-796.cif,True,,data/final/MP/graphs/Al1Nb2.85Ta0.15-MP-mp-796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ca1Si2.2,2,0.0416666666666667,1.818090909090909,False,Ca1.818Si4,Ca2Si4,1.37,Other,True,Ca31.25Si68.75,Ca-Si,2,Supercon,Ca1Si2.2,MP-mp-2699,Ca2Si4,Ca-Si,Ca33.333Si66.667,R -3 m,trigonal,3.874918263669661,3.874918263669661,10.37733386,data/final/MP/cifs/Ca1Si2.2-MP-mp-2699-synth_doped.cif,data/source/MP/raw/cifs/mp-2699.cif,mp-2699,0.0,,2011-05-12 22:51:54,2.4258733436285653,10.17188/1201272,"@misc{osti_1201272,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CaSi2 (SG:166) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201272"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688005'}},0.0102373316666648,5.60741277,520.0,-27.94690228,-4.657817046666667,"{'tags': ['Calcium silicide (1/2)', 'Calcium silicion (1/2)', 'Calcium silicide (1/2) - NP', 'High pressure experimental phase']}",-27.94690228,-4.657817046666667,-0.3250744066666667,"['xas', 'elasticity', 'bandstructure']",True,"[32006, 154431, 248515, 248517, 619593, 52789, 248516, 248518]",True,2021-05-12 10:56:18.721000,NM,6,20,mp-2699,,CaSi2,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Si'], 'pot_type': 'paw'}","{'Ca': 1.0, 'Si': 2.0}",GGA,mp-2699,"['mp-905805', 'mp-919797', 'mp-918806', 'mp-2699', 'mp-1072583', 'mp-1072609', 'mp-1072590', 'mp-1072614', 'mp-1072565', 'mp-1072635', 'mp-1077162', 'mp-1077281', 'mp-1138708', 'mp-1145615', 'mp-1439574', 'mp-1688005', 'mp-1788415', 'mp-1590320', 'mp-1072626', 'mp-1072608']",0.000103,"{'Ca': 2.0, 'Si': 4.0}",131.76716339371657,[],NM,False,166,0,"[0, 0, 0, 0, 0, 0]",1.5633636992281435e-06,0.000103,0,0.000206,MP,data/source/MP/cleaned/cifs/MP-mp-2699.cif,True,,data/final/MP/graphs/Ca1Si2.2-MP-mp-2699-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ga0.1Sn0.9V3,2,0.0499999999999999,2.0,False,Ga0.2Sn1.8V6,Sn2V6,3.8,Other,True,Ga2.5Sn22.5V75,Ga-Sn-V,3,Supercon,V3Ga0.1Sn0.9,MP-mp-21342,V6Sn2,Sn-V,Sn25V75,P m -3 n,cubic,4.964966,4.964966,4.964966,data/final/MP/cifs/Ga0.1Sn0.9V3-MP-mp-21342-synth_doped.cif,data/source/MP/raw/cifs/mp-21342.cif,mp-21342,0.0,,2014-02-22 08:04:37,7.368095966501239,10.17188/1196758,"@misc{osti_1196758,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Sn (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196758"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702465'}},0.0,7.68691019,520.0,-63.04343383,-7.88042922875,{'tags': ['Tin vanadium (1/3)']},-63.04343383,-7.88042922875,-0.0651067124999995,"['xas', 'elasticity', 'bandstructure']",True,"[106097, 652826, 652827, 652825, 652830, 652831, 652824]",True,2021-05-12 10:56:16.728000,FM,8,8,mp-21342,,V3Sn,"{'functional': 'PBE', 'labels': ['V_pv', 'Sn_d'], 'pot_type': 'paw'}","{'V': 3.0, 'Sn': 1.0}",GGA,mp-21342,"['mp-942096', 'mp-932834', 'mp-943109', 'mp-21342', 'mp-1441571', 'mp-1702465', 'mp-1803347', 'mp-1596265']",0.7034491,"{'V': 6.0, 'Sn': 2.0}",122.3908177172686,[],FM,True,223,1,"[0.2, 0.2, 0.2, 0.2, 0.2, 0.2, 0.0, 0.0]",0.0114951286889024,0.7034491,6,1.4068982,MP,data/source/MP/cleaned/cifs/MP-mp-21342.cif,True,,data/final/MP/graphs/Ga0.1Sn0.9V3-MP-mp-21342-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ca1.89Cl2Cu1Na0.11O2,2,0.0314285714285714,1.0,True,Ca1.89Cl2Cu1Na0.11O2,Ca2Cl2Cu1O2,15.14,Cuprate,True,Ca27Cl28.571Cu14.286Na1.571O28.571428571428573,Ca-Cl-Cu-Na-O,5,Supercon,Ca1.89Na0.11Cu1Cl2O2,MP-mp-23143,Ca2Cu1Cl2O2,Ca-Cl-Cu-O,Ca28.571Cl28.571Cu14.286O28.571428571428573,I 4/m m m,tetragonal,3.88024600076171,3.880246000761709,8.12907187,data/final/MP/cifs/Ca1.89Cl2Cu1Na0.11O2-MP-mp-23143-synth_doped.cif,data/source/MP/raw/cifs/mp-23143.cif,mp-23143,0.0,,2014-02-21 09:50:06,3.554337150605878,10.17188/1199263,"@misc{osti_1199263,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ca2Cu(ClO)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199263"",
    place = ""United States"",
    year = ""2016"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700223'}},0.0191527683333321,4.19679796,520.0,-35.95348475,-5.136212107142858,"{'tags': ['Dicalcium copper dioxide dichloride', 'Dicalcium dichlorodioxocuprate']}",-35.95348475,-5.136212107142858,-2.407440427142858,"['xas', 'elasticity', 'bandstructure']",True,"[1027, 83117, 41581]",True,2021-05-12 10:56:16.728000,NM,7,8,mp-23143,oxide,Ca2Cu(ClO)2,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Cu_pv', 'Cl', 'O'], 'pot_type': 'paw'}","{'Ca': 2.0, 'Cu': 1.0, 'Cl': 2.0, 'O': 2.0}",GGA,mp-23143,"['mp-992231', 'mp-990553', 'mp-23143', 'mp-1436301', 'mp-1700223', 'mp-1803462', 'mp-993865', 'mp-1592909']",0.0134962,"{'Ca': 2.0, 'Cu': 1.0, 'Cl': 2.0, 'O': 2.0}",115.21141865211318,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001171429026557,0.0134962,0,0.0134962,MP,data/source/MP/cleaned/cifs/MP-mp-23143.cif,True,,data/final/MP/graphs/Ca1.89Cl2Cu1Na0.11O2-MP-mp-23143-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B2C1Gd0.13Lu0.87Ni2,2,0.0433333333333333,1.0,True,B2C1Gd0.13Lu0.87Ni2,B2C1Lu1Ni2,9.715,Other,True,B33.333C16.667Gd2.167Lu14.5Ni33.333,B-C-Gd-Lu-Ni,5,Supercon,Lu0.87Gd0.13Ni2B2C1,MP-mp-6544,Lu1Ni2B2C1,B-C-Lu-Ni,B33.333C16.667Lu16.667Ni33.333,I 4/m m m,tetragonal,3.4660159989239463,3.4660159989239463,5.81490896,data/final/MP/cifs/B2C1Gd0.13Lu0.87Ni2-MP-mp-6544-synth_doped.cif,data/source/MP/raw/cifs/mp-6544.cif,mp-6544,0.0,,2011-05-13 04:17:06,8.54504130524706,10.17188/1281287,"@misc{osti_1281287,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LuNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281287"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702891'}},0.0,6.71335166,520.0,-41.78223818,-6.963706363333333,{'tags': []},-41.78223818,-6.963706363333333,-0.5192416763888884,"['xas', 'bandstructure']",True,"[75609, 83230, 79564]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6544,,LuNi2B2C,"{'functional': 'PBE', 'labels': ['Lu_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Lu': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6544,"['mp-1000584', 'mp-1007055', 'mp-6544', 'mp-1441469', 'mp-1702891', 'mp-1783160', 'mp-1011794', 'mp-1588498']",0.0023161,"{'Lu': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",63.34823894903922,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",3.656139520884231e-05,0.0023161,0,0.0023161,MP,data/source/MP/cleaned/cifs/MP-mp-6544.cif,True,,data/final/MP/graphs/B2C1Gd0.13Lu0.87Ni2-MP-mp-6544-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Pb1Pd2Tb1,1,0.0,1.0,True,Pb1Pd2Tb1,Pb1Pd2Tb1,0.0,Other,True,Pb25Pd50Tb25,Pb-Pd-Tb,3,Supercon,Pd2Tb1Pb1,MP-mp-1206368,Tb1Pd2Pb1,Pb-Pd-Tb,Pb25Pd50Tb25,F m -3 m,cubic,4.889963,4.889963,4.889963,data/final/MP/cifs/Pb1Pd2Tb1-MP-mp-1206368.cif,data/source/MP/raw/cifs/mp-1206368.cif,mp-1206368,0.0,,2019-01-12 09:41:36.827000,11.627864113980554,,,{'GGA': {'task_id': 'mp-1768273'}},0.0066303443749973,5.93879649,520.0,-21.49805395,-5.3745134875,"{'tags': ['b.c.c. atom arrangement', 'Cu2MnAl', 'TbPd2Pb']}",-21.49805395,-5.3745134875,-0.69781929,['bandstructure'],True,[],True,2021-05-12 10:58:37.524000,NM,4,5,mp-1206368,,TbPd2Pb,"{'functional': 'PBE', 'labels': ['Tb_3', 'Pd', 'Pb_d'], 'pot_type': 'paw'}","{'Tb': 1.0, 'Pd': 2.0, 'Pb': 1.0}",GGA,mp-1206368,"['mp-1206368', 'mp-1425447', 'mp-1768273', 'mp-1801797', 'mp-1617238']",0.0001549,"{'Tb': 1.0, 'Pd': 2.0, 'Pb': 1.0}",82.68023881761971,[],NM,False,225,0,"[0, 0, 0, 0]",1.8734827355988448e-06,0.0001549,0,0.0001549,MP,data/source/MP/cleaned/cifs/MP-mp-1206368.cif,False,,data/final/MP/graphs/Pb1Pd2Tb1-MP-mp-1206368.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Cu3Dy1Pb2Sr2O8,1,0.0,1.0,True,Cu3Dy1Pb2Sr2O8,Cu3Dy1Pb2Sr2O8,76.5,Cuprate,True,Cu18.75Dy6.25Pb12.5Sr12.5O50,Cu-Dy-Pb-Sr-O,5,Supercon,Pb2Sr2Dy1Cu3O8,MP-mp-22301,Sr2Dy1Cu3Pb2O8,Cu-Dy-Pb-Sr-O,Cu18.75Dy6.25Pb12.5Sr12.5O50,P 4/m m m,tetragonal,3.833965,3.833965,16.030814,data/final/MP/cifs/Cu3Dy1Pb2Sr2O8-MP-mp-22301.cif,data/source/MP/raw/cifs/mp-22301.cif,mp-22301,0.0,,2014-02-22 22:13:38,7.545616474886166,10.17188/1197535,"@misc{osti_1197535,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr2DyCu3(PbO4)2 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197535"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671617'}},0.0262304792871095,4.73773355,520.0,-94.88323484,-5.9302021775,{'tags': ['Lead strontium dysprosium copper oxide (2/2/1/3/8)']},-94.88323484,-5.9302021775,-2.0679286814583326,"['xas', 'bandstructure']",True,[71483],True,2021-05-12 10:56:59.077000,NM,16,8,mp-22301,oxide,Sr2DyCu3(PbO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Dy_3', 'Cu_pv', 'Pb_d', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Dy': 1.0, 'Cu': 3.0, 'Pb': 2.0, 'O': 8.0}",GGA,mp-22301,"['mp-916305', 'mp-932704', 'mp-931636', 'mp-22301', 'mp-1429980', 'mp-1671617', 'mp-1928260', 'mp-1600163']",0.0044132,"{'Sr': 2.0, 'Dy': 1.0, 'Cu': 3.0, 'Pb': 2.0, 'O': 8.0}",235.6415457883604,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.872844614575598e-05,0.0044132,0,0.0044132,MP,data/source/MP/cleaned/cifs/MP-mp-22301.cif,False,,data/final/MP/graphs/Cu3Dy1Pb2Sr2O8-MP-mp-22301.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Rh0.33Zr0.67,2,0.0066666666666667,6.0,False,Rh1.98Zr4.02,Rh2Zr4,11.25,Other,True,Rh33Zr67,Rh-Zr,2,Supercon,Rh0.33Zr0.67,MP-mp-571664,Zr4Rh2,Rh-Zr,Rh33.333Zr66.667,I 4/m c m,tetragonal,5.424551640917728,5.42455164,5.424551640000001,data/final/MP/cifs/Rh0.33Zr0.67-MP-mp-571664-synth_doped.cif,data/source/MP/raw/cifs/mp-571664.cif,mp-571664,0.0,,2014-02-16 05:17:29,7.817083063733077,10.17188/1276382,"@misc{osti_1276382,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Zr2Rh (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1276382"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704186'}},0.0,4.85143713,520.0,-52.2156124,-8.702602066666666,"{'tags': ['Rhodium zirconium hydride (1/2/4)', 'Rhodium zirconium (1/2)']}",-52.2156124,-8.702602066666666,-0.5493656899999996,"['xas', 'elasticity', 'bandstructure']",True,"[650562, 658071, 102807, 650557]",True,2021-05-12 10:56:27.046000,NM,6,17,mp-571664,,Zr2Rh,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Rh_pv'], 'pot_type': 'paw'}","{'Zr': 2.0, 'Rh': 1.0}",GGA,mp-571664,"['mp-941245', 'mp-934770', 'mp-941545', 'mp-571664', 'mp-1071440', 'mp-1071460', 'mp-1071500', 'mp-1072883', 'mp-1072945', 'mp-1072899', 'mp-1077561', 'mp-1441114', 'mp-1704186', 'mp-1802450', 'mp-1595340', 'mp-1071495', 'mp-1072938']",0.01533035,"{'Zr': 4.0, 'Rh': 2.0}",121.23208380358663,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0]",0.0002529091230476,0.01533035,0,0.0306607,MP,data/source/MP/cleaned/cifs/MP-mp-571664.cif,True,,data/final/MP/graphs/Rh0.33Zr0.67-MP-mp-571664-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Fe1Se0.82,3,0.0989010989010989,2.0,False,Fe2Se1.64,Fe2Se2,7.83,Ferrite,True,Fe54.945Se45.055,Fe-Se,2,Supercon,Fe1Se0.82,MP-mp-20311,Fe2Se2,Fe-Se,Fe50Se50,P 4/n m m,tetragonal,3.688905,3.688905,5.854194,data/final/MP/cifs/Fe1Se0.82-MP-mp-20311-synth_doped.cif,data/source/MP/raw/cifs/mp-20311.cif,mp-20311,0.0,,2013-10-20 07:09:24,5.619828229873189,10.17188/1195438,"@misc{osti_1195438,
    author = ""Persson, Kristin"",
    title = ""Materials Data on FeSe (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195438"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668877'}},0.0,3.48880228,520.0,-25.01949237,-6.2548730925,"{'tags': ['Iron selenide - NN AFM', 'Iron selenide - orthorhombic, LT', 'Iron selenide', 'Iron sulfide', 'Iron selenide (1/1) - nonmagnetic', 'Iron selenide - tetragonal', 'Iron selenide - alpha LT', 'Iron selenide - LT', 'High pressure experimental phase', 'Iron selenide - alpha']}",-25.01949237,-6.2548730925,-0.5079131286718743,"['xas', 'elasticity', 'bandstructure']",True,"[196301, 196298, 196299, 196297, 290701, 165958, 185464, 163561, 169257, 163560, 977900, 169311, 169303, 26889, 166440, 162901, 169283, 165957, 169271, 977903, 169259, 977901, 185465, 165959, 169306, 169267, 163557, 169287, 169297, 169289, 163556, 169299, 163562, 166441, 182544, 163559, 169269, 169263, 169265, 169315, 169255, 166439, 169293, 169313, 163555, 169291, 169301, 165960, 169253, 169295, 169970, 163558, 169285, 169261, 169309]",True,2021-05-12 10:56:14.760000,NM,4,55,mp-20311,,FeSe,"{'functional': 'PBE', 'labels': ['Fe_pv', 'Se'], 'pot_type': 'paw'}","{'Fe': 1.0, 'Se': 1.0}",GGA,mp-20311,"['mp-684656', 'mp-20311', 'mp-1063646', 'mp-1063662', 'mp-1063681', 'mp-1063669', 'mp-1063680', 'mp-1063695', 'mp-1063686', 'mp-1063699', 'mp-1063715', 'mp-1063717', 'mp-1063876', 'mp-1063734', 'mp-1063891', 'mp-1063735', 'mp-1063910', 'mp-1063918', 'mp-1063922', 'mp-1063931', 'mp-1063774', 'mp-1063781', 'mp-1064091', 'mp-1064111', 'mp-1063801', 'mp-1064112', 'mp-1064180', 'mp-1064138', 'mp-1064153', 'mp-1065102', 'mp-1065123', 'mp-1065075', 'mp-1065161', 'mp-1065131', 'mp-1065030', 'mp-1065055', 'mp-1065085', 'mp-1065094', 'mp-1440814', 'mp-1668877', 'mp-1799618', 'mp-1593782', 'mp-1592730', 'mp-1065081', 'mp-1065148', 'mp-1063928', 'mp-1063726', 'mp-1063683', 'mp-1063709', 'mp-1063911', 'mp-1063795', 'mp-1065121', 'mp-1063725', 'mp-1064139', 'mp-1064165']",3.455e-05,"{'Fe': 2.0, 'Se': 2.0}",79.66398961559156,[],NM,False,129,0,"[0, 0, 0, 0]",8.673931638803586e-07,3.455e-05,0,6.91e-05,MP,data/source/MP/cleaned/cifs/MP-mp-20311.cif,True,,data/final/MP/graphs/Fe1Se0.82-MP-mp-20311-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ba2Cu3Gd0.3Pr0.7O7,3,0.0461538461538461,1.0,True,Ba2Cu3Gd0.3Pr0.7O7,Ba2Cu3Pr1O7,0.0,Cuprate,True,Ba15.385Cu23.077Gd2.308Pr5.385O53.84615384615385,Ba-Cu-Gd-Pr-O,5,Supercon,Gd0.3Pr0.7Ba2Cu3O7,MP-mp-20936,Ba2Pr1Cu3O7,Ba-Cu-Pr-O,Ba15.385Cu23.077Pr7.692O53.84615384615385,P m m m,orthorhombic,3.903923,3.95568,11.916432,data/final/MP/cifs/Ba2Cu3Gd0.3Pr0.7O7-MP-mp-20936-synth_doped.cif,data/source/MP/raw/cifs/mp-20936.cif,mp-20936,0.0,,2014-02-22 14:41:55,6.480717836004672,10.17188/1196129,"@misc{osti_1196129,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2PrCu3O7 (SG:47) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196129"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698257'}},0.0256000172756332,3.18514576,520.0,-78.62827906,-6.048329158461538,"{'tags': ['Dibarium praseodymium tricopper heptaoxide', 'Praseodymium dibarium dicopper copper(III) oxide', 'Praseodymium dibarium tricopper heptaoxide', 'Praseodymium dibarium copper(III) dicopper oxide']}",-78.62827906,-6.048329158461538,-2.145007016153845,"['xas', 'bandstructure']",True,"[41452, 94377, 81168, 173910, 89221]",True,2021-05-12 10:56:57.051000,NM,13,8,mp-20936,oxide,Ba2PrCu3O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Pr_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Pr': 1.0, 'Cu': 3.0, 'O': 7.0}",GGA,mp-20936,"['mp-988090', 'mp-987725', 'mp-20936', 'mp-1417367', 'mp-1698257', 'mp-1833655', 'mp-988324', 'mp-1602318']",0.0007234,"{'Ba': 2.0, 'Pr': 1.0, 'Cu': 3.0, 'O': 7.0}",184.02152853403555,[],NM,False,47,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.931061793491212e-06,0.0007234,0,0.0007234,MP,data/source/MP/cleaned/cifs/MP-mp-20936.cif,True,,data/final/MP/graphs/Ba2Cu3Gd0.3Pr0.7O7-MP-mp-20936-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Si0.263V0.737,2,0.026,8.0,False,Si2.104V5.896,Si2V6,15.8,Other,True,Si26.3V73.7,Si-V,2,Supercon,Si0.263V0.737,MP-mp-2567,V6Si2,Si-V,Si25V75,P m -3 n,cubic,4.702381,4.702381,4.702381,data/final/MP/cifs/Si0.263V0.737-MP-mp-2567-synth_doped.cif,data/source/MP/raw/cifs/mp-2567.cif,mp-2567,0.0,,2011-05-13 19:15:43,5.778142190030859,10.17188/1200874,"@misc{osti_1200874,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Si (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1200874"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668672'}},0.0,7.30599425,520.0,-69.05773321,-8.63221665125,{'tags': ['Vanadium silicide (3/1)']},-69.05773321,-8.63221665125,-0.4452085937499994,"['xas', 'elasticity', 'bandstructure']",True,"[652491, 87328, 652522, 652502, 652510, 652520, 600518, 186003, 652507, 652513, 652497, 601150, 652514, 652487, 22412, 652509, 652529, 652532, 652499, 652539, 652537, 652533, 652512, 652538, 652490, 652493, 652494, 652511, 652519, 87329, 652526, 652500]",True,2021-05-12 10:56:18.721000,FM,8,13,mp-2567,,V3Si,"{'functional': 'PBE', 'labels': ['V_pv', 'Si'], 'pot_type': 'paw'}","{'V': 3.0, 'Si': 1.0}",GGA,mp-2567,"['mp-920081', 'mp-906309', 'mp-919083', 'mp-2567', 'mp-1078474', 'mp-1078852', 'mp-1138781', 'mp-1145907', 'mp-1440678', 'mp-1668672', 'mp-1795955', 'mp-1593554', 'mp-1596575']",0.8382519,"{'V': 6.0, 'Si': 2.0}",103.98086881866836,[],FM,True,131,1,"[0.2, 0.3, 0.3, 0.2, 0.3, 0.3, 0.0, 0.0]",0.0161231947669493,0.8382519,6,1.6765038,MP,data/source/MP/cleaned/cifs/MP-mp-2567.cif,True,,data/final/MP/graphs/Si0.263V0.737-MP-mp-2567-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Nb3Pt0.1Rh0.9,2,0.0499999999999999,2.0,False,Nb6Pt0.2Rh1.8,Nb6Rh2,2.8,Other,True,Nb75Pt2.5Rh22.5,Nb-Pt-Rh,3,Supercon,Nb3Rh0.9Pt0.1,MP-mp-1545,Nb6Rh2,Nb-Rh,Nb75Rh25,P m -3 n,cubic,5.186072,5.186072,5.186072,data/final/MP/cifs/Nb3Pt0.1Rh0.9-MP-mp-1545-synth_doped.cif,data/source/MP/raw/cifs/mp-1545.cif,mp-1545,0.0,,2011-05-14 11:20:25,9.086567873234834,10.17188/1191190,"@misc{osti_1191190,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Rh (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191190"",
    place = ""United States"",
    year = ""2015"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700041'}},0.0,5.48706495,520.0,-77.37430008,-9.67178751,{'tags': ['Niobium rhodium (3/1)']},-77.37430008,-9.67178751,-0.2547317625000005,"['xas', 'elasticity', 'bandstructure']",True,"[105216, 645269]",True,2021-05-12 10:56:12.755000,NM,8,8,mp-1545,,Nb3Rh,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Rh_pv'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Rh': 1.0}",GGA,mp-1545,"['mp-942004', 'mp-943019', 'mp-935201', 'mp-1545', 'mp-1433570', 'mp-1700041', 'mp-1786474', 'mp-1591392']",0.00021655,"{'Nb': 6.0, 'Rh': 2.0}",139.48118416938905,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",3.1050783127424102e-06,0.00021655,0,0.0004331,MP,data/source/MP/cleaned/cifs/MP-mp-1545.cif,True,,data/final/MP/graphs/Nb3Pt0.1Rh0.9-MP-mp-1545-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
V3Zr3O1,1,0.0,4.0,False,V12Zr12O4,V12Zr12O4,7.5,Oxide,True,V42.857Zr42.857O14.285714285714286,V-Zr-O,3,Supercon,Zr3V3O1,MP-mp-504834,Zr12V12O4,V-Zr-O,V42.857Zr42.857O14.285714285714286,F d -3 m,cubic,8.80329275,8.80329275,8.80329275,data/final/MP/cifs/V3Zr3O1-MP-mp-504834.cif,data/source/MP/raw/cifs/mp-504834.cif,mp-504834,0.0,,2014-02-22 14:11:55,6.092533201528037,,,{'GGA+U': {'task_id': 'mp-1756928'}},0.5720315021428366,5.07187423,520.0,-216.93041998,-7.747514999285714,{'tags': ['Zirconium vanadium oxide (3/3/1)']},-216.93041998,-7.747514999285714,-0.3109748414285716,['xas'],False,"[165077, 38407]",True,2021-05-12 10:57:10.838000,FiM,28,6,mp-504834,oxide,Zr3V3O,"{'functional': 'PBE', 'labels': ['Zr_sv', 'V_pv', 'O'], 'pot_type': 'paw'}","{'Zr': 3.0, 'V': 3.0, 'O': 1.0}",GGA+U,mp-504834,"['mp-649137', 'mp-540960', 'mp-504834', 'mp-1412019', 'mp-1756928', 'mp-1921514']",2.154402375,"{'Zr': 12.0, 'V': 12.0, 'O': 4.0}",482.4145914057818,[],FiM,True,227,2,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -2.4, -2.4, -2.4, -2.4, 2.2, 2.2, 2.2, 2.2, 2.2, 2.2, 2.2, 2.2, 0.0, 0.0, 0.0, 0.0]",0.0178634926337692,2.154402375,12,8.6176095,MP,data/source/MP/cleaned/cifs/MP-mp-504834.cif,False,,data/final/MP/graphs/V3Zr3O1-MP-mp-504834.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Sb0.268V0.732,2,0.036,8.0,False,Sb2.144V5.856,Sb2V6,0.0,Other,True,Sb26.8V73.2,Sb-V,2,Supercon,Sb0.268V0.732,MP-mp-1555,V6Sb2,Sb-V,Sb25V75,P m -3 n,cubic,4.935,4.935,4.935,data/final/MP/cifs/Sb0.268V0.732-MP-mp-1555-synth_doped.cif,data/source/MP/raw/cifs/mp-1555.cif,mp-1555,0.0,,2011-05-13 19:31:48,7.587411530928405,10.17188/1191232,"@misc{osti_1191232,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Sb (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191232"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699451'}},0.0,8.2538452,520.0,-64.48303092,-8.060378865,"{'tags': ['Vanadium antimonide (1/3)', 'Vanadium antimonide (3/1)']}",-64.48303092,-8.060378865,-0.2631990025000004,"['xas', 'elasticity', 'bandstructure']",True,"[651731, 52330, 106037, 651717]",True,2021-05-12 10:56:12.755000,NM,8,8,mp-1555,,V3Sb,"{'functional': 'PBE', 'labels': ['V_pv', 'Sb'], 'pot_type': 'paw'}","{'V': 3.0, 'Sb': 1.0}",GGA,mp-1555,"['mp-926619', 'mp-927153', 'mp-911044', 'mp-1555', 'mp-1413633', 'mp-1699451', 'mp-1805224', 'mp-1596724']",0.0044149,"{'V': 6.0, 'Sb': 2.0}",120.18810037499998,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",7.34665076862856e-05,0.0044149,0,0.0088298,MP,data/source/MP/cleaned/cifs/MP-mp-1555.cif,True,,data/final/MP/graphs/Sb0.268V0.732-MP-mp-1555-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ce0.965Co1In5La0.035,2,0.01,1.0,True,Ce0.965Co1In5La0.035,Ce1Co1In5,1.84,Heavy_fermion,True,Ce13.786Co14.286In71.429La0.5,Ce-Co-In-La,4,Supercon,Ce0.965La0.035Co1In5,MP-mp-19961,Ce1In5Co1,Ce-Co-In,Ce14.286Co14.286In71.429,P 4/m m m,tetragonal,4.635989,4.635989,7.564124,data/final/MP/cifs/Ce0.965Co1In5La0.035-MP-mp-19961-synth_doped.cif,data/source/MP/raw/cifs/mp-19961.cif,mp-19961,0.0,,2014-02-21 14:08:25,7.897022127398995,10.17188/1195145,"@misc{osti_1195145,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeIn5Co (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195145"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701944'}},0.0,7.80626318,520.0,-28.52795357,-4.075421938571429,{'tags': ['Cerium cobalt indium (1/1/5)']},-28.52795357,-4.075421938571429,-0.2468754242857146,"['xas', 'bandstructure']",True,[102108],True,2021-05-12 10:56:57.051000,FM,7,8,mp-19961,,CeIn5Co,"{'functional': 'PBE', 'labels': ['Ce', 'In_d', 'Co'], 'pot_type': 'paw'}","{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",GGA,mp-19961,"['mp-928775', 'mp-912209', 'mp-928270', 'mp-19961', 'mp-1504062', 'mp-1701944', 'mp-1785253', 'mp-1593180']",0.9310323,"{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",162.57113333428427,[],FM,True,123,1,"[0.7, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0057269226147644,0.9310323,1,0.9310323,MP,data/source/MP/cleaned/cifs/MP-mp-19961.cif,True,,data/final/MP/graphs/Ce0.965Co1In5La0.035-MP-mp-19961-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Co4Sc5Si10,1,0.0,2.0,False,Co8Sc10Si20,Co8Sc10Si20,4.81,Other,True,Co21.053Sc26.316Si52.632,Co-Sc-Si,3,Supercon,Sc5Co4Si10,MP-mp-542493,Sc10Co8Si20,Co-Sc-Si,Co21.053Sc26.316Si52.632,P 4/m b m,tetragonal,3.941318,12.012605,12.012605,data/final/MP/cifs/Co4Sc5Si10-MP-mp-542493.cif,data/source/MP/raw/cifs/mp-542493.cif,mp-542493,0.0,,2015-02-14 21:09:32,4.32909057737821,10.17188/1266556,"@misc{osti_1266556,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sc5(Co2Si5)2 (SG:127) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1266556"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1739103'}},0.0,7.38961053,520.0,-256.80161605,-6.757937264473685,{'tags': ['Scandium cobalt silicide (5/4/10)']},-256.80161605,-6.757937264473685,-0.7022132168421057,['xas'],False,"[30519, 624969, 624958]",True,2021-05-12 10:57:15.388000,NM,38,9,mp-542493,,Sc5(Co2Si5)2,"{'functional': 'PBE', 'labels': ['Sc_sv', 'Co', 'Si'], 'pot_type': 'paw'}","{'Sc': 5.0, 'Co': 4.0, 'Si': 10.0}",GGA,mp-542493,"['mp-943589', 'mp-933259', 'mp-943428', 'mp-1170770', 'mp-542493', 'mp-1267243', 'mp-1409762', 'mp-1739103', 'mp-1881456']",0.00042215,"{'Sc': 10.0, 'Co': 8.0, 'Si': 20.0}",568.7427457417103,[],NM,False,127,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.4845024509260846e-06,0.00042215,0,0.0008443,MP,data/source/MP/cleaned/cifs/MP-mp-542493.cif,False,,data/final/MP/graphs/Co4Sc5Si10-MP-mp-542493.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
As2Ba0.59Fe2K0.41,3,0.1026666666666666,3.0,False,As6Ba1.77Fe6K1.23,As6Ba1Fe6K2,36.9,Ferrite,True,As40Ba11.8Fe40K8.2,As-Ba-Fe-K,4,Supercon,Ba0.59K0.41Fe2As2,MP-mp-1223766,K2Ba1Fe6As6,As-Ba-Fe-K,As40Ba6.667Fe40K13.333,C 1 2/m 1,monoclinic,5.437740001361472,7.18634711,8.612102760000003,data/final/MP/cifs/As2Ba0.59Fe2K0.41-MP-mp-1223766-synth_doped.cif,data/source/MP/raw/cifs/mp-1223766.cif,mp-1223766,0.0,,2019-01-13 00:06:57.709000,5.619425416151954,,,,0.0077898596666665,3.9822019,520.0,-88.48429402,-5.898952934666666,{'tags': []},-88.48429402,-5.898952934666666,-0.3713176110666666,[],False,[],True,2021-05-12 11:00:52.054000,FM,15,3,mp-1223766,,K2Ba(FeAs)6,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'K': 2.0, 'Ba': 1.0, 'Fe': 6.0, 'As': 6.0}",GGA,mp-1223766,"['mp-1223766', 'mp-1375545', 'mp-1808794']",0.1908756,"{'K': 2.0, 'Ba': 1.0, 'Fe': 6.0, 'As': 6.0}",295.5362020180066,[],FM,True,12,2,"[-0.0, -0.0, -0.0, -0.0, 0.1, 0.1, 0.1, 0.1, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0006458619915145,0.1908756,4,0.1908756,MP,data/source/MP/cleaned/cifs/MP-mp-1223766.cif,True,,data/final/MP/graphs/As2Ba0.59Fe2K0.41-MP-mp-1223766-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
Ba2Co1Cu2Gd1O7.16,2,0.011222819733458,0.9777307262569832,True,Ba1.955Co0.978Cu1.955Gd0.978O7,Ba2Co1Cu2Gd1O7,0.0,Cuprate,True,Ba15.198Co7.599Cu15.198Gd7.599O54.40729483282674,Ba-Co-Cu-Gd-O,5,Supercon,Gd1Ba2Cu2Co1O7.16,MP-mp-1214814,Ba2Gd1Co1Cu2O7,Ba-Co-Cu-Gd-O,Ba15.385Co7.692Cu15.385Gd7.692O53.84615384615385,P m m m,orthorhombic,3.881135,3.919828,11.844703,data/final/MP/cifs/Ba2Co1Cu2Gd1O7.16-MP-mp-1214814-synth_doped.cif,data/source/MP/raw/cifs/mp-1214814.cif,mp-1214814,0.0,,2019-01-12 16:35:35.889000,6.726318027546892,,,{'GGA+U': {'task_id': 'mp-1743109'}},0.0335287189743578,4.0069399,520.0,-90.15597441,-6.935074954615384,"{'tags': ['Ba2Cu2GdCoO7', 'high-Tc cuprate family', 'Ba2Cu2(Cu0.89Al0.11)YO7']}",-90.15597441,-6.935074954615384,-2.211265564615384,[],False,[],True,2021-05-12 11:00:37.845000,FiM,13,5,mp-1214814,oxide,Ba2GdCoCu2O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Gd', 'Co', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Gd': 1.0, 'Co': 1.0, 'Cu': 2.0, 'O': 7.0}",GGA+U,mp-1214814,"['mp-1214814', 'mp-1383878', 'mp-1743109', 'mp-1771654', 'mp-1829309']",4.5576481,"{'Ba': 2.0, 'Gd': 1.0, 'Co': 1.0, 'Cu': 2.0, 'O': 7.0}",180.19798720807063,[],FiM,True,47,2,"[-0.0, -0.0, 6.9, -2.1, 0.0, 0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0252924473276018,4.5576481,2,4.5576481,MP,data/source/MP/cleaned/cifs/MP-mp-1214814.cif,True,,data/final/MP/graphs/Ba2Co1Cu2Gd1O7.16-MP-mp-1214814-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ba2Cu1Tl2O6.05,2,0.0041135335252982,1.9833677685950413,False,Ba3.967Cu1.983Tl3.967O12,Ba4Cu2Tl4O12,47.0,Cuprate,True,Ba18.1Cu9.05Tl18.1O54.751131221719454,Ba-Cu-Tl-O,4,Supercon,Tl2Ba2Cu1O6.05,MP-mp-6027,Ba4Tl4Cu2O12,Ba-Cu-Tl-O,Ba18.182Cu9.091Tl18.182O54.54545454545455,C m c a,orthorhombic,5.504110002693673,5.585743,12.28312762,data/final/MP/cifs/Ba2Cu1Tl2O6.05-MP-mp-6027-synth_doped.cif,data/source/MP/raw/cifs/mp-6027.cif,mp-6027,0.0,,2011-05-19 00:05:23,7.606665315628389,10.17188/1277350,"@misc{osti_1277350,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Tl2CuO6 (SG:64) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277350"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1673478'}},0.0059215576010052,4.10961464,520.0,-115.75418737,-5.261553971363636,"{'tags': ['Dithallium dibarium cuprate', 'Dithallium(III) dibarium copper oxide']}",-115.75418737,-5.261553971363636,-1.7862630028787878,"['xas', 'bandstructure']",True,"[202723, 202724, 202722]",True,2021-05-12 10:57:28.836000,NM,22,8,mp-6027,oxide,Ba2Tl2CuO6,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Tl_d', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Tl': 2.0, 'Cu': 1.0, 'O': 6.0}",GGA,mp-6027,"['mp-925246', 'mp-909581', 'mp-924678', 'mp-6027', 'mp-1504634', 'mp-1673478', 'mp-1837163', 'mp-1605186']",2.9e-05,"{'Ba': 4.0, 'Tl': 4.0, 'Cu': 2.0, 'O': 12.0}",368.0385386017736,[],NM,False,64,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.5759219189476614e-07,2.9e-05,0,5.8e-05,MP,data/source/MP/cleaned/cifs/MP-mp-6027.cif,True,,data/final/MP/graphs/Ba2Cu1Tl2O6.05-MP-mp-6027-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ag0.1Ge2Pd1.9Sr1,2,0.04,1.0,True,Ag0.1Ge2Pd1.9Sr1,Ge2Pd2Sr1,2.62,Other,True,Ag2Ge40Pd38Sr20,Ag-Ge-Pd-Sr,4,Supercon,Sr1Pd1.9Ag0.1Ge2,MP-mp-978986,Sr1Ge2Pd2,Ge-Pd-Sr,Ge40Pd40Sr20,I 4/m m m,tetragonal,4.438671999438209,4.438671999438209,6.03054834,data/final/MP/cifs/Ag0.1Ge2Pd1.9Sr1-MP-mp-978986-synth_doped.cif,data/source/MP/raw/cifs/mp-978986.cif,mp-978986,0.0,,2015-10-09 03:56:43,7.295677176868866,10.17188/1316057,"@misc{osti_1316057,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr(GePd)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1316057"",
    place = ""United States"",
    year = ""2016"",
    month = ""9"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688092'}},0.0,4.0155429,520.0,-24.8627221,-4.97254442,"{'tags': ['Strontium palladium germanide (1/2/2)', 'Strontium palladium germanium (1/2/2)', 'High pressure experimental phase']}",-24.8627221,-4.97254442,-0.7134818633333324,"['xas', 'elasticity', 'bandstructure']",True,"[165985, 181157, 181155, 181156, 168133]",True,2021-05-12 10:56:37.246000,NM,5,9,mp-978986,,Sr(GePd)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ge_d', 'Pd'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Ge': 2.0, 'Pd': 2.0}",GGA,mp-978986,"['mp-1005776', 'mp-978986', 'mp-1005866', 'mp-979737', 'mp-1438850', 'mp-1688092', 'mp-1782349', 'mp-1011093', 'mp-1589601']",0.0012593,"{'Sr': 1.0, 'Ge': 2.0, 'Pd': 2.0}",101.45304755163892,[],NM,False,139,0,"[0, 0, 0, 0, 0]",1.2412638460752248e-05,0.0012593,0,0.0012593,MP,data/source/MP/cleaned/cifs/MP-mp-978986.cif,True,,data/final/MP/graphs/Ag0.1Ge2Pd1.9Sr1-MP-mp-978986-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Fe1.7K0.8Se2,3,0.0888888888888888,1.0,True,Fe1.7K0.8Se2,Fe2K1Se2,31.5,Ferrite,True,Fe37.778K17.778Se44.444,Fe-K-Se,3,Supercon,K0.8Fe1.7Se2,MP-mp-1070735,K1Fe2Se2,Fe-K-Se,Fe40K20Se40,I 4/m m m,tetragonal,3.783558000712664,3.783558000712664,7.91886339,data/final/MP/cifs/Fe1.7K0.8Se2-MP-mp-1070735-synth_doped.cif,data/source/MP/raw/cifs/mp-1070735.cif,mp-1070735,0.0,,2018-03-22 03:52:22,4.804538531009527,,,{'GGA': {'task_id': 'mp-1761650'}},0.0327827750000011,3.42423866,520.0,-27.50456218,-5.500912436,{'tags': ['Potassium iron selenide (1/2/2)']},-27.50456218,-5.500912436,-0.6812646755374999,['bandstructure'],True,[186573],True,2021-05-12 10:58:14.654000,FM,5,8,mp-1070735,,K(FeSe)2,"{'functional': 'PBE', 'labels': ['K_sv', 'Fe_pv', 'Se'], 'pot_type': 'paw'}","{'K': 1.0, 'Fe': 2.0, 'Se': 2.0}",GGA,mp-1070735,"['mp-1070735', 'mp-1070765', 'mp-1070841', 'mp-1416829', 'mp-1761650', 'mp-1797161', 'mp-1585994', 'mp-1070830']",6.0503851,"{'K': 1.0, 'Fe': 2.0, 'Se': 2.0}",106.69540665041993,[],FM,True,139,1,"[0.0, 2.8, 2.8, 0.0, 0.0]",0.0567070813069176,6.0503851,2,6.0503851,MP,data/source/MP/cleaned/cifs/MP-mp-1070735.cif,True,,data/final/MP/graphs/Fe1.7K0.8Se2-MP-mp-1070735-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Fe1.951K0.8Mn0.049Se2,3,0.0666666666666665,1.0,True,Fe1.951K0.8Mn0.049Se2,Fe2K1Se2,31.9,Ferrite,True,Fe40.646K16.667Mn1.021Se41.667,Fe-K-Mn-Se,4,Supercon,K0.8Fe1.951Mn0.049Se2,MP-mp-1070735,K1Fe2Se2,Fe-K-Se,Fe40K20Se40,I 4/m m m,tetragonal,3.783558000712664,3.783558000712664,7.91886339,data/final/MP/cifs/Fe1.951K0.8Mn0.049Se2-MP-mp-1070735-synth_doped.cif,data/source/MP/raw/cifs/mp-1070735.cif,mp-1070735,0.0,,2018-03-22 03:52:22,4.804538531009527,,,{'GGA': {'task_id': 'mp-1761650'}},0.0327827750000011,3.42423866,520.0,-27.50456218,-5.500912436,{'tags': ['Potassium iron selenide (1/2/2)']},-27.50456218,-5.500912436,-0.6812646755374999,['bandstructure'],True,[186573],True,2021-05-12 10:58:14.654000,FM,5,8,mp-1070735,,K(FeSe)2,"{'functional': 'PBE', 'labels': ['K_sv', 'Fe_pv', 'Se'], 'pot_type': 'paw'}","{'K': 1.0, 'Fe': 2.0, 'Se': 2.0}",GGA,mp-1070735,"['mp-1070735', 'mp-1070765', 'mp-1070841', 'mp-1416829', 'mp-1761650', 'mp-1797161', 'mp-1585994', 'mp-1070830']",6.0503851,"{'K': 1.0, 'Fe': 2.0, 'Se': 2.0}",106.69540665041993,[],FM,True,139,1,"[0.0, 2.8, 2.8, 0.0, 0.0]",0.0567070813069176,6.0503851,2,6.0503851,MP,data/source/MP/cleaned/cifs/MP-mp-1070735.cif,True,,data/final/MP/graphs/Fe1.951K0.8Mn0.049Se2-MP-mp-1070735-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ir1Si1Zr1,1,0.0,4.0,False,Ir4Si4Zr4,Ir4Si4Zr4,2.04,Other,True,Ir33.333Si33.333Zr33.333,Ir-Si-Zr,3,Supercon,Zr1Ir1Si1,MP-mp-1102869,Zr4Si4Ir4,Ir-Si-Zr,Ir33.333Si33.333Zr33.333,P n m a,orthorhombic,3.989546,6.591333,7.450976,data/final/MP/cifs/Ir1Si1Zr1-MP-mp-1102869.cif,data/source/MP/raw/cifs/mp-1102869.cif,mp-1102869,0.0,,2018-07-18 15:53:08,10.560736094883543,,,{'GGA': {'task_id': 'mp-1696371'}},0.0,7.85026282,520.0,-104.7155005,-8.726291708333333,"{'tags': ['Iridium zirconium silicide (1/1/1)', 'TiNiSi', 'AlB2 family', 'ZrIrSi']}",-104.7155005,-8.726291708333333,-1.1224766850000012,['bandstructure'],True,[641044],True,2021-05-12 10:58:20.361000,NM,12,5,mp-1102869,,ZrSiIr,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Si', 'Ir'], 'pot_type': 'paw'}","{'Zr': 1.0, 'Si': 1.0, 'Ir': 1.0}",GGA,mp-1102869,"['mp-1102869', 'mp-1420247', 'mp-1696371', 'mp-1827770', 'mp-1598764']",0.000121125,"{'Zr': 4.0, 'Si': 4.0, 'Ir': 4.0}",195.93404053787,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.472770931839974e-06,0.000121125,0,0.0004845,MP,data/source/MP/cleaned/cifs/MP-mp-1102869.cif,False,,data/final/MP/graphs/Ir1Si1Zr1-MP-mp-1102869.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ru1Y3,1,0.0,4.0,False,Ru4Y12,Ru4Y12,0.0,Other,True,Ru25Y75,Ru-Y,2,Supercon,Ru1Y3,MP-mp-1207781,Y12Ru4,Ru-Y,Ru25Y75,P n m a,orthorhombic,6.348096,7.358583,9.269664,data/final/MP/cifs/Ru1Y3-MP-mp-1207781.cif,data/source/MP/raw/cifs/mp-1207781.cif,mp-1207781,0.0,,2019-01-12 10:49:25.126000,5.641627941360977,,,{'GGA': {'task_id': 'mp-1705775'}},0.0,3.84902163,520.0,-119.5926938,-7.4745433625,"{'tags': ['Y3Ru', 'Yttrium ruthenium (3/1)', 'Fe3C']}",-119.5926938,-7.4745433625,-0.3060926137500006,['bandstructure'],True,[650772],True,2021-05-12 10:58:39.488000,NM,16,5,mp-1207781,,Y3Ru,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ru_pv'], 'pot_type': 'paw'}","{'Y': 3.0, 'Ru': 1.0}",GGA,mp-1207781,"['mp-1207781', 'mp-1416862', 'mp-1705775', 'mp-1818350', 'mp-1606312']",0.00065185,"{'Y': 12.0, 'Ru': 4.0}",433.013733859784,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.021518016895773e-06,0.00065185,0,0.0026074,MP,data/source/MP/cleaned/cifs/MP-mp-1207781.cif,False,,data/final/MP/graphs/Ru1Y3-MP-mp-1207781.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
B1.834C0.166Mg1,3,0.1106666666666666,1.0,True,B1.834C0.166Mg1,B2Mg1,32.0,Other,True,B61.133C5.533Mg33.333,B-C-Mg,3,Supercon,Mg1B1.834C0.166,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B1.834C0.166Mg1-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B1.834C0.166Mg1-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ba0.118Cu1La1.882O4,2,0.0337142857142857,1.0,True,Ba0.118Cu1La1.882O4,Cu1La2O4,9.0,Cuprate,True,Ba1.686Cu14.286La26.886O57.142857142857146,Ba-Cu-La-O,4,Supercon,La1.882Ba0.118Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ba0.118Cu1La1.882O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ba0.118Cu1La1.882O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Nb3Os0.9Rh0.1,2,0.0499999999999999,2.0,False,Nb6Os1.8Rh0.2,Nb6Os2,0.0,Other,True,Nb75Os22.5Rh2.5,Nb-Os-Rh,3,Supercon,Nb3Rh0.1Os0.9,MP-mp-1932,Nb6Os2,Nb-Os,Nb75Os25,P m -3 n,cubic,5.179602,5.179602,5.179602,data/final/MP/cifs/Nb3Os0.9Rh0.1-MP-mp-1932-synth_doped.cif,data/source/MP/raw/cifs/mp-1932.cif,mp-1932,0.0,,2011-05-14 10:15:59,11.20767857188024,10.17188/1194239,"@misc{osti_1194239,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Os (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1194239"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704639'}},0.0,5.61834429,520.0,-84.99595231,-10.62449403875,{'tags': ['Niobium osmium (3/1)']},-84.99595231,-10.62449403875,-0.2416736950000011,"['xas', 'elasticity', 'bandstructure']",True,"[603783, 645150, 105184]",True,2021-05-12 10:56:14.760000,NM,8,8,mp-1932,,Nb3Os,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Os_pv'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Os': 1.0}",GGA,mp-1932,"['mp-912682', 'mp-929065', 'mp-929435', 'mp-1932', 'mp-1427426', 'mp-1704639', 'mp-1789424', 'mp-1593834']",0.00027085,"{'Nb': 6.0, 'Os': 2.0}",138.95979657593512,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",3.898249805683804e-06,0.00027085,0,0.0005417,MP,data/source/MP/cleaned/cifs/MP-mp-1932.cif,True,,data/final/MP/graphs/Nb3Os0.9Rh0.1-MP-mp-1932-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
B2C1Lu0.08Ni2Y0.92,2,0.0266666666666666,1.0,True,B2C1Lu0.08Ni2Y0.92,B2C1Ni2Y1,15.2,Other,True,B33.333C16.667Lu1.333Ni33.333Y15.333,B-C-Lu-Ni-Y,5,Supercon,Y0.92Lu0.08Ni2B2C1,MP-mp-6576,Y1Ni2B2C1,B-C-Ni-Y,B33.333C16.667Ni33.333Y16.667,I 4/m m m,tetragonal,3.548790000501972,3.548790000501972,5.76144136,data/final/MP/cifs/B2C1Lu0.08Ni2Y0.92-MP-mp-6576-synth_doped.cif,data/source/MP/raw/cifs/mp-6576.cif,mp-6576,0.0,,2011-05-13 05:21:43,6.099730998852292,10.17188/1281366,"@misc{osti_1281366,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281366"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688230'}},0.0,6.81083016,520.0,-43.677878,-7.279646333333333,{'tags': []},-43.677878,-7.279646333333333,-0.5109282141666659,"['xas', 'bandstructure']",True,"[75816, 89142, 83231, 79574, 41549]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6576,,YNi2B2C,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6576,"['mp-6576', 'mp-1007054', 'mp-1000583', 'mp-1439516', 'mp-1688230', 'mp-1794280', 'mp-1011792', 'mp-1597064']",0.0006603,"{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.3152437079014,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",1.010943177297096e-05,0.0006603,0,0.0006603,MP,data/source/MP/cleaned/cifs/MP-mp-6576.cif,True,,data/final/MP/graphs/B2C1Lu0.08Ni2Y0.92-MP-mp-6576-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ti1U2,1,0.0,1.0,True,Ti1U2,Ti1U2,0.0,Heavy_fermion,True,Ti33.333U66.667,Ti-U,2,Supercon,Ti1U2,MP-mp-1709,U2Ti1,Ti-U,Ti33.333U66.667,P 6/m m m,hexagonal,2.802179,4.788685999714287,4.78868537,data/final/MP/cifs/Ti1U2-MP-mp-1709.cif,data/source/MP/raw/cifs/mp-1709.cif,mp-1709,0.0,,2011-05-12 22:22:29,15.633597235727196,10.17188/1192324,"@misc{osti_1192324,
    author = ""Persson, Kristin"",
    title = ""Materials Data on U2Ti (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1192324"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671508'}},0.0,12.58467633,520.0,-30.7119188,-10.237306266666666,"{'tags': ['Uranium titanium (2/1)', 'Titanium uranium (1/2)']}",-30.7119188,-10.237306266666666,-0.0778689211111114,"['xas', 'elasticity', 'bandstructure']",True,"[653286, 106173, 653285, 96155, 182488, 191194]",True,2021-05-12 10:56:14.760000,NM,3,12,mp-1709,,U2Ti,"{'functional': 'PBE', 'labels': ['U', 'Ti_pv'], 'pot_type': 'paw'}","{'U': 2.0, 'Ti': 1.0}",GGA,mp-1709,"['mp-911936', 'mp-928582', 'mp-928052', 'mp-1709', 'mp-1063326', 'mp-1063407', 'mp-1063498', 'mp-1442048', 'mp-1671508', 'mp-1783438', 'mp-1587995', 'mp-1063472']",0.0001546,"{'U': 2.0, 'Ti': 1.0}",55.64922893006237,[],NM,False,191,0,"[0, 0, 0]",2.7781157613934744e-06,0.0001546,0,0.0001546,MP,data/source/MP/cleaned/cifs/MP-mp-1709.cif,False,,data/final/MP/graphs/Ti1U2-MP-mp-1709.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
As1Ca1Cu0.05F1Fe0.95,2,0.025,2.0,False,As2Ca2Cu0.1F2Fe1.9,As2Ca2F2Fe2,0.0,Ferrite,True,As25Ca25Cu1.25F25Fe23.75,As-Ca-Cu-F-Fe,5,Supercon,Ca1Fe0.95Cu0.05As1F1,MP-mp-1079859,Ca2Fe2As2F2,As-Ca-F-Fe,As25Ca25F25Fe25,P m m n,orthorhombic,3.933336,3.981276,9.018918,data/final/MP/cifs/As1Ca1Cu0.05F1Fe0.95-MP-mp-1079859-synth_doped.cif,data/source/MP/raw/cifs/mp-1079859.cif,mp-1079859,0.0,,2018-04-16 14:43:21,4.464120586611354,,,{'GGA+U': {'task_id': 'mp-1695365'}},0.2859614887499973,4.27317878,520.0,-41.71531675,-5.21441459375,"{'tags': ['Calcium iron arsenide fluoride', 'High pressure experimental phase']}",-41.71531675,-5.21441459375,-1.632363168125,['bandstructure'],True,[186505],True,2021-05-12 10:58:16.596000,FM,8,6,mp-1079859,,CaFeAsF,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Fe_pv', 'As', 'F'], 'pot_type': 'paw'}","{'Ca': 1.0, 'Fe': 1.0, 'As': 1.0, 'F': 1.0}",GGA+U,mp-1079859,"['mp-1079859', 'mp-1475687', 'mp-1695365', 'mp-1785040', 'mp-1938652', 'mp-1594699']",3.7150606,"{'Ca': 2.0, 'Fe': 2.0, 'As': 2.0, 'F': 2.0}",141.2335160836522,[],FM,True,59,1,"[0.0, 0.0, 3.6, 3.6, 0.0, 0.0, 0.0, 0.0]",0.0526087674231601,3.7150606,2,7.4301212,MP,data/source/MP/cleaned/cifs/MP-mp-1079859.cif,True,,data/final/MP/graphs/As1Ca1Cu0.05F1Fe0.95-MP-mp-1079859-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
C2Ce1Ni1,1,0.0,1.0,True,C2Ce1Ni1,C2Ce1Ni1,0.0,Heavy_fermion,True,C50Ce25Ni25,C-Ce-Ni,3,Supercon,Ce1Ni1C2,MP-mp-19741,Ce1Ni1C2,C-Ce-Ni,C50Ce25Ni25,A m m 2,orthorhombic,3.76805523,3.76805523,3.822816,data/final/MP/cifs/C2Ce1Ni1-MP-mp-19741.cif,data/source/MP/raw/cifs/mp-19741.cif,mp-19741,0.0,,2014-02-21 06:14:28,7.083700908421734,10.17188/1194950,"@misc{osti_1194950,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeNiC2 (SG:38) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1194950"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1674366'}},0.0046394432499994,8.54829654,520.0,-31.1015073,-7.775376825,{'tags': ['Cerium nickel carbide (1/1/2)']},-31.1015073,-7.775376825,-0.2336800162500001,"['xas', 'elasticity', 'bandstructure']",True,"[20397, 617365]",True,2021-05-12 10:56:14.760000,NM,4,9,mp-19741,,CeNiC2,"{'functional': 'PBE', 'labels': ['Ce', 'Ni_pv', 'C'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Ni': 1.0, 'C': 2.0}",GGA,mp-19741,"['mp-911552', 'mp-927449', 'mp-927891', 'mp-19741', 'mp-1115970', 'mp-1437964', 'mp-1674366', 'mp-1795510', 'mp-1587330']",0.0644338,"{'Ce': 1.0, 'Ni': 1.0, 'C': 2.0}",52.23530092889995,[],NM,False,38,0,"[0.0, 0.0, 0.0, 0.0]",0.001233529794108,0.0644338,0,0.0644338,MP,data/source/MP/cleaned/cifs/MP-mp-19741.cif,False,,data/final/MP/graphs/C2Ce1Ni1-MP-mp-19741.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Ge1.5La1Ni2P0.5,1,0.0,2.0,False,Ge3La2Ni4P1,Ge3La2Ni4P1,0.0,Other,True,Ge30La20Ni40P10,Ge-La-Ni-P,4,Supercon,La1Ni2Ge1.5P0.5,MP-mp-1223467,La2Ni4Ge3P1,Ge-La-Ni-P,Ge30La20Ni40P10,P 4 m m,tetragonal,4.159826,4.159826,9.817086,data/final/MP/cifs/Ge1.5La1Ni2P0.5-MP-mp-1223467.cif,data/source/MP/raw/cifs/mp-1223467.cif,mp-1223467,0.0,,2019-01-12 23:51:28.814000,7.443440217497515,,,{'GGA': {'task_id': 'mp-1752295'}},0.0,8.4728461,520.0,-60.00770339,-6.000770339000001,{'tags': []},-60.00770339,-6.000770339000001,-0.7732756388333343,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,10,5,mp-1223467,,La2Ni4Ge3P,"{'functional': 'PBE', 'labels': ['La', 'Ni_pv', 'Ge_d', 'P'], 'pot_type': 'paw'}","{'La': 2.0, 'Ni': 4.0, 'Ge': 3.0, 'P': 1.0}",GGA,mp-1223467,"['mp-1223467', 'mp-1411929', 'mp-1752295', 'mp-1780850', 'mp-1623623']",0.065464,"{'La': 2.0, 'Ni': 4.0, 'Ge': 3.0, 'P': 1.0}",169.8763517797616,[],NM,False,99,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0003853626435589,0.065464,0,0.065464,MP,data/source/MP/cleaned/cifs/MP-mp-1223467.cif,False,,data/final/MP/graphs/Ge1.5La1Ni2P0.5-MP-mp-1223467.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
Ir2Y1,1,0.0,2.0,False,Ir4Y2,Ir4Y2,1.635,Other,True,Ir66.667Y33.333,Ir-Y,2,Supercon,Ir2Y1,MP-mp-2762,Y2Ir4,Ir-Y,Ir66.667Y33.333,F d -3 m,cubic,5.36959071,5.36959071,5.36959071,data/final/MP/cifs/Ir2Y1-MP-mp-2762.cif,data/source/MP/raw/cifs/mp-2762.cif,mp-2762,0.0,,2011-05-13 07:37:37,14.35964193164293,10.17188/1201821,"@misc{osti_1201821,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YIr2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201821"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1690588'}},0.0,6.95640963,520.0,-53.17609962,-8.86268327,{'tags': ['Iridium yttrium (2/1)']},-53.17609962,-8.86268327,-0.8149059522222224,"['xas', 'elasticity', 'bandstructure']",True,"[641175, 641183, 104602, 641180, 104601]",True,2021-05-12 10:56:18.721000,NM,6,8,mp-2762,,YIr2,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ir'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ir': 2.0}",GGA,mp-2762,"['mp-941753', 'mp-941895', 'mp-935077', 'mp-2762', 'mp-1437563', 'mp-1690588', 'mp-1805279', 'mp-1596052']",0.0006015,"{'Y': 2.0, 'Ir': 4.0}",109.47338609767904,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",1.0988972232270298e-05,0.0006015,0,0.001203,MP,data/source/MP/cleaned/cifs/MP-mp-2762.cif,False,,data/final/MP/graphs/Ir2Y1-MP-mp-2762.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ba2Ca0.1Cu3Y0.9O7,2,0.0153846153846153,1.0,True,Ba2Ca0.1Cu3Y0.9O7,Ba2Cu3Y1O7,81.8,Cuprate,True,Ba15.385Ca0.769Cu23.077Y6.923O53.84615384615385,Ba-Ca-Cu-Y-O,5,Supercon,Y0.9Ca0.1Ba2Cu3O7,MP-mp-20674,Ba2Y1Cu3O7,Ba-Cu-Y-O,Ba15.385Cu23.077Y7.692O53.84615384615385,P m m m,orthorhombic,3.844668,3.926152,11.823664,data/final/MP/cifs/Ba2Ca0.1Cu3Y0.9O7-MP-mp-20674-synth_doped.cif,data/source/MP/raw/cifs/mp-20674.cif,mp-20674,0.0,,2014-02-22 18:23:22,6.198285186087997,10.17188/1195834,"@misc{osti_1195834,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2YCu3O7 (SG:47) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195834"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686609'}},0.0313759126602519,3.28295453,520.0,-80.7708035,-6.213138730769231,"{'tags': ['Yttrium barium copper oxide (1/2/3/7)', 'Dibarium yttrium dicopper copper(III) oxide', 'Yttrium barium copper oxide (1/2/3/6.93)', 'Dibarium yttrium copper(III) dicopper oxide', 'High pressure experimental phase', 'Yttrium dibarium dicopper copper(III) oxide']}",-80.7708035,-6.213138730769231,-2.180157206282052,"['xas', 'elasticity', 'bandstructure']",True,"[196266, 196264, 196265, 71423, 66620, 63483, 66621, 164530, 56507, 63487, 66602, 66601, 68394, 63486, 63485, 202774, 62466, 62465, 41646, 65224, 202773, 66600, 63335, 66611, 78598, 66617, 81175, 66610, 66619, 66615, 63484, 86958, 262809, 66609, 184677, 202775, 66616, 63488, 66618, 66623, 202771, 66622, 202772, 77737, 202770, 62928, 77745]",True,2021-05-12 10:56:14.760000,NM,13,14,mp-20674,oxide,Ba2YCu3O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Cu': 3.0, 'O': 7.0}",GGA,mp-20674,"['mp-923155', 'mp-917354', 'mp-922372', 'mp-20674', 'mp-1103385', 'mp-1103741', 'mp-1103748', 'mp-1104329', 'mp-1104589', 'mp-1440689', 'mp-1686609', 'mp-1832558', 'mp-1596594', 'mp-1592890']",0.0001806,"{'Ba': 2.0, 'Y': 1.0, 'Cu': 3.0, 'O': 7.0}",178.47526348558395,[],NM,False,47,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.0119049355799813e-06,0.0001806,0,0.0001806,MP,data/source/MP/cleaned/cifs/MP-mp-20674.cif,True,,data/final/MP/graphs/Ba2Ca0.1Cu3Y0.9O7-MP-mp-20674-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Au0.2Nb0.8,3,0.1,8.0,False,Au1.6Nb6.4,Au2Nb6,6.45,Other,True,Au20Nb80,Au-Nb,2,Supercon,Au0.2Nb0.8,MP-mp-2752,Nb6Au2,Au-Nb,Au25Nb75,P m -3 n,cubic,5.256336,5.256336,5.256336,data/final/MP/cifs/Au0.2Nb0.8-MP-mp-2752-synth_doped.cif,data/source/MP/raw/cifs/mp-2752.cif,mp-2752,0.0,,2011-05-14 04:00:34,10.878019698243486,10.17188/1201733,"@misc{osti_1201733,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Au (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201733"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677627'}},0.0265571000000033,5.43391329,520.0,-67.6805768,-8.4600721,{'tags': ['Gold niobium (1/3)']},-67.6805768,-8.4600721,-0.0656229350000003,"['xas', 'elasticity', 'bandstructure']",True,"[612199, 58557, 612192, 612186, 612203, 612188, 612198, 612185]",True,2021-05-12 10:56:18.721000,FM,8,8,mp-2752,,Nb3Au,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Au'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Au': 1.0}",GGA,mp-2752,"['mp-941043', 'mp-934500', 'mp-940884', 'mp-2752', 'mp-1437534', 'mp-1677627', 'mp-1787383', 'mp-1591584']",0.84123765,"{'Nb': 6.0, 'Au': 2.0}",145.22766553647008,[],FM,True,223,1,"[0.2, 0.2, 0.2, 0.2, 0.2, 0.2, 0.0, 0.0]",0.0115850881013954,0.84123765,6,1.6824753,MP,data/source/MP/cleaned/cifs/MP-mp-2752.cif,True,,data/final/MP/graphs/Au0.2Nb0.8-MP-mp-2752-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
K1Nb0.09Ta0.91O3,2,0.0359999999999999,1.0,True,K1Nb0.09Ta0.91O3,K1Ta1O3,0.0,Oxide,True,K20Nb1.8Ta18.2O60,K-Nb-Ta-O,4,Supercon,K1Ta0.91Nb0.09O3,MP-mp-3614,K1Ta1O3,K-Ta-O,K20Ta20O60,P m -3 m,cubic,4.030839,4.030839,4.030839,data/final/MP/cifs/K1Nb0.09Ta0.91O3-MP-mp-3614-synth_doped.cif,data/source/MP/raw/cifs/mp-3614.cif,mp-3614,2.1532,,2011-05-12 22:13:37,6.796251592212529,10.17188/1207137,"@misc{osti_1207137,
    author = ""Persson, Kristin"",
    title = ""Materials Data on KTaO3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207137"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686512'}},0.0,1.55797225,520.0,-41.13911957,-8.227823914,{'tags': ['Potassium tantalate']},-41.13911957,-8.227823914,-3.0776119956000003,"['xas', 'bandstructure', 'diel', 'phonons', 'elasticity']",True,"[39673, 184922, 56439, 181838, 56440, 39905, 280424]",True,2021-05-12 10:56:20.740000,NM,5,17,mp-3614,oxide,KTaO3,"{'functional': 'PBE', 'labels': ['K_sv', 'Ta_pv', 'O'], 'pot_type': 'paw'}","{'K': 1.0, 'Ta': 1.0, 'O': 3.0}",GGA,mp-3614,"['mp-664976', 'mp-669248', 'mp-3614', 'mp-1068712', 'mp-1068716', 'mp-1068728', 'mp-1076849', 'mp-1076850', 'mp-1076851', 'mp-1140169', 'mp-1440109', 'mp-1686512', 'mp-1782459', 'mp-1597006', 'mp-1068733', 'mp-1076852', 'mp-691387']",8.85e-05,"{'K': 1.0, 'Ta': 1.0, 'O': 3.0}",65.49171385629549,[],NM,False,221,0,"[0, 0, 0, 0, 0]",1.351315987762821e-06,8.85e-05,0,8.85e-05,MP,data/source/MP/cleaned/cifs/MP-mp-3614.cif,True,,data/final/MP/graphs/K1Nb0.09Ta0.91O3-MP-mp-3614-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba0.1Pb3Sr0.9,2,0.0499999999999999,1.0,True,Ba0.1Pb3Sr0.9,Pb3Sr1,1.75,Other,True,Ba2.5Pb75Sr22.5,Ba-Pb-Sr,3,Supercon,Ba0.1Pb3Sr0.9,MP-mp-21162,Sr1Pb3,Pb-Sr,Pb75Sr25,P m -3 m,cubic,5.051975,5.051975,5.051975,data/final/MP/cifs/Ba0.1Pb3Sr0.9-MP-mp-21162-synth_doped.cif,data/source/MP/raw/cifs/mp-21162.cif,mp-21162,0.0,,2014-02-21 08:42:42,9.133694752070644,10.17188/1196429,"@misc{osti_1196429,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SrPb3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196429"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696441'}},0.0,5.95694755,520.0,-14.11951311,-3.5298782775,{'tags': ['Lead strontium (3/1)']},-14.11951311,-3.5298782775,-0.3230196116666661,"['xas', 'bandstructure']",True,"[105626, 105625, 648572]",True,2021-05-12 10:56:57.051000,NM,4,8,mp-21162,,SrPb3,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Pb_d'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Pb': 3.0}",GGA,mp-21162,"['mp-930579', 'mp-930953', 'mp-913792', 'mp-21162', 'mp-1441340', 'mp-1696441', 'mp-1803772', 'mp-1591715']",0.0019031,"{'Sr': 1.0, 'Pb': 3.0}",128.93878641467248,[],NM,False,221,0,"[0, 0, 0, 0]",1.4759717017031256e-05,0.0019031,0,0.0019031,MP,data/source/MP/cleaned/cifs/MP-mp-21162.cif,True,,data/final/MP/graphs/Ba0.1Pb3Sr0.9-MP-mp-21162-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba1.5Cu3La0.5Y1O7,1,0.0,2.0,False,Ba3Cu6La1Y2O14,Ba3Cu6La1Y2O14,0.3,Cuprate,True,Ba11.538Cu23.077La3.846Y7.692O53.84615384615385,Ba-Cu-La-Y-O,5,Supercon,Y1Ba1.5La0.5Cu3O7,MP-mp-1228381,Ba3La1Y2Cu6O14,Ba-Cu-La-Y-O,Ba11.538Cu23.077La3.846Y7.692O53.84615384615385,F m m 2,orthorhombic,5.4834994787594304,5.48349948,12.26332536,data/final/MP/cifs/Ba1.5Cu3La0.5Y1O7-MP-mp-1228381.cif,data/source/MP/raw/cifs/mp-1228381.cif,mp-1228381,0.0,,2019-01-13 04:06:02.436000,6.324350456564466,,,,0.0436738408974424,4.26294052,520.0,-167.11537736,-6.427514513846154,{'tags': []},-167.11537736,-6.427514513846154,-2.2784931326282045,[],False,[],True,2021-05-12 11:00:59.151000,NM,26,3,mp-1228381,oxide,Ba3LaY2(Cu3O7)2,"{'functional': 'PBE', 'labels': ['Ba_sv', 'La', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 3.0, 'La': 1.0, 'Y': 2.0, 'Cu': 6.0, 'O': 14.0}",GGA,mp-1228381,"['mp-1228381', 'mp-1369669', 'mp-1843065']",0.000285,"{'Ba': 3.0, 'La': 1.0, 'Y': 2.0, 'Cu': 6.0, 'O': 14.0}",350.2497671192379,[],NM,False,42,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",8.137050378194128e-07,0.000285,0,0.000285,MP,data/source/MP/cleaned/cifs/MP-mp-1228381.cif,False,,data/final/MP/graphs/Ba1.5Cu3La0.5Y1O7-MP-mp-1228381.json,0,True,mm2,0,0,0,6,0,0,0,0,0,0,1,1.0,False
Al1Nb2.976Ti0.024,2,0.012,2.0,False,Al2Nb5.952Ti0.048,Al2Nb6,17.7,Other,True,Al25Nb74.4Ti0.6,Al-Nb-Ti,3,Supercon,Nb2.976Ti0.024Al1,MP-mp-796,Nb6Al2,Al-Nb,Al25Nb75,P m -3 n,cubic,5.215254,5.215254,5.215254,data/final/MP/cifs/Al1Nb2.976Ti0.024-MP-mp-796-synth_doped.cif,data/source/MP/raw/cifs/mp-796.cif,mp-796,0.0,,2011-05-13 16:07:37,7.157298025966356,,,{'GGA': {'task_id': 'mp-1686893'}},0.0460773865000003,5.52947534,520.0,-69.48918494,-8.6861481175,"{'tags': ['Aluminium niobium (1/3)', 'Niobium aluminide (3/1)', 'Aluminum niobium (1/3)']}",-69.48918494,-8.6861481175,-0.1737753800000003,"['bandstructure', 'elasticity']",True,"[608675, 608654, 608688, 608668, 608669, 608685, 608676, 608683, 58014, 608657, 107856, 608655, 608666, 608691, 608656, 608665, 608673, 608653, 608661]",True,2021-05-12 10:56:31.128000,NM,8,10,mp-796,,Nb3Al,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Al': 1.0}",GGA,mp-796,"['mp-911586', 'mp-927906', 'mp-796', 'mp-927472', 'mp-1260512', 'mp-1440919', 'mp-1686893', 'mp-1927652', 'mp-1591599', 'mp-1587739']",0.16323955,"{'Nb': 6.0, 'Al': 2.0}",141.8490379078192,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0023015954483396,0.16323955,0,0.3264791,MP,data/source/MP/cleaned/cifs/MP-mp-796.cif,True,,data/final/MP/graphs/Al1Nb2.976Ti0.024-MP-mp-796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Ca0.28Cu3Y0.72O6,3,0.0466666666666666,1.0,True,Ba2Ca0.28Cu3Y0.72O6,Ba2Cu3Y1O6,47.5,Cuprate,True,Ba16.667Ca2.333Cu25Y6O50,Ba-Ca-Cu-Y-O,5,Supercon,Y0.72Ca0.28Ba2Cu3O6,MP-mp-22215,Ba2Y1Cu3O6,Ba-Cu-Y-O,Ba16.667Cu25Y8.333O50,P 4/m m m,tetragonal,3.890574,3.890574,12.12302,data/final/MP/cifs/Ba2Ca0.28Cu3Y0.72O6-MP-mp-22215-synth_doped.cif,data/source/MP/raw/cifs/mp-22215.cif,mp-22215,0.0,,2014-02-22 10:32:14,5.883747679108356,10.17188/1197430,"@misc{osti_1197430,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Y(CuO2)3 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197430"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697120'}},0.0102308603749952,3.24358281,520.0,-74.96347692,-6.24695641,"{'tags': ['Dibarium yttrium dicopper copper(I) hexaoxide', 'Yttrium dibarium copper(I) dicopper oxide', 'Yttrium dibarium copper oxide (1/2/3/6)', 'Dibarium yttrium tricopper hexaoxide', 'Yttrium barium copper oxide (1/2/3/6)']}",-74.96347692,-6.24695641,-2.232973175555556,"['xas', 'bandstructure']",True,"[68290, 72254, 63424, 66903, 68046, 68008, 67016, 84739, 203116, 63269]",True,2021-05-12 10:56:59.077000,NM,12,11,mp-22215,oxide,Ba2Y(CuO2)3,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Cu': 3.0, 'O': 6.0}",GGA,mp-22215,"['mp-917350', 'mp-923178', 'mp-922392', 'mp-610585', 'mp-22215', 'mp-1182689', 'mp-1236883', 'mp-1432999', 'mp-1697120', 'mp-1830265', 'mp-1587968']",0.1132814,"{'Ba': 2.0, 'Y': 1.0, 'Cu': 3.0, 'O': 6.0}",183.5008929491185,[],NM,False,123,0,"[0.0, 0.0, 0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0006173343256232,0.1132814,0,0.1132814,MP,data/source/MP/cleaned/cifs/MP-mp-22215.cif,True,,data/final/MP/graphs/Ba2Ca0.28Cu3Y0.72O6-MP-mp-22215-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Au1In1Pd1Y1,1,0.0,1.0,True,Au1In1Pd1Y1,Au1In1Pd1Y1,2.3,Other,True,Au25In25Pd25Y25,Au-In-Pd-Y,4,Supercon,Au1Pd1In1Y1,MP-mp-1215995,Y1In1Pd1Au1,Au-In-Pd-Y,Au25In25Pd25Y25,F -4 3 m,cubic,4.8912457,4.891245699999999,4.891245699999999,data/final/MP/cifs/Au1In1Pd1Y1-MP-mp-1215995.cif,data/source/MP/raw/cifs/mp-1215995.cif,mp-1215995,0.0,,2019-01-12 17:34:56.186000,10.176728600736933,,,{'GGA': {'task_id': 'mp-1765733'}},0.0132657161458329,5.90702848,520.0,-20.66700178,-5.166750445,{'tags': []},-20.66700178,-5.166750445,-0.7487708966666657,['bandstructure'],True,[],True,2021-05-12 10:58:39.488000,NM,4,5,mp-1215995,,YInPdAu,"{'functional': 'PBE', 'labels': ['Y_sv', 'In_d', 'Pd', 'Au'], 'pot_type': 'paw'}","{'Y': 1.0, 'In': 1.0, 'Pd': 1.0, 'Au': 1.0}",GGA,mp-1215995,"['mp-1215995', 'mp-1433807', 'mp-1765733', 'mp-1874074', 'mp-1613808']",0.0021391,"{'Y': 1.0, 'In': 1.0, 'Pd': 1.0, 'Au': 1.0}",82.74531972567463,[],NM,False,216,0,"[0, 0, 0, 0]",2.585161320412748e-05,0.0021391,0,0.0021391,MP,data/source/MP/cleaned/cifs/MP-mp-1215995.cif,False,,data/final/MP/graphs/Au1In1Pd1Y1-MP-mp-1215995.json,0,True,-43m,5,0,0,0,0,0,0,0,0,0,1,1.0,False
Au2Er1In1,1,0.0,1.0,True,Au2Er1In1,Au2Er1In1,0.0,Other,True,Au50Er25In25,Au-Er-In,3,Supercon,Au2In1Er1,MP-mp-30376,Er1In1Au2,Au-Er-In,Au50Er25In25,F m -3 m,cubic,4.93145744,4.93145744,4.93145744,data/final/MP/cifs/Au2Er1In1-MP-mp-30376.cif,data/source/MP/raw/cifs/mp-30376.cif,mp-30376,0.0,,2014-02-19 20:18:02,13.237056880155071,10.17188/1204791,"@misc{osti_1204791,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ErInAu2 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1204791"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702839'}},0.0,5.95447283,520.0,-16.66512586,-4.166281465,{'tags': ['Gold erbium indium (2/1/1)']},-16.66512586,-4.166281465,-0.69949006,"['xas', 'bandstructure']",True,[58449],True,2021-05-12 10:57:04.957000,NM,4,8,mp-30376,,ErInAu2,"{'functional': 'PBE', 'labels': ['Er_3', 'In_d', 'Au'], 'pot_type': 'paw'}","{'Er': 1.0, 'In': 1.0, 'Au': 2.0}",GGA,mp-30376,"['mp-940990', 'mp-932729', 'mp-940851', 'mp-30376', 'mp-1438323', 'mp-1702839', 'mp-1782642', 'mp-1596143']",0.030462,"{'Er': 1.0, 'In': 1.0, 'Au': 2.0}",84.80293268585747,[],NM,False,225,0,"[0.0, 0.0, 0.0, 0.0]",0.0003592092753778,0.030462,0,0.030462,MP,data/source/MP/cleaned/cifs/MP-mp-30376.cif,False,,data/final/MP/graphs/Au2Er1In1-MP-mp-30376.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Mo1Ni1P1,1,0.0,3.0,False,Mo3Ni3P3,Mo3Ni3P3,15.5,Ferrite,True,Mo33.333Ni33.333P33.333,Mo-Ni-P,3,Supercon,Mo1Ni1P1,MP-mp-7632,Ni3Mo3P3,Mo-Ni-P,Mo33.333Ni33.333P33.333,P -6 2 m,hexagonal,3.749923,5.85716400241481,5.85716416,data/final/MP/cifs/Mo1Ni1P1-MP-mp-7632.cif,data/source/MP/raw/cifs/mp-7632.cif,mp-7632,0.0,,2011-06-01 06:29:29,8.299220745760733,10.17188/1293294,"@misc{osti_1293294,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NiMoP (SG:189) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1293294"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700605'}},0.0,10.4089746,520.0,-71.14036171,-7.904484634444444,{'tags': ['Molybdenum nickel phosphide (1/1/1)']},-71.14036171,-7.904484634444444,-0.558123895555555,"['bandstructure', 'elasticity']",True,[1133],True,2021-05-12 10:56:29.056000,NM,9,8,mp-7632,,NiMoP,"{'functional': 'PBE', 'labels': ['Ni_pv', 'Mo_pv', 'P'], 'pot_type': 'paw'}","{'Ni': 1.0, 'Mo': 1.0, 'P': 1.0}",GGA,mp-7632,"['mp-1000844', 'mp-1007297', 'mp-7632', 'mp-1419895', 'mp-1700605', 'mp-1804357', 'mp-1012042', 'mp-1594101']",0.0038601333333333,"{'Ni': 3.0, 'Mo': 3.0, 'P': 3.0}",111.41092145278404,[],NM,False,189,0,"[-0.0, -0.0, -0.0, -0.0, -0.0, -0.0, 0.0, 0.0, 0.0]",0.0001039431309695,0.0038601333333333,0,0.0115804,MP,data/source/MP/cleaned/cifs/MP-mp-7632.cif,False,,data/final/MP/graphs/Mo1Ni1P1-MP-mp-7632.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Ta0.52Ti0.48,2,0.04,2.0,False,Ta1.04Ti0.96,Ta1Ti1,7.86,Other,True,Ta52Ti48,Ta-Ti,2,Supercon,Ta0.52Ti0.48,MP-mp-1217887,Ta1Ti1,Ta-Ti,Ta50Ti50,C m m m,orthorhombic,2.83159279,2.83159221,4.659713,data/final/MP/cifs/Ta0.52Ti0.48-MP-mp-1217887-synth_doped.cif,data/source/MP/raw/cifs/mp-1217887.cif,mp-1217887,0.0,,2019-01-12 19:08:56.125000,10.746615063570298,,,{'GGA': {'task_id': 'mp-1675318'}},0.0605979833333325,5.58352202,520.0,-19.63207368,-9.81603684,{'tags': []},-19.63207368,-9.81603684,0.0605979833333325,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,2,5,mp-1217887,,TaTi,"{'functional': 'PBE', 'labels': ['Ta_pv', 'Ti_pv'], 'pot_type': 'paw'}","{'Ta': 1.0, 'Ti': 1.0}",GGA,mp-1217887,"['mp-1217887', 'mp-1425780', 'mp-1675318', 'mp-1790597', 'mp-1611384']",0.0591736,"{'Ta': 1.0, 'Ti': 1.0}",35.35588136467223,[],NM,False,65,0,"[0, 0]",0.0016736564813549,0.0591736,0,0.0591736,MP,data/source/MP/cleaned/cifs/MP-mp-1217887.cif,True,,data/final/MP/graphs/Ta0.52Ti0.48-MP-mp-1217887-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Al0.91Ge0.09Nb3,2,0.0449999999999999,2.0,False,Al1.82Ge0.18Nb6,Al2Nb6,19.8,Other,True,Al22.75Ge2.25Nb75,Al-Ge-Nb,3,Supercon,Nb3Al0.91Ge0.09,MP-mp-796,Nb6Al2,Al-Nb,Al25Nb75,P m -3 n,cubic,5.215254,5.215254,5.215254,data/final/MP/cifs/Al0.91Ge0.09Nb3-MP-mp-796-synth_doped.cif,data/source/MP/raw/cifs/mp-796.cif,mp-796,0.0,,2011-05-13 16:07:37,7.157298025966356,,,{'GGA': {'task_id': 'mp-1686893'}},0.0460773865000003,5.52947534,520.0,-69.48918494,-8.6861481175,"{'tags': ['Aluminium niobium (1/3)', 'Niobium aluminide (3/1)', 'Aluminum niobium (1/3)']}",-69.48918494,-8.6861481175,-0.1737753800000003,"['bandstructure', 'elasticity']",True,"[608675, 608654, 608688, 608668, 608669, 608685, 608676, 608683, 58014, 608657, 107856, 608655, 608666, 608691, 608656, 608665, 608673, 608653, 608661]",True,2021-05-12 10:56:31.128000,NM,8,10,mp-796,,Nb3Al,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Al': 1.0}",GGA,mp-796,"['mp-911586', 'mp-927906', 'mp-796', 'mp-927472', 'mp-1260512', 'mp-1440919', 'mp-1686893', 'mp-1927652', 'mp-1591599', 'mp-1587739']",0.16323955,"{'Nb': 6.0, 'Al': 2.0}",141.8490379078192,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0023015954483396,0.16323955,0,0.3264791,MP,data/source/MP/cleaned/cifs/MP-mp-796.cif,True,,data/final/MP/graphs/Al0.91Ge0.09Nb3-MP-mp-796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Hg1Pb2,1,0.0,1.0,True,Hg1Pb2,Hg1Pb2,5.8,Other,True,Hg33.333Pb66.667,Hg-Pb,2,Supercon,Hg1Pb2,MP-mp-1223969,Hg1Pb2,Hg-Pb,Hg33.333Pb66.667,C 1 2/m 1,monoclinic,3.5087683499999995,3.50876835,8.56737949,data/final/MP/cifs/Hg1Pb2-MP-mp-1223969.cif,data/source/MP/raw/cifs/mp-1223969.cif,mp-1223969,0.0,,2019-01-13 00:17:15.122000,11.052462588233434,,,{'GGA': {'task_id': 'mp-1736380'}},0.0330006883333329,5.1677822,520.0,-7.62997244,-2.543324146666667,{'tags': []},-7.62997244,-2.543324146666667,0.0330006883333332,['bandstructure'],True,[],True,2021-05-12 10:58:45.495000,NM,3,5,mp-1223969,,HgPb2,"{'functional': 'PBE', 'labels': ['Hg', 'Pb_d'], 'pot_type': 'paw'}","{'Hg': 1.0, 'Pb': 2.0}",GGA,mp-1223969,"['mp-1223969', 'mp-1414700', 'mp-1736380', 'mp-1796469', 'mp-1613624']",0.0054305,"{'Hg': 1.0, 'Pb': 2.0}",92.39704838770773,[],NM,False,12,0,"[0, 0, 0]",5.8773522474582216e-05,0.0054305,0,0.0054305,MP,data/source/MP/cleaned/cifs/MP-mp-1223969.cif,False,,data/final/MP/graphs/Hg1Pb2-MP-mp-1223969.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
Ce1Cu2Ge0.08Si1.92,2,0.032,1.0,True,Ce1Cu2Ge0.08Si1.92,Ce1Cu2Si2,0.27,Heavy_fermion,True,Ce20Cu40Ge1.6Si38.4,Ce-Cu-Ge-Si,4,Supercon,Ce1Cu2Si1.92Ge0.08,MP-mp-5452,Ce1Cu2Si2,Ce-Cu-Si,Ce20Cu40Si40,I 4/m m m,tetragonal,4.075731996715381,4.075731996715381,5.70132195,data/final/MP/cifs/Ce1Cu2Ge0.08Si1.92-MP-mp-5452-synth_doped.cif,data/source/MP/raw/cifs/mp-5452.cif,mp-5452,0.0,,2011-05-13 06:29:11,6.571257460055593,10.17188/1266988,"@misc{osti_1266988,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ce(SiCu)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1266988"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668622'}},0.0,8.51519913,520.0,-27.86039596,-5.572079192,"{'tags': ['Cerium copper silicon (1/2/2)', 'Cerium copper silicide (1/2/2)']}",-27.86039596,-5.572079192,-0.5472530850000006,"['xas', 'elasticity', 'bandstructure']",True,"[620924, 620948, 102140, 620940, 620921, 620914, 164068, 620946, 620920, 620949, 102141, 620930, 620939, 620931, 620951, 620944, 657643, 657672, 620943, 55797, 52851]",True,2021-05-12 10:56:22.739000,NM,5,9,mp-5452,,Ce(CuSi)2,"{'functional': 'PBE', 'labels': ['Ce', 'Cu_pv', 'Si'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Cu': 2.0, 'Si': 2.0}",GGA,mp-5452,"['mp-5452', 'mp-1097881', 'mp-1156698', 'mp-1248439', 'mp-1440927', 'mp-1668622', 'mp-1798875', 'mp-1594230', 'mp-1595235']",0.01041,"{'Ce': 1.0, 'Cu': 2.0, 'Si': 2.0}",81.71700258012696,[],NM,False,139,0,"[-0.0, 0.0, 0.0, 0.0, 0.0]",0.0001273908693578,0.01041,0,0.01041,MP,data/source/MP/cleaned/cifs/MP-mp-5452.cif,True,,data/final/MP/graphs/Ce1Cu2Ge0.08Si1.92-MP-mp-5452-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ce2Rh3Si5,1,0.0,2.0,False,Ce4Rh6Si10,Ce4Rh6Si10,0.0,Heavy_fermion,True,Ce20Rh30Si50,Ce-Rh-Si,3,Supercon,Ce2Rh3Si5,MP-mp-1188214,Ce4Si10Rh6,Ce-Rh-Si,Ce20Rh30Si50,I b a m,orthorhombic,5.860725999575008,8.20457525,8.204575249886915,data/final/MP/cifs/Ce2Rh3Si5-MP-mp-1188214.cif,data/source/MP/raw/cifs/mp-1188214.cif,mp-1188214,0.0,,2019-01-11 19:16:26.264000,7.124414193056385,,,{'GGA': {'task_id': 'mp-1677844'}},0.0040123480000007,8.6943514,520.0,-141.61027402,-7.080513700999999,"{'tags': ['U2Co3Si5', 'Cerium rhodium silicide (2/3/5)', 'Ce2Rh3Si5']}",-141.61027402,-7.080513700999999,-0.9364464989999988,['bandstructure'],True,"[621960, 247297, 169509]",True,2021-05-12 10:58:31.620000,NM,20,7,mp-1188214,,Ce2Si5Rh3,"{'functional': 'PBE', 'labels': ['Ce', 'Si', 'Rh_pv'], 'pot_type': 'paw'}","{'Ce': 2.0, 'Si': 5.0, 'Rh': 3.0}",GGA,mp-1188214,"['mp-1188214', 'mp-1189534', 'mp-1189903', 'mp-1340871', 'mp-1677844', 'mp-1837894', 'mp-1637880']",0.0060757,"{'Ce': 4.0, 'Si': 10.0, 'Rh': 6.0}",340.0019452605276,[],NM,False,12,0,"[0.0, 0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",3.5739207288031694e-05,0.0060757,0,0.0121514,MP,data/source/MP/cleaned/cifs/MP-mp-1188214.cif,False,,data/final/MP/graphs/Ce2Rh3Si5-MP-mp-1188214.json,0,True,mmm,0,0,0,7,0,0,0,0,0,1,0,1.0,False
C1Mg0.85Ni3Zn0.15,3,0.06,1.0,True,C1Mg0.85Ni3Zn0.15,C1Mg1Ni3,4.12,Other,True,C20Mg17Ni60Zn3,C-Mg-Ni-Zn,4,Supercon,Mg0.85Zn0.15C1Ni3,MP-mp-10700,Mg1Ni3C1,C-Mg-Ni,C20Mg20Ni60,P m -3 m,cubic,3.810209,3.810209,3.810209,data/final/MP/cifs/C1Mg0.85Ni3Zn0.15-MP-mp-10700-synth_doped.cif,data/source/MP/raw/cifs/mp-10700.cif,mp-10700,0.0,,2011-05-28 10:04:44,6.376007671789427,10.17188/1187303,"@misc{osti_1187303,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MgNi3C (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187303"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678621'}},0.0,6.64260176,520.0,-28.85099542,-5.770199084,{'tags': ['Magnesium nickel carbide (1/3/1)']},-28.85099542,-5.770199084,-0.1367049259999994,"['xas', 'elasticity', 'bandstructure']",True,[77152],True,2021-05-12 10:56:10.715000,NM,5,8,mp-10700,,MgNi3C,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Ni_pv', 'C'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",GGA,mp-10700,"['mp-927245', 'mp-927653', 'mp-911184', 'mp-10700', 'mp-1438083', 'mp-1678621', 'mp-1791467', 'mp-1591421']",0.0387875,"{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",55.31544309398296,[],NM,False,221,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",0.0007012056277683,0.0387875,0,0.0387875,MP,data/source/MP/cleaned/cifs/MP-mp-10700.cif,True,,data/final/MP/graphs/C1Mg0.85Ni3Zn0.15-MP-mp-10700-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Re0.25Ta0.75,1,0.0,4.0,False,Re1Ta3,Re1Ta3,0.0,Other,True,Re25Ta75,Re-Ta,2,Supercon,Re0.25Ta0.75,MP-mp-1187203,Ta3Re1,Re-Ta,Re25Ta75,F m -3 m,cubic,4.6019768,4.6019768,4.601976799999999,data/final/MP/cifs/Re0.25Ta0.75-MP-mp-1187203.cif,data/source/MP/raw/cifs/mp-1187203.cif,mp-1187203,0.0,,2019-01-11 14:54:30.172000,17.566632545538077,,,{'GGA': {'task_id': 'mp-1768151'}},0.0,5.91749072,520.0,-48.89036476,-12.22259119,{'tags': []},-48.89036476,-12.22259119,-0.2181261712500006,['bandstructure'],True,[],True,2021-05-12 10:58:31.620000,NM,4,5,mp-1187203,,Ta3Re,"{'functional': 'PBE', 'labels': ['Ta_pv', 'Re_pv'], 'pot_type': 'paw'}","{'Ta': 3.0, 'Re': 1.0}",GGA,mp-1187203,"['mp-1187203', 'mp-1421088', 'mp-1768151', 'mp-1798299', 'mp-1615335']",0.0107227,"{'Ta': 3.0, 'Re': 1.0}",68.91571655019501,[],NM,False,225,0,"[0, 0, 0, 0]",0.0001555915041845,0.0107227,0,0.0107227,MP,data/source/MP/cleaned/cifs/MP-mp-1187203.cif,False,,data/final/MP/graphs/Re0.25Ta0.75-MP-mp-1187203.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
As2Eu1Fe1.91Ni0.09,2,0.036,1.0,True,As2Eu1Fe1.91Ni0.09,As2Eu1Fe2,0.0,Ferrite,True,As40Eu20Fe38.2Ni1.8,As-Eu-Fe-Ni,4,Supercon,Eu1Fe1.91Ni0.09As2,MP-mp-20890,Eu1Fe2As2,As-Eu-Fe,As40Eu20Fe40,I 4/m m m,tetragonal,3.9736679999368567,3.9736679999368567,6.07120609,data/final/MP/cifs/As2Eu1Fe1.91Ni0.09-MP-mp-20890-synth_doped.cif,data/source/MP/raw/cifs/mp-20890.cif,mp-20890,0.0,,2014-02-21 09:03:25,8.079887417044961,10.17188/1196086,"@misc{osti_1196086,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Eu(FeAs)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196086"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687595'}},0.0,5.69045342,520.0,-39.43180547,-7.886361094,"{'tags': ['High pressure experimental phase', 'Europium diiron diarsenide - HP', 'Europium diiron diarsenide', 'Europium iron arsenide (1/2/2)']}",-39.43180547,-7.886361094,-0.5763016570000005,"['xas', 'bandstructure']",True,"[169689, 169687, 185355, 169691, 163211, 185356, 610431, 169690, 169688, 163210]",True,2021-05-12 10:56:57.051000,FM,5,16,mp-20890,,Eu(FeAs)2,"{'functional': 'PBE', 'labels': ['Eu', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Eu': 1.0, 'Fe': 2.0, 'As': 2.0}",GGA,mp-20890,"['mp-991161', 'mp-993140', 'mp-20890', 'mp-1069324', 'mp-1069480', 'mp-1069596', 'mp-1069907', 'mp-1070115', 'mp-1069978', 'mp-1442076', 'mp-1687595', 'mp-1782260', 'mp-994461', 'mp-1594012', 'mp-1069557', 'mp-1070074']",6.9579645,"{'Eu': 1.0, 'Fe': 2.0, 'As': 2.0}",84.97992844321493,[],FM,True,139,1,"[6.7, -0.0, -0.0, 0.0, 0.0]",0.0818777401613068,6.9579645,1,6.9579645,MP,data/source/MP/cleaned/cifs/MP-mp-20890.cif,True,,data/final/MP/graphs/As2Eu1Fe1.91Ni0.09-MP-mp-20890-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Mo2Zr1,1,0.0,2.0,False,Mo4Zr2,Mo4Zr2,2.743,Other,True,Mo66.667Zr33.333,Mo-Zr,2,Supercon,Mo2Zr1,MP-mp-2049,Zr2Mo4,Mo-Zr,Mo66.667Zr33.333,F d -3 m,cubic,5.394503490000001,5.39450349,5.39450349,data/final/MP/cifs/Mo2Zr1-MP-mp-2049.cif,data/source/MP/raw/cifs/mp-2049.cif,mp-2049,0.0,,2011-05-13 16:28:26,8.470043894172937,10.17188/1195617,"@misc{osti_1195617,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrMo2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195617"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1673152'}},0.0,6.24392739,520.0,-61.3094724,-10.2182454,"{'tags': ['Molydenum zirconium (2/1)', 'Molybdenum zirconium hydride (2/1/3)', 'Molybdenum zirconium (2/1)']}",-61.3094724,-10.2182454,-0.1385831700000004,"['xas', 'elasticity', 'bandstructure']",True,"[638337, 644509, 105116, 644511, 644517, 644505, 644513, 644514, 644515, 644512, 105115]",True,2021-05-12 10:56:14.760000,NM,6,12,mp-2049,,ZrMo2,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Mo_pv'], 'pot_type': 'paw'}","{'Zr': 1.0, 'Mo': 2.0}",GGA,mp-2049,"['mp-941979', 'mp-941799', 'mp-935151', 'mp-2049', 'mp-1071756', 'mp-1071771', 'mp-1071750', 'mp-1442141', 'mp-1673152', 'mp-1803149', 'mp-1589214', 'mp-1071782']",4.35e-06,"{'Zr': 2.0, 'Mo': 4.0}",111.00420677492372,[],NM,False,166,0,"[0.0, 0.0, 0.0, 0.0, -0.0, 0.0]",7.837540803872818e-08,4.35e-06,0,8.7e-06,MP,data/source/MP/cleaned/cifs/MP-mp-2049.cif,False,,data/final/MP/graphs/Mo2Zr1-MP-mp-2049.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
As2Fe2K0.7Sr0.3,3,0.12,1.0,True,As2Fe2K0.7Sr0.3,As2Fe2K1,12.2,Ferrite,True,As40Fe40K14Sr6,As-Fe-K-Sr,4,Supercon,K0.7Sr0.3Fe2As2,MP-mp-35276,K1Fe2As2,As-Fe-K,As40Fe40K20,I 4/m m m,tetragonal,3.773663997645024,3.773663997645024,7.55368275,data/final/MP/cifs/As2Fe2K0.7Sr0.3-MP-mp-35276-synth_doped.cif,data/source/MP/raw/cifs/mp-35276.cif,mp-35276,0.0,,2013-11-11 09:13:53,4.960691158678031,,,{'GGA': {'task_id': 'mp-1695961'}},0.0,3.49619278,520.0,-28.80228941,-5.760457882,"{'tags': ['Potassium iron arsenide (1/2/2)', 'Potassium iron iron(III) arsenide']}",-28.80228941,-5.760457882,-0.2867273506000004,"['xas', 'elasticity', 'bandstructure']",True,"[189036, 31473]",True,2021-05-12 10:56:27.046000,FM,5,13,mp-35276,,K(FeAs)2,"{'functional': 'PBE', 'labels': ['K_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'K': 1.0, 'Fe': 2.0, 'As': 2.0}",GGA,mp-35276,"['mp-675576', 'mp-936897', 'mp-947308', 'mp-947894', 'mp-1068571', 'mp-1068449', 'mp-1068488', 'mp-35276', 'mp-1441920', 'mp-1695961', 'mp-1796098', 'mp-1593314', 'mp-1068554']",1.3381583,"{'K': 1.0, 'Fe': 2.0, 'As': 2.0}",100.63322517614498,[],FM,True,139,1,"[0.0, 0.8, 0.8, 0.0, 0.0]",0.0132973806380321,1.3381583,2,1.3381583,MP,data/source/MP/cleaned/cifs/MP-mp-35276.cif,True,,data/final/MP/graphs/As2Fe2K0.7Sr0.3-MP-mp-35276-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ce1Co1.9Ru0.1,3,0.0666666666666667,2.0,False,Ce2Co3.8Ru0.2,Ce2Co4,0.47,Heavy_fermion,True,Ce33.333Co63.333Ru3.333,Ce-Co-Ru,3,Supercon,Ce1Ru0.1Co1.9,MP-mp-1112,Ce2Co4,Ce-Co,Ce33.333Co66.667,F d -3 m,cubic,4.99867784,4.99867784,4.99867784,data/final/MP/cifs/Ce1Co1.9Ru0.1-MP-mp-1112-synth_doped.cif,data/source/MP/raw/cifs/mp-1112.cif,mp-1112,0.0,,2011-05-13 09:02:17,9.701049230746174,10.17188/1187580,"@misc{osti_1187580,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeCo2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187580"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686856'}},0.0,8.26937171,520.0,-41.81273492,-6.968789153333333,{'tags': ['Cerium cobalt (1/2)']},-41.81273492,-6.968789153333333,-0.2522142383333327,"['xas', 'bandstructure']",True,"[102094, 620652, 620671, 657905, 108239, 620681, 620677, 620694, 620679, 620691, 620644, 656107, 620672, 620661, 620654]",True,2021-05-12 10:56:51.169000,NM,6,9,mp-1112,,CeCo2,"{'functional': 'PBE', 'labels': ['Ce', 'Co'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Co': 2.0}",GGA,mp-1112,"['mp-930540', 'mp-929975', 'mp-913634', 'mp-1112', 'mp-1440572', 'mp-1686856', 'mp-1801907', 'mp-1593275', 'mp-1596792']",0.0056005,"{'Ce': 2.0, 'Co': 4.0}",88.31824824311025,[],NM,False,227,0,"[0.0, 0.0, -0.0, -0.0, -0.0, -0.0]",0.0001268254321481,0.0056005,0,0.011201,MP,data/source/MP/cleaned/cifs/MP-mp-1112.cif,True,,data/final/MP/graphs/Ce1Co1.9Ru0.1-MP-mp-1112-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Cl1Li0.13N1Zr1,3,0.0707790611943966,4.0,False,Cl4Li0.52N4Zr4,Cl4Li1N4Zr4,12.2,Other,True,Cl31.949Li4.153N31.949Zr31.949,Cl-Li-N-Zr,4,Supercon,Li0.13Zr1N1Cl1,MP-mp-1222362,Li1Zr4N4Cl4,Cl-Li-N-Zr,Cl30.769Li7.692N30.769Zr30.769,R -3 m,trigonal,3.681774253191133,3.681774253191133,19.4360702,data/final/MP/cifs/Cl1Li0.13N1Zr1-MP-mp-1222362-synth_doped.cif,data/source/MP/raw/cifs/mp-1222362.cif,mp-1222362,0.0,,2019-01-12 22:54:36.562000,4.170964502866723,,,,0.0903183780769225,5.20200093,520.0,-98.5732949,-7.582561146153846,{'tags': []},-98.5732949,-7.582561146153846,-1.971803321025641,[],False,[],True,2021-05-12 11:00:49.659000,NM,13,3,mp-1222362,,LiZr4(NCl)4,"{'functional': 'PBE', 'labels': ['Li_sv', 'Zr_sv', 'N', 'Cl'], 'pot_type': 'paw'}","{'Li': 1.0, 'Zr': 4.0, 'N': 4.0, 'Cl': 4.0}",GGA,mp-1222362,"['mp-1222362', 'mp-1411613', 'mp-1872376']",0.0031614,"{'Li': 1.0, 'Zr': 4.0, 'N': 4.0, 'Cl': 4.0}",226.7986027084237,[],NM,False,166,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.3939239317379532e-05,0.0031614,0,0.0031614,MP,data/source/MP/cleaned/cifs/MP-mp-1222362.cif,True,,data/final/MP/graphs/Cl1Li0.13N1Zr1-MP-mp-1222362-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Al0.9Nb3Zn0.1,2,0.0499999999999999,2.0,False,Al1.8Nb6Zn0.2,Al2Nb6,18.1,Other,True,Al22.5Nb75Zn2.5,Al-Nb-Zn,3,Supercon,Nb3Al0.9Zn0.1,MP-mp-796,Nb6Al2,Al-Nb,Al25Nb75,P m -3 n,cubic,5.215254,5.215254,5.215254,data/final/MP/cifs/Al0.9Nb3Zn0.1-MP-mp-796-synth_doped.cif,data/source/MP/raw/cifs/mp-796.cif,mp-796,0.0,,2011-05-13 16:07:37,7.157298025966356,,,{'GGA': {'task_id': 'mp-1686893'}},0.0460773865000003,5.52947534,520.0,-69.48918494,-8.6861481175,"{'tags': ['Aluminium niobium (1/3)', 'Niobium aluminide (3/1)', 'Aluminum niobium (1/3)']}",-69.48918494,-8.6861481175,-0.1737753800000003,"['bandstructure', 'elasticity']",True,"[608675, 608654, 608688, 608668, 608669, 608685, 608676, 608683, 58014, 608657, 107856, 608655, 608666, 608691, 608656, 608665, 608673, 608653, 608661]",True,2021-05-12 10:56:31.128000,NM,8,10,mp-796,,Nb3Al,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Al': 1.0}",GGA,mp-796,"['mp-911586', 'mp-927906', 'mp-796', 'mp-927472', 'mp-1260512', 'mp-1440919', 'mp-1686893', 'mp-1927652', 'mp-1591599', 'mp-1587739']",0.16323955,"{'Nb': 6.0, 'Al': 2.0}",141.8490379078192,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0023015954483396,0.16323955,0,0.3264791,MP,data/source/MP/cleaned/cifs/MP-mp-796.cif,True,,data/final/MP/graphs/Al0.9Nb3Zn0.1-MP-mp-796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Sn1Zr4,3,0.1,1.5,False,Sn1.5Zr6,Sn2Zr6,0.92,Other,True,Sn20Zr80,Sn-Zr,2,Supercon,Sn1Zr4,MP-mp-30876,Zr6Sn2,Sn-Zr,Sn25Zr75,P m -3 n,cubic,5.651281,5.651281,5.651281,data/final/MP/cifs/Sn1Zr4-MP-mp-30876-synth_doped.cif,data/source/MP/raw/cifs/mp-30876.cif,mp-30876,0.0,,2014-02-24 05:50:04,7.220170653441738,10.17188/1205229,"@misc{osti_1205229,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Zr3Sn (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1205229"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704348'}},0.0116640699999992,5.87615628,520.0,-62.22556685,-7.77819585625,{'tags': ['Tin zirconium (1/3)']},-62.22556685,-7.77819585625,-0.3650274200000005,"['xas', 'elasticity', 'bandstructure']",True,[106108],True,2021-05-12 10:56:18.721000,NM,8,8,mp-30876,,Zr3Sn,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Sn_d'], 'pot_type': 'paw'}","{'Zr': 3.0, 'Sn': 1.0}",GGA,mp-30876,"['mp-942117', 'mp-932855', 'mp-943128', 'mp-30876', 'mp-1418366', 'mp-1704348', 'mp-1833457', 'mp-1601379']",0.05753415,"{'Zr': 6.0, 'Sn': 2.0}",180.48483098389104,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0006375510859983,0.05753415,0,0.1150683,MP,data/source/MP/cleaned/cifs/MP-mp-30876.cif,True,,data/final/MP/graphs/Sn1Zr4-MP-mp-30876-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ni27Zr73,2,0.04,0.0740712836123795,False,Ni2Zr5.407,Ni2Zr6,3.1,Other,True,Ni27Zr73,Ni-Zr,2,Supercon,Ni27Zr73,MP-mp-1188073,Zr6Ni2,Ni-Zr,Ni25Zr75,P 63/m m c,hexagonal,4.896295,6.064418005027057,6.06441883,data/final/MP/cifs/Ni27Zr73-MP-mp-1188073-synth_doped.cif,data/source/MP/raw/cifs/mp-1188073.cif,mp-1188073,0.0,,2019-01-11 15:34:08.753000,7.07812709883652,,,{'GGA': {'task_id': 'mp-1730307'}},0.2678923887499991,4.81016384,520.0,-62.64172784,-7.83021598,{'tags': []},-62.64172784,-7.83021598,0.0255936624999986,['bandstructure'],True,[],True,2021-05-12 10:58:31.620000,NM,8,5,mp-1188073,,Zr3Ni,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Ni_pv'], 'pot_type': 'paw'}","{'Zr': 3.0, 'Ni': 1.0}",GGA,mp-1188073,"['mp-1188073', 'mp-1399727', 'mp-1730307', 'mp-1929912', 'mp-1619498']",0.00082625,"{'Zr': 6.0, 'Ni': 2.0}",155.94682700084778,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.0596560582736426e-05,0.00082625,0,0.0016525,MP,data/source/MP/cleaned/cifs/MP-mp-1188073.cif,True,,data/final/MP/graphs/Ni27Zr73-MP-mp-1188073-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Mo0.3Tc0.7,3,0.1,4.0,False,Mo1.2Tc2.8,Mo1Tc3,12.0,Other,True,Mo30Tc70,Mo-Tc,2,Supercon,Mo0.3Tc0.7,MP-mp-1187395,Tc3Mo1,Mo-Tc,Mo25Tc75,P m -3 m,cubic,3.914319,3.914319,3.914319,data/final/MP/cifs/Mo0.3Tc0.7-MP-mp-1187395-synth_doped.cif,data/source/MP/raw/cifs/mp-1187395.cif,mp-1187395,0.0,,2019-01-11 15:03:16.119000,10.796381868720824,,,{'GGA': {'task_id': 'mp-1733975'}},0.1169263725,8.23961456,520.0,-41.45979727,-10.3649493175,{'tags': []},-41.45979727,-10.3649493175,0.1169263725,['bandstructure'],True,[],True,2021-05-12 10:58:31.620000,NM,4,5,mp-1187395,,Tc3Mo,"{'functional': 'PBE', 'labels': ['Tc_pv', 'Mo_pv'], 'pot_type': 'paw'}","{'Tc': 3.0, 'Mo': 1.0}",GGA,mp-1187395,"['mp-1187395', 'mp-1436691', 'mp-1733975', 'mp-1793356', 'mp-1584941']",0.0069778,"{'Tc': 3.0, 'Mo': 1.0}",59.97477780088212,[],NM,False,221,0,"[0.0, 0.0, 0.0, -0.0]",0.0001163455748542,0.0069778,0,0.0069778,MP,data/source/MP/cleaned/cifs/MP-mp-1187395.cif,True,,data/final/MP/graphs/Mo0.3Tc0.7-MP-mp-1187395-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
C1Cu1Sr2O5,1,0.0,4.0,False,C4Cu4Sr8O20,C4Cu4Sr8O20,0.0,Cuprate,True,C11.111Cu11.111Sr22.222O55.55555555555556,C-Cu-Sr-O,4,Supercon,Sr2Cu1C1O5,MP-mp-1198030,Sr8Cu4C4O20,C-Cu-Sr-O,C11.111Cu11.111Sr22.222O55.55555555555556,I -4,tetragonal,7.877744002100394,7.877744002100395,9.46755054,data/final/MP/cifs/C1Cu1Sr2O5-MP-mp-1198030.cif,data/source/MP/raw/cifs/mp-1198030.cif,mp-1198030,0.0,,2019-01-12 02:53:33.853000,4.624821022244182,,,{'GGA': {'task_id': 'mp-1742814'}},0.0386187874999981,3.47889523,520.0,-237.90163358,-6.608378710555556,"{'tags': ['Distrontium copper dioxide carbonate - LT', 'Distrontium copper dioxide carbonate']}",-237.90163358,-6.608378710555556,-2.385069899259259,['bandstructure'],True,"[78650, 83095]",True,2021-05-12 10:58:37.524000,NM,36,6,mp-1198030,oxide,Sr2CuCO5,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Cu_pv', 'C', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Cu': 1.0, 'C': 1.0, 'O': 5.0}",GGA,mp-1198030,"['mp-1198030', 'mp-1200477', 'mp-1399692', 'mp-1742814', 'mp-1929945', 'mp-1655225']",0.000743875,"{'Sr': 8.0, 'Cu': 4.0, 'C': 4.0, 'O': 20.0}",475.08507610840775,[],NM,False,82,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.263088759540475e-06,0.000743875,0,0.0029755,MP,data/source/MP/cleaned/cifs/MP-mp-1198030.cif,False,,data/final/MP/graphs/C1Cu1Sr2O5-MP-mp-1198030.json,0,True,-4,0,0,0,0,2,0,0,0,0,1,0,1.0,False
Mo6Na2Se6,1,0.0,1.0,True,Mo6Na2Se6,Mo6Na2Se6,0.0,Chevrel,True,Mo42.857Na14.286Se42.857,Mo-Na-Se,3,Supercon,Na2Mo6Se6,MP-mp-1186069,Na2Mo6Se6,Mo-Na-Se,Mo42.857Na14.286Se42.857,P 63/m,hexagonal,4.525872,8.823916004514617,8.82391651,data/final/MP/cifs/Mo6Na2Se6-MP-mp-1186069.cif,data/source/MP/raw/cifs/mp-1186069.cif,mp-1186069,0.4380000000000006,,2019-01-11 14:02:37.885000,5.960161932794943,,,{'GGA': {'task_id': 'mp-1737087'}},0.0,4.80971312,520.0,-97.49857949,-6.964184249285714,"{'tags': ['Sodium molybdenum(I/II) selenide (1/3/3)', 'Chevrel phase', 'TlFe3Te3', 'NaMo3Se3']}",-97.49857949,-6.964184249285714,-0.8311572755118531,[],False,[603625],True,2021-05-12 10:59:52.436000,NM,14,4,mp-1186069,,Na(MoSe)3,"{'functional': 'PBE', 'labels': ['Na_pv', 'Mo_pv', 'Se'], 'pot_type': 'paw'}","{'Na': 1.0, 'Mo': 3.0, 'Se': 3.0}",GGA,mp-1186069,"['mp-1186069', 'mp-1384493', 'mp-1737087', 'mp-1811068']",8.035e-05,"{'Na': 2.0, 'Mo': 6.0, 'Se': 6.0}",305.1797144176251,[],NM,False,176,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.265749733944932e-07,8.035e-05,0,0.0001607,MP,data/source/MP/cleaned/cifs/MP-mp-1186069.cif,False,,data/final/MP/graphs/Mo6Na2Se6-MP-mp-1186069.json,0,True,6/m,0,3,0,0,0,0,0,1,0,0,0,1.0,False
Ga0.21V0.79,3,0.08,8.0,False,Ga1.68V6.32,Ga2V6,10.0,Other,True,Ga21V79,Ga-V,2,Supercon,Ga0.21V0.79,MP-mp-22568,V6Ga2,Ga-V,Ga25V75,P m -3 n,cubic,4.789645,4.789645,4.789645,data/final/MP/cifs/Ga0.21V0.79-MP-mp-22568-synth_doped.cif,data/source/MP/raw/cifs/mp-22568.cif,mp-22568,0.0,,2014-02-22 11:36:40,6.726541666276222,10.17188/1198793,"@misc{osti_1198793,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Ga (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198793"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686867'}},0.0,5.67452231,520.0,-61.95244347,-7.74405543375,{'tags': ['Gallium vanadium (1/3)']},-61.95244347,-7.74405543375,-0.1741018756249994,"['xas', 'elasticity', 'bandstructure']",True,"[635643, 635628, 635619, 635634, 104021, 635646, 635604, 635610, 635617, 635624, 635626, 635605, 635631, 635625, 635636, 635603, 104020, 635616, 635607]",True,2021-05-12 10:56:16.728000,FM,8,9,mp-22568,,V3Ga,"{'functional': 'PBE', 'labels': ['V_pv', 'Ga_d'], 'pot_type': 'paw'}","{'V': 3.0, 'Ga': 1.0}",GGA,mp-22568,"['mp-941343', 'mp-941663', 'mp-934924', 'mp-22568', 'mp-1440749', 'mp-1686867', 'mp-1804076', 'mp-1593784', 'mp-1595713']",0.09063635,"{'V': 6.0, 'Ga': 2.0}",109.87780534443452,[],FM,True,131,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.0, -0.0, -0.0]",0.0016497662965852,0.09063635,2,0.1812727,MP,data/source/MP/cleaned/cifs/MP-mp-22568.cif,True,,data/final/MP/graphs/Ga0.21V0.79-MP-mp-22568-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Yb1,1,0.0,3.0,False,Yb3,Yb3,0.0,Heavy_fermion,True,Yb100,Yb,1,Supercon,Yb1,MP-mp-972364,Yb3,Yb,Yb100,R -3 m,trigonal,3.8789741927957206,3.878974192795721,9.70452294,data/final/MP/cifs/Yb1-MP-mp-972364.cif,data/source/MP/raw/cifs/mp-972364.cif,mp-972364,0.0,,2015-09-16 00:14:43,7.005866629959364,10.17188/1282044,"@misc{osti_1282044,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Yb (SG:166) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1282044"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1759580'}},0.0,1.41994628,520.0,-4.61882484,-1.5396082800000002,{'tags': []},-4.61882484,-1.5396082800000002,0.0,"['xas', 'elasticity', 'bandstructure', 'surfaces']",True,[],True,2021-05-12 10:56:35.166000,NM,3,8,mp-972364,,Yb,"{'functional': 'PBE', 'labels': ['Yb_2'], 'pot_type': 'paw'}",{'Yb': 1.0},GGA,mp-972364,"['mp-1005218', 'mp-1005233', 'mp-972364', 'mp-1446617', 'mp-1759580', 'mp-1805159', 'mp-1010787', 'mp-1617513']",0.0005049,{'Yb': 3.0},123.04245652737924,[],NM,False,166,0,"[0, 0, 0]",1.2310384908992377e-05,0.0005049,0,0.0015147,MP,data/source/MP/cleaned/cifs/MP-mp-972364.cif,False,,data/final/MP/graphs/Yb1-MP-mp-972364.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
N0.75V1,3,0.1428571428571428,1.0,True,N0.75V1,N1V1,2.3,Other,True,N42.857V57.143,N-V,2,Supercon,N0.75V1,MP-mp-1018027,V1N1,N-V,N50V50,P -6 m 2,hexagonal,2.650884,2.7441139966135384,2.74411362,data/final/MP/cifs/N0.75V1-MP-mp-1018027-synth_doped.cif,data/source/MP/raw/cifs/mp-1018027.cif,mp-1018027,0.0,,2017-04-06 22:50:08,6.238650289574885,10.17188/1350109,"@article{osti_1350109,
    author = ""Persson, Kristin"",
    title = ""Materials Data on VN (SG:187) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1350109"",
    place = ""United States"",
    year = ""2017"",
    month = ""4""
}
",{'GGA': {'task_id': 'mp-1708543'}},0.0,8.01774245,520.0,-19.7434431,-9.87172155,"{'tags': ['Tantalum nitride', 'Vanadium nitride', 'Niobium nitride']}",-19.7434431,-9.87172155,-1.3420210524999998,"['xas', 'bandstructure']",True,"[169820, 236426, 236427, 236425, 191061]",True,2021-05-12 10:56:51.169000,NM,2,29,mp-1018027,,VN,"{'functional': 'PBE', 'labels': ['V_pv', 'N'], 'pot_type': 'paw'}","{'V': 1.0, 'N': 1.0}",GGA,mp-1018027,"['mp-1018027', 'mp-1018232', 'mp-1018180', 'mp-1018364', 'mp-1057791', 'mp-1057832', 'mp-1057871', 'mp-1058279', 'mp-1058305', 'mp-1058336', 'mp-1058343', 'mp-1058365', 'mp-1058410', 'mp-1059217', 'mp-1059301', 'mp-1059342', 'mp-1059261', 'mp-1059121', 'mp-1059171', 'mp-1115473', 'mp-1423003', 'mp-1708543', 'mp-1790797', 'mp-1607807', 'mp-1059185', 'mp-1058318', 'mp-1058380', 'mp-1057845', 'mp-1059319']",0.0042068,"{'V': 1.0, 'N': 1.0}",17.287236565507055,[],NM,False,187,0,"[0, 0]",0.0002433471644851,0.0042068,0,0.0042068,MP,data/source/MP/cleaned/cifs/MP-mp-1018027.cif,True,,data/final/MP/graphs/N0.75V1-MP-mp-1018027-synth_doped.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Nb0.5Ta0.5,1,0.0,2.0,False,Nb1Ta1,Nb1Ta1,6.09,Other,True,Nb50Ta50,Nb-Ta,2,Supercon,Nb0.5Ta0.5,MP-mp-1217892,Ta1Nb1,Nb-Ta,Nb50Ta50,C m m m,orthorhombic,2.87873582,2.87873582,4.693674,data/final/MP/cifs/Nb0.5Ta0.5-MP-mp-1217892.cif,data/source/MP/raw/cifs/mp-1217892.cif,mp-1217892,0.0,,2019-01-12 19:09:10.960000,12.407336172495045,,,{'GGA': {'task_id': 'mp-1675862'}},0.0001007699999995,5.09964765,520.0,-21.95888113,-10.979440565,{'tags': []},-21.95888113,-10.979440565,0.0001007699999995,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,2,5,mp-1217892,,TaNb,"{'functional': 'PBE', 'labels': ['Ta_pv', 'Nb_pv'], 'pot_type': 'paw'}","{'Ta': 1.0, 'Nb': 1.0}",GGA,mp-1217892,"['mp-1217892', 'mp-1382606', 'mp-1675862', 'mp-1791691', 'mp-1610242']",0.0026552,"{'Ta': 1.0, 'Nb': 1.0}",36.65135617852667,[],NM,False,65,0,"[0, 0]",7.244479541402703e-05,0.0026552,0,0.0026552,MP,data/source/MP/cleaned/cifs/MP-mp-1217892.cif,False,,data/final/MP/graphs/Nb0.5Ta0.5-MP-mp-1217892.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
As1Co0.075Fe0.925Li1,2,0.0499999999999999,2.0,False,As2Co0.15Fe1.85Li2,As2Fe2Li2,7.66,Ferrite,True,As33.333Co2.5Fe30.833Li33.333,As-Co-Fe-Li,4,Supercon,Li1Fe0.925Co0.075As1,MP-mp-21471,Li2Fe2As2,As-Fe-Li,As33.333Fe33.333Li33.333,P 4/n m m,tetragonal,3.790629,3.790629,6.107451,data/final/MP/cifs/As1Co0.075Fe0.925Li1-MP-mp-21471-synth_doped.cif,data/source/MP/raw/cifs/mp-21471.cif,mp-21471,0.0,,2013-10-29 11:57:13,5.21140049061562,10.17188/1196927,"@misc{osti_1196927,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LiFeAs (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196927"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686578'}},0.0,4.20304559,520.0,-32.72438031,-5.454063385,"{'tags': ['Lithium iron arsenide', 'Iron lithium arsenide']}",-32.72438031,-5.454063385,-0.4413801444444445,"['xas', 'elasticity']",False,"[290700, 168206, 610480, 169175, 162250, 162056, 166457, 163870]",True,2021-05-12 10:56:16.728000,FM,6,18,mp-21471,,LiFeAs,"{'functional': 'PBE', 'labels': ['Li_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Li': 1.0, 'Fe': 1.0, 'As': 1.0}",GGA,mp-21471,"['mp-917215', 'mp-674647', 'mp-919059', 'mp-920059', 'mp-1071407', 'mp-21471', 'mp-1071451', 'mp-38403', 'mp-33848', 'mp-37001', 'mp-34336', 'mp-36599', 'mp-36822', 'mp-36276', 'mp-1439936', 'mp-1686578', 'mp-1784376', 'mp-1071444']",0.2682074,"{'Li': 2.0, 'Fe': 2.0, 'As': 2.0}",87.75715855248485,[],FM,True,129,1,"[-0.0, -0.0, 0.3, 0.3, -0.0, -0.0]",0.0061124905232567,0.2682074,2,0.5364148,MP,data/source/MP/cleaned/cifs/MP-mp-21471.cif,True,,data/final/MP/graphs/As1Co0.075Fe0.925Li1-MP-mp-21471-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Sb0.236V0.764,2,0.028,8.0,False,Sb1.888V6.112,Sb2V6,0.0,Other,True,Sb23.6V76.4,Sb-V,2,Supercon,Sb0.236V0.764,MP-mp-1555,V6Sb2,Sb-V,Sb25V75,P m -3 n,cubic,4.935,4.935,4.935,data/final/MP/cifs/Sb0.236V0.764-MP-mp-1555-synth_doped.cif,data/source/MP/raw/cifs/mp-1555.cif,mp-1555,0.0,,2011-05-13 19:31:48,7.587411530928405,10.17188/1191232,"@misc{osti_1191232,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Sb (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191232"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699451'}},0.0,8.2538452,520.0,-64.48303092,-8.060378865,"{'tags': ['Vanadium antimonide (1/3)', 'Vanadium antimonide (3/1)']}",-64.48303092,-8.060378865,-0.2631990025000004,"['xas', 'elasticity', 'bandstructure']",True,"[651731, 52330, 106037, 651717]",True,2021-05-12 10:56:12.755000,NM,8,8,mp-1555,,V3Sb,"{'functional': 'PBE', 'labels': ['V_pv', 'Sb'], 'pot_type': 'paw'}","{'V': 3.0, 'Sb': 1.0}",GGA,mp-1555,"['mp-926619', 'mp-927153', 'mp-911044', 'mp-1555', 'mp-1413633', 'mp-1699451', 'mp-1805224', 'mp-1596724']",0.0044149,"{'V': 6.0, 'Sb': 2.0}",120.18810037499998,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",7.34665076862856e-05,0.0044149,0,0.0088298,MP,data/source/MP/cleaned/cifs/MP-mp-1555.cif,True,,data/final/MP/graphs/Sb0.236V0.764-MP-mp-1555-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Au0.98Ga2Pd0.02,2,0.0133333333333333,1.0,True,Au0.98Ga2Pd0.02,Au1Ga2,1.51,Other,True,Au32.667Ga66.667Pd0.667,Au-Ga-Pd,3,Supercon,Au0.98Pd0.02Ga2,MP-mp-2776,Ga2Au1,Au-Ga,Au33.333Ga66.667,F m -3 m,cubic,4.40327555,4.40327555,4.40327555,data/final/MP/cifs/Au0.98Ga2Pd0.02-MP-mp-2776-synth_doped.cif,data/source/MP/raw/cifs/mp-2776.cif,mp-2776,0.0,,2011-05-12 21:57:19,9.253557284351938,10.17188/1201942,"@misc{osti_1201942,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ga2Au (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201942"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687524'}},0.0,3.58527429,520.0,-10.04441228,-3.3481374266666664,"{'tags': ['Gold gallium (1/2)', 'Gallium gold (2/1)']}",-10.04441228,-3.3481374266666664,-0.2381128983333328,"['xas', 'elasticity', 'bandstructure']",True,"[611874, 611864, 150958, 58458]",True,2021-05-12 10:56:18.721000,NM,3,8,mp-2776,,Ga2Au,"{'functional': 'PBE', 'labels': ['Ga_d', 'Au'], 'pot_type': 'paw'}","{'Ga': 2.0, 'Au': 1.0}",GGA,mp-2776,"['mp-991379', 'mp-2776', 'mp-993315', 'mp-1439079', 'mp-1687524', 'mp-1795480', 'mp-994626', 'mp-1589089']",0.000866,"{'Ga': 2.0, 'Au': 1.0}",60.36880695215696,[],NM,False,225,0,"[0, 0, 0]",1.4345156774198237e-05,0.000866,0,0.000866,MP,data/source/MP/cleaned/cifs/MP-mp-2776.cif,True,,data/final/MP/graphs/Au0.98Ga2Pd0.02-MP-mp-2776-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Fe1.99K0.8Mn0.01Se2,3,0.0666666666666666,1.0,True,Fe1.99K0.8Mn0.01Se2,Fe2K1Se2,31.0,Ferrite,True,Fe41.458K16.667Mn0.208Se41.667,Fe-K-Mn-Se,4,Supercon,K0.8Fe1.99Mn0.01Se2,MP-mp-1070735,K1Fe2Se2,Fe-K-Se,Fe40K20Se40,I 4/m m m,tetragonal,3.783558000712664,3.783558000712664,7.91886339,data/final/MP/cifs/Fe1.99K0.8Mn0.01Se2-MP-mp-1070735-synth_doped.cif,data/source/MP/raw/cifs/mp-1070735.cif,mp-1070735,0.0,,2018-03-22 03:52:22,4.804538531009527,,,{'GGA': {'task_id': 'mp-1761650'}},0.0327827750000011,3.42423866,520.0,-27.50456218,-5.500912436,{'tags': ['Potassium iron selenide (1/2/2)']},-27.50456218,-5.500912436,-0.6812646755374999,['bandstructure'],True,[186573],True,2021-05-12 10:58:14.654000,FM,5,8,mp-1070735,,K(FeSe)2,"{'functional': 'PBE', 'labels': ['K_sv', 'Fe_pv', 'Se'], 'pot_type': 'paw'}","{'K': 1.0, 'Fe': 2.0, 'Se': 2.0}",GGA,mp-1070735,"['mp-1070735', 'mp-1070765', 'mp-1070841', 'mp-1416829', 'mp-1761650', 'mp-1797161', 'mp-1585994', 'mp-1070830']",6.0503851,"{'K': 1.0, 'Fe': 2.0, 'Se': 2.0}",106.69540665041993,[],FM,True,139,1,"[0.0, 2.8, 2.8, 0.0, 0.0]",0.0567070813069176,6.0503851,2,6.0503851,MP,data/source/MP/cleaned/cifs/MP-mp-1070735.cif,True,,data/final/MP/graphs/Fe1.99K0.8Mn0.01Se2-MP-mp-1070735-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ho2Rh3Sn5,1,0.0,2.0,False,Ho4Rh6Sn10,Ho4Rh6Sn10,0.0,Other,True,Ho20Rh30Sn50,Ho-Rh-Sn,3,Supercon,Ho2Rh3Sn5,MP-mp-1188971,Ho4Sn10Rh6,Ho-Rh-Sn,Ho20Rh30Sn50,C m c 21,orthorhombic,4.391495999950056,7.340415,13.46326204,data/final/MP/cifs/Ho2Rh3Sn5-MP-mp-1188971.cif,data/source/MP/raw/cifs/mp-1188971.cif,mp-1188971,0.0,,2019-01-11 19:50:39.445000,9.556641754620763,,,{'GGA': {'task_id': 'mp-1675256'}},0.0,7.47172744,520.0,-116.45274325,-5.8226371625,"{'tags': ['Holmium rhodium stannide (2/3/5)', 'Ho2Rh3Sn5', 'Y2Rh3Sn5']}",-116.45274325,-5.8226371625,-0.6920771000000002,['bandstructure'],True,[639639],True,2021-05-12 10:58:33.577000,NM,20,5,mp-1188971,,Ho2Sn5Rh3,"{'functional': 'PBE', 'labels': ['Ho_3', 'Sn_d', 'Rh_pv'], 'pot_type': 'paw'}","{'Ho': 2.0, 'Sn': 5.0, 'Rh': 3.0}",GGA,mp-1188971,"['mp-1188971', 'mp-1382481', 'mp-1675256', 'mp-1814475', 'mp-1637623']",5.17e-05,"{'Ho': 4.0, 'Sn': 10.0, 'Rh': 6.0}",428.1828917566909,[],NM,False,36,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.4148559410158697e-07,5.17e-05,0,0.0001034,MP,data/source/MP/cleaned/cifs/MP-mp-1188971.cif,False,,data/final/MP/graphs/Ho2Rh3Sn5-MP-mp-1188971.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Ce0.15Cu1Sm1.85O4,2,0.0428571428571428,1.0,True,Ce0.15Cu1Sm1.85O4,Cu1Sm2O4,18.05714286,Cuprate,True,Ce2.143Cu14.286Sm26.429O57.142857142857146,Ce-Cu-Sm-O,4,Supercon,Sm1.85Ce0.15Cu1O4,MP-mp-4210,Sm2Cu1O4,Cu-Sm-O,Cu14.286Sm28.571O57.142857142857146,I 4/m m m,tetragonal,3.936481999770292,3.936481999770292,6.66682973,data/final/MP/cifs/Ce0.15Cu1Sm1.85O4-MP-mp-4210-synth_doped.cif,data/source/MP/raw/cifs/mp-4210.cif,mp-4210,0.0,,2011-05-13 10:20:22,7.575626216473968,10.17188/1207966,"@misc{osti_1207966,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sm2CuO4 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207966"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-670158'}},0.0084157301785579,3.24265454,520.0,-51.71666507,-7.38809501,"{'tags': ['Samarium cuprate', 'Disamarium copper oxide', 'Disamarium copper tetraoxide']}",-51.71666507,-7.38809501,-3.0194917299999995,"['xas', 'elasticity', 'bandstructure']",True,"[261378, 72243, 71182, 95371, 261377]",True,2021-05-12 10:56:20.740000,NM,7,8,mp-4210,oxide,Sm2CuO4,"{'functional': 'PBE', 'labels': ['Sm_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sm': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-4210,"['mp-660482', 'mp-670158', 'mp-4210', 'mp-1412888', 'mp-1702500', 'mp-1798108', 'mp-1589420', 'mp-688388']",0.0004776,"{'Sm': 2.0, 'Cu': 1.0, 'O': 4.0}",93.8732216032902,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",5.087712894507291e-06,0.0004776,0,0.0004776,MP,data/source/MP/cleaned/cifs/MP-mp-4210.cif,True,,data/final/MP/graphs/Ce0.15Cu1Sm1.85O4-MP-mp-4210-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Mo1Pt2,1,0.0,1.0,True,Mo1Pt2,Mo1Pt2,0.0,Other,True,Mo33.333Pt66.667,Mo-Pt,2,Supercon,Mo1Pt2,MP-mp-952,Mo1Pt2,Mo-Pt,Mo33.333Pt66.667,I m m m,orthorhombic,2.7651859985026457,4.003033997688403,4.84790974,data/final/MP/cifs/Mo1Pt2-MP-mp-952.cif,data/source/MP/raw/cifs/mp-952.cif,mp-952,0.0,,2011-05-12 21:16:50,17.39009883847262,10.17188/1313304,"@misc{osti_1313304,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MoPt2 (SG:71) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1313304"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668258'}},0.0,8.22307555,520.0,-24.05726539,-8.019088463333334,"{'tags': ['Molybdenum platinum (1/2)', 'Molydenum platinum (1/2)']}",-24.05726539,-8.019088463333334,-0.3566023133333343,"['xas', 'elasticity', 'bandstructure']",True,"[644167, 105070, 161107, 644155]",True,2021-05-12 10:56:35.166000,NM,3,12,mp-952,,MoPt2,"{'functional': 'PBE', 'labels': ['Mo_pv', 'Pt'], 'pot_type': 'paw'}","{'Mo': 1.0, 'Pt': 2.0}",GGA,mp-952,"['mp-920022', 'mp-919007', 'mp-906196', 'mp-952', 'mp-1063404', 'mp-1063530', 'mp-1063319', 'mp-1439989', 'mp-1668258', 'mp-1793461', 'mp-1588907', 'mp-1063448']",0.0013822,"{'Mo': 1.0, 'Pt': 2.0}",46.417293661436695,[],NM,False,71,0,"[0, 0, 0]",2.977769471183811e-05,0.0013822,0,0.0013822,MP,data/source/MP/cleaned/cifs/MP-mp-952.cif,False,,data/final/MP/graphs/Mo1Pt2-MP-mp-952.json,0,True,mmm,0,0,0,7,0,0,0,0,0,1,0,1.0,False
Cu1Te1,1,0.0,2.0,False,Cu2Te2,Cu2Te2,0.0,Other,True,Cu50Te50,Cu-Te,2,Supercon,Cu1Te1,MP-mp-20826,Cu2Te2,Cu-Te,Cu50Te50,P m m n,orthorhombic,3.195561,4.040864,7.128868,data/final/MP/cifs/Cu1Te1-MP-mp-20826.cif,data/source/MP/raw/cifs/mp-20826.cif,mp-20826,0.0,,2014-02-21 08:23:56,6.896081538150364,10.17188/1196028,"@misc{osti_1196028,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CuTe (SG:59) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196028"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687864'}},0.0,6.02620216,520.0,-14.74894129,-3.6872353225,"{'tags': ['Vulcanite', 'Copper telluride']}",-14.74894129,-3.6872353225,-0.2769815224999998,"['xas', 'elasticity', 'bandstructure']",True,"[44993, 43273, 42591, 93966, 660104]",True,2021-05-12 10:56:14.760000,NM,4,12,mp-20826,,CuTe,"{'functional': 'PBE', 'labels': ['Cu_pv', 'Te'], 'pot_type': 'paw'}","{'Cu': 1.0, 'Te': 1.0}",GGA,mp-20826,"['mp-988114', 'mp-987817', 'mp-20826', 'mp-1066020', 'mp-1065991', 'mp-1066113', 'mp-1439215', 'mp-1687864', 'mp-1797532', 'mp-988722', 'mp-1587594', 'mp-1066056']",7.25e-06,"{'Cu': 2.0, 'Te': 2.0}",92.0538420749174,[],NM,False,59,0,"[0, 0, 0, 0]",1.5751651069815506e-07,7.25e-06,0,1.45e-05,MP,data/source/MP/cleaned/cifs/MP-mp-20826.cif,False,,data/final/MP/graphs/Cu1Te1-MP-mp-20826.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
As1F1Fe1Sr1,1,0.0,2.0,False,As2F2Fe2Sr2,As2F2Fe2Sr2,0.0,Ferrite,True,As25F25Fe25Sr25,As-F-Fe-Sr,4,Supercon,Sr1Fe1As1F1,MP-mp-20807,Sr2Fe2As2F2,As-F-Fe-Sr,As25F25Fe25Sr25,P 4/n m m,tetragonal,4.157413,4.157413,9.372332,data/final/MP/cifs/As1F1Fe1Sr1-MP-mp-20807.cif,data/source/MP/raw/cifs/mp-20807.cif,mp-20807,0.0,,2018-04-13 12:50:49,4.866742499159453,,,{'GGA+U': {'task_id': 'mp-1696380'}},0.2379540762499967,3.54876534,520.0,-41.4894831,-5.1861853875,"{'tags': ['Strontium iron arsenide fluoride', 'High pressure experimental phase', 'LaFeAsO', 'SrFeAsF lt']}",-41.4894831,-5.1861853875,-1.683160568541667,['bandstructure'],True,"[186506, 162808, 186507, 168774, 163916, 163915, 168775]",True,2021-05-12 10:58:49.477000,FM,8,12,mp-20807,,SrFeAsF,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Fe_pv', 'As', 'F'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Fe': 1.0, 'As': 1.0, 'F': 1.0}",GGA+U,mp-20807,"['mp-1078931', 'mp-1078979', 'mp-1079045', 'mp-1079606', 'mp-1080125', 'mp-1080447', 'mp-1091412', 'mp-20807', 'mp-1441549', 'mp-1696380', 'mp-1779098', 'mp-1595923']",3.9344288,"{'Sr': 2.0, 'Fe': 2.0, 'As': 2.0, 'F': 2.0}",161.99216280978374,[],FM,True,129,1,"[0.0, 0.0, 3.7, 3.7, 0.0, 0.0, 0.0, 0.0]",0.0485755450357179,3.9344288,2,7.8688576,MP,data/source/MP/cleaned/cifs/MP-mp-20807.cif,False,,data/final/MP/graphs/As1F1Fe1Sr1-MP-mp-20807.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Bi1Ce1Pd1,1,0.0,1.0,True,Bi1Ce1Pd1,Bi1Ce1Pd1,1.3,Heavy_fermion,True,Bi33.333Ce33.333Pd33.333,Bi-Ce-Pd,3,Supercon,Ce1Pd1Bi1,MP-mp-604453,Ce1Bi1Pd1,Bi-Ce-Pd,Bi33.333Ce33.333Pd33.333,F -4 3 m,cubic,4.86780511,4.86780511,4.86780511,data/final/MP/cifs/Bi1Ce1Pd1-MP-mp-604453.cif,data/source/MP/raw/cifs/mp-604453.cif,mp-604453,0.0,,2013-05-24 22:07:27,9.274031508788498,10.17188/1277388,"@misc{osti_1277388,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeBiPd (SG:216) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277388"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672024'}},0.0,6.63617791,520.0,-17.55202691,-5.850675636666666,"{'tags': ['Cerium palladium bismuth (1/1/1)', 'Cerium palladium bismuthide (1/1/1)']}",-17.55202691,-5.850675636666666,-0.849673878333333,"['xas', 'bandstructure']",True,"[161758, 616563]",True,2021-05-12 10:57:28.836000,FM,3,8,mp-604453,,CeBiPd,"{'functional': 'PBE', 'labels': ['Ce', 'Bi', 'Pd'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Bi': 1.0, 'Pd': 1.0}",GGA,mp-604453,"['mp-604453', 'mp-918992', 'mp-919991', 'mp-906166', 'mp-1438963', 'mp-1672024', 'mp-1802138', 'mp-1596641']",0.997551,"{'Ce': 1.0, 'Bi': 1.0, 'Pd': 1.0}",81.5613767281457,[],FM,True,216,1,"[0.9, 0.0, 0.0]",0.0122306787847017,0.997551,1,0.997551,MP,data/source/MP/cleaned/cifs/MP-mp-604453.cif,False,,data/final/MP/graphs/Bi1Ce1Pd1-MP-mp-604453.json,0,True,-43m,5,0,0,0,0,0,0,0,0,0,1,1.0,False
Cu2.2Gd1Ru0.8Sr2O8,3,0.0285714285714285,2.0,False,Cu4.4Gd2Ru1.6Sr4O16,Cu4Gd2Ru2Sr4O16,28.4,Cuprate,True,Cu15.714Gd7.143Ru5.714Sr14.286O57.142857142857146,Cu-Gd-Ru-Sr-O,5,Supercon,Gd1Sr2Ru0.8Cu2.2O8,MP-mp-1194240,Sr4Gd2Cu4Ru2O16,Cu-Gd-Ru-Sr-O,Cu14.286Gd7.143Ru7.143Sr14.286O57.142857142857146,P 4/m b m,tetragonal,5.472451,5.472451,11.740702,data/final/MP/cifs/Cu2.2Gd1Ru0.8Sr2O8-MP-mp-1194240-synth_doped.cif,data/source/MP/raw/cifs/mp-1194240.cif,mp-1194240,0.0,,2019-01-11 23:51:58.932000,6.504561898971391,,,{'GGA': {'task_id': 'mp-1765260'}},0.0213449239285443,3.93502801,520.0,-201.55352223,-7.198340079642857,"{'tags': ['Sr2Cu2GdRuO8 orth', 'Sr2Cu2GdRuO8', 'Ruthenium distrontium gadolinium dicopper octaoxide']}",-201.55352223,-7.198340079642857,-2.268654352380952,['bandstructure'],True,[245741],True,2021-05-12 10:58:35.561000,FiM,28,6,mp-1194240,oxide,Sr2GdCu2RuO8,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Gd', 'Cu_pv', 'Ru_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Gd': 1.0, 'Cu': 2.0, 'Ru': 1.0, 'O': 8.0}",GGA,mp-1194240,"['mp-1194240', 'mp-1396976', 'mp-1659973', 'mp-1765260', 'mp-1841948', 'mp-1638264']",4.23696715,"{'Sr': 4.0, 'Gd': 2.0, 'Cu': 4.0, 'Ru': 2.0, 'O': 16.0}",351.6072554818909,[],FiM,True,127,2,"[-0.0, -0.0, -0.0, -0.0, 6.9, 6.9, 0.0, 0.0, 0.0, 0.0, -1.8, -1.8, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0241005672319991,4.23696715,4,8.4739343,MP,data/source/MP/cleaned/cifs/MP-mp-1194240.cif,True,,data/final/MP/graphs/Cu2.2Gd1Ru0.8Sr2O8-MP-mp-1194240-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Hg7K5,1,0.0,4.0,False,Hg28K20,Hg28K20,0.0,Other,True,Hg58.333K41.667,Hg-K,2,Supercon,Hg7K5,MP-mp-30718,K20Hg28,Hg-K,Hg58.333K41.667,P b c m,orthorhombic,8.527231,10.318978,19.810313,data/final/MP/cifs/Hg7K5-MP-mp-30718.cif,data/source/MP/raw/cifs/mp-30718.cif,mp-30718,0.0,,2014-02-18 06:13:22,6.095232405909425,10.17188/1205077,"@misc{osti_1205077,
    author = ""Persson, Kristin"",
    title = ""Materials Data on K5Hg7 (SG:57) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1205077"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-941710'}},0.0031537372916665,1.29831208,520.0,-43.25161914,-0.90107539875,{'tags': ['Mercury potassium (7/5)']},-43.25161914,-0.90107539875,-0.26126229125,"['xas', 'bandstructure']",True,"[639057, 104304]",True,2021-05-12 10:57:04.957000,NM,48,6,mp-30718,,K5Hg7,"{'functional': 'PBE', 'labels': ['K_sv', 'Hg'], 'pot_type': 'paw'}","{'K': 5.0, 'Hg': 7.0}",GGA,mp-30718,"['mp-30718', 'mp-941930', 'mp-935023', 'mp-941710', 'mp-1201759', 'mp-1348716']",0.0107612,"{'K': 20.0, 'Hg': 28.0}",1743.155184664021,[],NM,False,57,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.469361327017855e-05,0.0107612,0,0.0430448,MP,data/source/MP/cleaned/cifs/MP-mp-30718.cif,False,,data/final/MP/graphs/Hg7K5-MP-mp-30718.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ce0.061In1La2.939,2,0.0304999999999999,1.0,True,Ce0.061In1La2.939,In1La3,5.72,Other,True,Ce1.525In25La73.475,Ce-In-La,3,Supercon,La2.9394Ce0.0606In1,MP-mp-20909,La3In1,In-La,In25La75,P m -3 m,cubic,5.076766,5.076766,5.076766,data/final/MP/cifs/Ce0.061In1La2.939-MP-mp-20909-synth_doped.cif,data/source/MP/raw/cifs/mp-20909.cif,mp-20909,0.0,,2014-02-21 06:52:52,6.7455760598452565,10.17188/1196104,"@misc{osti_1196104,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La3In (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196104"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671685'}},0.0,8.16935076,520.0,-18.73796121,-4.6844903025,"{'tags': ['Indium lanthanum (1/3)', 'Lanthanum indium (3/1)']}",-18.73796121,-4.6844903025,-0.2945640412500001,"['xas', 'bandstructure']",True,"[639844, 51950, 639851, 639840, 603208, 107019]",True,2021-05-12 10:56:57.051000,NM,4,8,mp-20909,,La3In,"{'functional': 'PBE', 'labels': ['La', 'In_d'], 'pot_type': 'paw'}","{'La': 3.0, 'In': 1.0}",GGA,mp-20909,"['mp-906743', 'mp-921394', 'mp-920373', 'mp-20909', 'mp-1476042', 'mp-1671685', 'mp-1778647', 'mp-1590323']",0.0489742,"{'La': 3.0, 'In': 1.0}",130.84629766481785,[],NM,False,221,0,"[0, 0, 0, 0]",0.0003742880071811,0.0489742,0,0.0489742,MP,data/source/MP/cleaned/cifs/MP-mp-20909.cif,True,,data/final/MP/graphs/Ce0.061In1La2.939-MP-mp-20909-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Br2Ca1.7Cu1Na0.3O2,3,0.0857142857142857,1.0,True,Br2Ca1.7Cu1Na0.3O2,Br2Ca2Cu1O2,16.5,Cuprate,True,Br28.571Ca24.286Cu14.286Na4.286O28.571428571428573,Br-Ca-Cu-Na-O,5,Supercon,Ca1.7Na0.3Cu1Br2O2,MP-mp-545481,Ca2Cu1Br2O2,Br-Ca-Cu-O,Br28.571Ca28.571Cu14.286O28.571428571428573,I 4/m m m,tetragonal,3.8848960001664095,3.8848960001664095,9.26575389,data/final/MP/cifs/Br2Ca1.7Cu1Na0.3O2-MP-mp-545481-synth_doped.cif,data/source/MP/raw/cifs/mp-545481.cif,mp-545481,0.0,,2014-02-21 09:12:30,4.171489837215984,10.17188/1267001,"@misc{osti_1267001,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ca2Cu(BrO)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1267001"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687817'}},0.0,3.0811802,520.0,-34.65890385,-4.9512719785714285,{'tags': ['Dicalcium dibromodioxocuprate']},-34.65890385,-4.9512719785714285,-2.260101375,"['xas', 'elasticity', 'bandstructure']",True,[1028],True,2021-05-12 10:56:22.739000,NM,7,8,mp-545481,oxide,Ca2Cu(BrO)2,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Cu_pv', 'Br', 'O'], 'pot_type': 'paw'}","{'Ca': 2.0, 'Cu': 1.0, 'Br': 2.0, 'O': 2.0}",GGA,mp-545481,"['mp-1000746', 'mp-1007202', 'mp-545481', 'mp-1301034', 'mp-1687817', 'mp-1779505', 'mp-1011944', 'mp-1590430']",0.0093361,"{'Ca': 2.0, 'Cu': 1.0, 'Br': 2.0, 'O': 2.0}",133.55551405583833,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",6.990426464980444e-05,0.0093361,0,0.0093361,MP,data/source/MP/cleaned/cifs/MP-mp-545481.cif,True,,data/final/MP/graphs/Br2Ca1.7Cu1Na0.3O2-MP-mp-545481-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ru3U1,1,0.0,1.0,True,Ru3U1,Ru3U1,0.0725,Heavy_fermion,True,Ru75U25,Ru-U,2,Supercon,Ru3U1,MP-mp-1263,U1Ru3,Ru-U,Ru75U25,P m -3 m,cubic,4.001132,4.001132,4.001132,data/final/MP/cifs/Ru3U1-MP-mp-1263.cif,data/source/MP/raw/cifs/mp-1263.cif,mp-1263,0.0,,2011-05-13 05:58:05,14.031027324087884,10.17188/1189094,"@misc{osti_1189094,
    author = ""Persson, Kristin"",
    title = ""Materials Data on URu3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189094"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-929158'}},0.0,9.73701192,520.0,-40.42281009,-10.1057025225,{'tags': ['Ruthenium uranium (3/1)']},-40.42281009,-10.1057025225,-0.3270577787499995,"['xas', 'elasticity', 'bandstructure']",True,"[657430, 650749, 106009, 650750, 106008]",True,2021-05-12 10:56:12.755000,NM,4,7,mp-1263,,URu3,"{'functional': 'PBE', 'labels': ['U', 'Ru_pv'], 'pot_type': 'paw'}","{'U': 1.0, 'Ru': 3.0}",GGA,mp-1263,"['mp-929158', 'mp-929537', 'mp-912840', 'mp-1263', 'mp-1439958', 'mp-1781684', 'mp-1590427']",0.0004862,"{'U': 1.0, 'Ru': 3.0}",64.05435137853858,[],NM,False,221,0,"[0, 0, 0, 0]",7.590428901960615e-06,0.0004862,0,0.0004862,MP,data/source/MP/cleaned/cifs/MP-mp-1263.cif,False,,data/final/MP/graphs/Ru3U1-MP-mp-1263.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Nb3Te1,1,0.0,2.0,False,Nb6Te2,Nb6Te2,0.0,Other,True,Nb75Te25,Nb-Te,2,Supercon,Nb3Te1,MP-mp-570751,Nb6Te2,Nb-Te,Nb75Te25,P m -3 n,cubic,5.30287,5.30287,5.30287,data/final/MP/cifs/Nb3Te1-MP-mp-570751.cif,data/source/MP/raw/cifs/mp-570751.cif,mp-570751,0.0,,2014-02-16 08:56:38,9.049267622748465,10.17188/1275887,"@misc{osti_1275887,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Te (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1275887"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1705039'}},0.0442874406250002,7.8549913,520.0,-68.15657252,-8.519571565,"{'tags': ['Niobium telluride (3/1) -  HP, HT']}",-68.15657252,-8.519571565,-0.2632675524999985,"['xas', 'elasticity', 'bandstructure']",True,[105244],True,2021-05-12 10:56:27.046000,NM,8,8,mp-570751,,Nb3Te,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Te'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Te': 1.0}",GGA,mp-570751,"['mp-912681', 'mp-929054', 'mp-929432', 'mp-570751', 'mp-1435944', 'mp-1705039', 'mp-1779557', 'mp-1591696']",0.00300065,"{'Nb': 6.0, 'Te': 2.0}",149.11898589034996,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",4.024504300487176e-05,0.00300065,0,0.0060013,MP,data/source/MP/cleaned/cifs/MP-mp-570751.cif,False,,data/final/MP/graphs/Nb3Te1-MP-mp-570751.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Au0.25Ba1Ge12Pt3.75,3,0.0294117647058823,1.0,True,Au0.25Ba1Ge12Pt3.75,Ba1Ge12Pt4,5.05,Other,True,Au1.471Ba5.882Ge70.588Pt22.059,Au-Ba-Ge-Pt,4,Supercon,Ba1Pt3.75Au0.25Ge12,MP-mp-642304,Ba1Ge12Pt4,Ba-Ge-Pt,Ba5.882Ge70.588Pt23.529,I m -3,cubic,7.645083471694796,7.645083469999999,7.64508347,data/final/MP/cifs/Au0.25Ba1Ge12Pt3.75-MP-mp-642304-synth_doped.cif,data/source/MP/raw/cifs/mp-642304.cif,mp-642304,0.0,,2013-06-27 03:14:07,8.63809333529259,10.17188/1280105,"@misc{osti_1280105,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba(Ge3Pt)4 (SG:204) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1280105"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668080'}},0.0,3.85683615,520.0,-87.95775196,-5.173985409411764,{'tags': ['Barium platinum germanide (1/4/12)']},-87.95775196,-5.173985409411764,-0.3693421194117648,"['xas', 'bandstructure']",True,"[174551, 160797, 160798]",True,2021-05-12 10:57:30.779000,NM,17,6,mp-642304,,Ba(Ge3Pt)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ge_d', 'Pt'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Ge': 12.0, 'Pt': 4.0}",GGA,mp-642304,"['mp-642304', 'mp-914966', 'mp-1429457', 'mp-1668080', 'mp-1841530', 'mp-1604761']",0.0003968,"{'Ba': 1.0, 'Ge': 12.0, 'Pt': 4.0}",343.9733561233396,[],NM,False,204,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.1535777202979588e-06,0.0003968,0,0.0003968,MP,data/source/MP/cleaned/cifs/MP-mp-642304.cif,True,,data/final/MP/graphs/Au0.25Ba1Ge12Pt3.75-MP-mp-642304-synth_doped.json,0,True,m-3,2,0,0,0,0,0,0,0,0,1,0,1.0,False
Ca2Si1,1,0.0,4.0,False,Ca8Si4,Ca8Si4,0.0,Other,True,Ca66.667Si33.333,Ca-Si,2,Supercon,Ca2Si1,MP-mp-2517,Ca8Si4,Ca-Si,Ca66.667Si33.333,P n m a,orthorhombic,4.819887,7.614753,9.04721,data/final/MP/cifs/Ca2Si1-MP-mp-2517.cif,data/source/MP/raw/cifs/mp-2517.cif,mp-2517,0.2915000000000001,,2011-05-14 12:24:10,2.16518765639069,10.17188/1200545,"@misc{osti_1200545,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ca2Si (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1200545"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698219'}},0.0,3.42271036,520.0,-43.24343497,-3.6036195808333336,"{'tags': ['Dicalcium silicide', 'Calcium silicide (2/1)', 'Calcium silicide']}",-43.24343497,-3.6036195808333336,-0.4344483208333335,"['xas', 'bandstructure', 'diel', 'phonons', 'elasticity']",True,"[42453, 158275, 187350, 191034, 25595]",True,2021-05-12 10:56:16.728000,NM,12,14,mp-2517,,Ca2Si,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Si'], 'pot_type': 'paw'}","{'Ca': 2.0, 'Si': 1.0}",GGA,mp-2517,"['mp-666817', 'mp-682246', 'mp-702283', 'mp-2517', 'mp-1102266', 'mp-1102491', 'mp-1138743', 'mp-1141667', 'mp-1145775', 'mp-1252427', 'mp-1422834', 'mp-1698219', 'mp-1812483', 'mp-1601634']",0.00017295,"{'Ca': 8.0, 'Si': 4.0}",332.0529541111543,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.083402636341012e-06,0.00017295,0,0.0006918,MP,data/source/MP/cleaned/cifs/MP-mp-2517.cif,False,,data/final/MP/graphs/Ca2Si1-MP-mp-2517.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Cu1La2O4.093,2,0.0112384443415036,0.977259426663409,True,Cu0.977La1.955O4,Cu1La2O4,45.0,Cuprate,True,Cu14.098La28.197O57.704779359932324,Cu-La-O,3,Supercon,La2Cu1O4.093,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La2O4.093-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La2O4.093-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ir3U1,1,0.0,1.0,True,Ir3U1,Ir3U1,0.0,Heavy_fermion,True,Ir75U25,Ir-U,2,Supercon,Ir3U1,MP-mp-1044,U1Ir3,Ir-U,Ir75U25,P m -3 m,cubic,4.051411,4.051411,4.051411,data/final/MP/cifs/Ir3U1-MP-mp-1044.cif,data/source/MP/raw/cifs/mp-1044.cif,mp-1044,0.0,,2011-05-12 23:13:32,20.34310288117098,10.17188/1187121,"@misc{osti_1187121,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UIr3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187121"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671917'}},0.0,11.0829311,520.0,-40.44903986,-10.112259965,{'tags': ['Iridium uranium (3/1)']},-40.44903986,-10.112259965,-0.6605846475000003,"['xas', 'elasticity', 'bandstructure']",True,"[104588, 104587, 641145]",True,2021-05-12 10:56:10.715000,NM,4,8,mp-1044,,UIr3,"{'functional': 'PBE', 'labels': ['U', 'Ir'], 'pot_type': 'paw'}","{'U': 1.0, 'Ir': 3.0}",GGA,mp-1044,"['mp-993654', 'mp-991936', 'mp-1044', 'mp-1300857', 'mp-1671917', 'mp-1792140', 'mp-994939', 'mp-1590772']",0.005005,"{'U': 1.0, 'Ir': 3.0}",66.49958097499933,[],NM,False,221,0,"[0, 0, 0, 0]",7.526363214050387e-05,0.005005,0,0.005005,MP,data/source/MP/cleaned/cifs/MP-mp-1044.cif,False,,data/final/MP/graphs/Ir3U1-MP-mp-1044.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Cu0.85La2Zn0.15O4,2,0.0428571428571428,1.0,True,Cu0.85La2Zn0.15O4,Cu1La2O4,0.0,Cuprate,True,Cu12.143La28.571Zn2.143O57.142857142857146,Cu-La-Zn-O,4,Supercon,La2Sr0Cu0.85Zn0.15O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu0.85La2Zn0.15O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu0.85La2Zn0.15O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Cu3Pb2Sr2Tb0.05Y0.95O8,2,0.00625,2.0,False,Cu6Pb4Sr4Tb0.1Y1.9O16,Cu6Pb4Sr4Y2O16,0.0,Cuprate,True,Cu18.75Pb12.5Sr12.5Tb0.312Y5.938O50,Cu-Pb-Sr-Tb-Y-O,6,Supercon,Pb2Sr2Tb0.05Y0.95Cu3O8,MP-mp-1198573,Sr4Y2Cu6Pb4O16,Cu-Pb-Sr-Y-O,Cu18.75Pb12.5Sr12.5Y6.25O50,P m n a,orthorhombic,5.415744,5.488367,15.951096,data/final/MP/cifs/Cu3Pb2Sr2Tb0.05Y0.95O8-MP-mp-1198573-synth_doped.cif,data/source/MP/raw/cifs/mp-1198573.cif,mp-1198573,0.0,,2019-01-12 03:19:55.890000,6.984903949344623,,,{'GGA': {'task_id': 'mp-1733220'}},0.0235427039355471,4.6568914,520.0,-193.37804115,-6.0430637859375,{'tags': ['Lead strontium yttrium copper oxide (2/2/1/3/8)']},-193.37804115,-6.0430637859375,-2.0645600228125,['bandstructure'],True,[71478],True,2021-05-12 10:58:37.524000,NM,32,5,mp-1198573,oxide,Sr2YCu3(PbO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Y_sv', 'Cu_pv', 'Pb_d', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Y': 1.0, 'Cu': 3.0, 'Pb': 2.0, 'O': 8.0}",GGA,mp-1198573,"['mp-1198573', 'mp-1384845', 'mp-1733220', 'mp-1823228', 'mp-1654304']",0.00063755,"{'Sr': 4.0, 'Y': 2.0, 'Cu': 6.0, 'Pb': 4.0, 'O': 16.0}",474.1238479236181,[],NM,False,53,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.689381699706065e-06,0.00063755,0,0.0012751,MP,data/source/MP/cleaned/cifs/MP-mp-1198573.cif,True,,data/final/MP/graphs/Cu3Pb2Sr2Tb0.05Y0.95O8-MP-mp-1198573-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Cu2La2Sr1O6,1,0.0,1.0,True,Cu2La2Sr1O6,Cu2La2Sr1O6,0.0,Cuprate,True,Cu18.182La18.182Sr9.091O54.54545454545455,Cu-La-Sr-O,4,Supercon,La2Sr1Cu2O6,MP-mp-1218240,Sr1La2Cu2O6,Cu-La-Sr-O,Cu18.182La18.182Sr9.091O54.54545454545455,I 4/m m m,tetragonal,3.878414000890276,3.878414000890275,10.332121229999998,data/final/MP/cifs/Cu2La2Sr1O6-MP-mp-1218240.cif,data/source/MP/raw/cifs/mp-1218240.cif,mp-1218240,0.0,,2019-01-12 19:26:29.085000,6.521932952077898,,,{'GGA': {'task_id': 'mp-1744577'}},0.040209457727272,6.22729824,520.0,-74.48878828,-6.7717080254545445,{'tags': []},-74.48878828,-6.7717080254545445,-2.6511910224242423,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,11,5,mp-1218240,oxide,SrLa2(CuO3)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 1.0, 'La': 2.0, 'Cu': 2.0, 'O': 6.0}",GGA,mp-1218240,"['mp-1218240', 'mp-1442927', 'mp-1744577', 'mp-1780326', 'mp-1622813']",0.0208588,"{'Sr': 1.0, 'La': 2.0, 'Cu': 2.0, 'O': 6.0}",149.8419813114288,[],NM,False,139,0,"[0.0, 0.0, 0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001392053136073,0.0208588,0,0.0208588,MP,data/source/MP/cleaned/cifs/MP-mp-1218240.cif,False,,data/final/MP/graphs/Cu2La2Sr1O6-MP-mp-1218240.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Co1Nb4Si1,1,0.0,2.0,False,Co2Nb8Si2,Co2Nb8Si2,6.0,Other,True,Co16.667Nb66.667Si16.667,Co-Nb-Si,3,Supercon,Nb4Co1Si1,MP-mp-10003,Nb8Co2Si2,Co-Nb-Si,Co16.667Nb66.667Si16.667,P 4/m c c,tetragonal,5.023228,6.228505,6.228505,data/final/MP/cifs/Co1Nb4Si1-MP-mp-10003.cif,data/source/MP/raw/cifs/mp-10003.cif,mp-10003,0.0,,2011-06-03 02:54:26,7.816358809618785,10.17188/1184816,"@misc{osti_1184816,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb4CoSi (SG:124) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1184816"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1676349'}},0.0127759987499977,5.80929481,520.0,-110.11013253,-9.1758443775,{'tags': ['Niobium cobalt silicon (4/1/1)']},-110.11013253,-9.1758443775,-0.340869048333334,"['xas', 'elasticity', 'bandstructure']",True,[43233],True,2021-05-12 10:56:08.727000,NM,12,11,mp-10003,,Nb4CoSi,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Co', 'Si'], 'pot_type': 'paw'}","{'Nb': 4.0, 'Co': 1.0, 'Si': 1.0}",GGA,mp-10003,"['mp-10003', 'mp-909958', 'mp-925548', 'mp-925932', 'mp-1125290', 'mp-1136316', 'mp-1253640', 'mp-1382771', 'mp-1676349', 'mp-1829379', 'mp-1601056']",7.43e-05,"{'Nb': 8.0, 'Co': 2.0, 'Si': 2.0}",194.87248608402456,[],NM,False,124,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",7.625499268066355e-07,7.43e-05,0,0.0001486,MP,data/source/MP/cleaned/cifs/MP-mp-10003.cif,False,,data/final/MP/graphs/Co1Nb4Si1-MP-mp-10003.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ba0.155Cu1La1.845O4,3,0.0442857142857142,1.0,True,Ba0.155Cu1La1.845O4,Cu1La2O4,26.0,Cuprate,True,Ba2.214Cu14.286La26.357O57.142857142857146,Ba-Cu-La-O,4,Supercon,La1.845Ba0.155Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ba0.155Cu1La1.845O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ba0.155Cu1La1.845O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
La1P2Pd2,1,0.0,1.0,True,La1P2Pd2,La1P2Pd2,0.75,Other,True,La20P40Pd40,La-P-Pd,3,Supercon,La1Pd2P2,MP-mp-1207202,La1P2Pd2,La-P-Pd,La20P40Pd40,I 4/m m m,tetragonal,4.218066002372907,4.218066002372907,5.8277547,data/final/MP/cifs/La1P2Pd2-MP-mp-1207202.cif,data/source/MP/raw/cifs/mp-1207202.cif,mp-1207202,0.0,,2019-01-12 10:21:32.399000,7.711734605659415,,,{'GGA': {'task_id': 'mp-1732400'}},0.0,8.35454078,520.0,-31.15220253,-6.230440506,"{'tags': ['LaPd2P2', 'CeAl2Ga2']}",-31.15220253,-6.230440506,-1.0059653583333337,['bandstructure'],True,[],True,2021-05-12 10:58:39.488000,NM,5,5,mp-1207202,,La(PPd)2,"{'functional': 'PBE', 'labels': ['La', 'P', 'Pd'], 'pot_type': 'paw'}","{'La': 1.0, 'P': 2.0, 'Pd': 2.0}",GGA,mp-1207202,"['mp-1207202', 'mp-1403503', 'mp-1732400', 'mp-1782477', 'mp-1638183']",0.0001701,"{'La': 1.0, 'P': 2.0, 'Pd': 2.0}",89.07897032810031,[],NM,False,139,0,"[0, 0, 0, 0, 0]",1.909541605313564e-06,0.0001701,0,0.0001701,MP,data/source/MP/cleaned/cifs/MP-mp-1207202.cif,False,,data/final/MP/graphs/La1P2Pd2-MP-mp-1207202.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
La0.92Ru3Si2Tm0.08,2,0.0266666666666666,1.0,True,La0.92Ru3Si2Tm0.08,La1Ru3Si2,6.8,Other,True,La15.333Ru50Si33.333Tm1.333,La-Ru-Si-Tm,4,Supercon,La0.92Tm0.08Ru3Si2,MP-mp-29240,La2Si4Ru6,La-Ru-Si,La16.667Ru50Si33.333,P 6/m m m,hexagonal,3.6088705,5.693851997310984,5.69385245,data/final/MP/cifs/La0.92Ru3Si2Tm0.08-MP-mp-29240-synth_doped.cif,data/source/MP/raw/cifs/mp-29240.cif,mp-29240,0.0,,2014-02-24 11:42:03,8.166084465628895,10.17188/1203620,"@misc{osti_1203620,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaSi2Ru3 (SG:193) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1203620"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1719509'}},0.0844490616666675,8.56766587,520.0,-95.13702135,-7.9280851125,{'tags': []},-95.13702135,-7.9280851125,-0.6361177608333328,"['xas', 'bandstructure']",True,[],True,2021-05-12 10:57:03.017000,NM,12,10,mp-29240,,LaSi2Ru3,"{'functional': 'PBE', 'labels': ['La', 'Si', 'Ru_pv'], 'pot_type': 'paw'}","{'La': 1.0, 'Si': 2.0, 'Ru': 3.0}",GGA,mp-29240,"['mp-925171', 'mp-924493', 'mp-909454', 'mp-29240', 'mp-1172476', 'mp-1254946', 'mp-1406081', 'mp-1719509', 'mp-1834844', 'mp-1618500']",0.00014945,"{'La': 2.0, 'Si': 4.0, 'Ru': 6.0}",202.6489324904347,[],NM,False,38,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, 0.0, 0.0, 0.0, -0.0]",1.4749645918520125e-06,0.00014945,0,0.0002989,MP,data/source/MP/cleaned/cifs/MP-mp-29240.cif,True,,data/final/MP/graphs/La0.92Ru3Si2Tm0.08-MP-mp-29240-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Li1.18Ti1.82O4,3,0.0514285714285714,2.0,False,Li2.36Ti3.64O8,Li2Ti4O8,0.0,Oxide,True,Li16.857Ti26O57.142857142857146,Li-Ti-O,3,Supercon,Li1.18Ti1.82O4,MP-mp-5670,Li2Ti4O8,Li-Ti-O,Li14.286Ti28.571O57.142857142857146,F d -3 m,cubic,5.986032260000001,5.98603226,5.98603226,data/final/MP/cifs/Li1.18Ti1.82O4-MP-mp-5670-synth_doped.cif,data/source/MP/raw/cifs/mp-5670.cif,mp-5670,0.0,,2011-05-14 11:10:22,3.649565337909552,10.17188/1273637,"@misc{osti_1273637,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LiTi2O4 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1273637"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699404'}},0.0,5.03116805,520.0,-114.93444733,-8.209603380714286,"{'tags': ['Lithium titanium oxide (1/2/4)', 'Lithium titanium(III) titanium(IV) oxide', 'Lithium titanium(III) titanium oxide', 'Lithium titanium titanium(III) oxide', 'Lithium titano(III)titanate', 'Spinel-(Li,Ti)']}",-114.93444733,-8.209603380714286,-3.2462103921428564,"['bandstructure', 'elasticity']",True,"[72859, 78482, 154982, 81329, 15789, 48127]",True,2021-05-12 10:56:22.739000,NM,14,7,mp-5670,oxide,LiTi2O4,"{'functional': 'PBE', 'labels': ['Li_sv', 'Ti_pv', 'O'], 'pot_type': 'paw'}","{'Li': 1.0, 'Ti': 2.0, 'O': 4.0}",GGA,mp-5670,"['mp-923613', 'mp-922835', 'mp-908534', 'mp-5670', 'mp-1418091', 'mp-1699404', 'mp-1787951']",0.0521081,"{'Li': 2.0, 'Ti': 4.0, 'O': 8.0}",151.67086379131675,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0006871207652868,0.0521081,0,0.1042162,MP,data/source/MP/cleaned/cifs/MP-mp-5670.cif,True,,data/final/MP/graphs/Li1.18Ti1.82O4-MP-mp-5670-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Al1B4Yb1,1,0.0,4.0,False,Al4B16Yb4,Al4B16Yb4,0.08,Heavy_fermion,True,Al16.667B66.667Yb16.667,Al-B-Yb,3,Supercon,Yb1Al1B4,MP-mp-1191244,Yb4Al4B16,Al-B-Yb,Al16.667B66.667Yb16.667,P b a m,orthorhombic,3.475934,6.003239,11.617121,data/final/MP/cifs/Al1B4Yb1-MP-mp-1191244.cif,data/source/MP/raw/cifs/mp-1191244.cif,mp-1191244,0.0,,2019-01-11 21:33:44.436000,6.66551961824022,,,{'GGA': {'task_id': 'mp-1670841'}},0.0480340376388896,5.97920545,520.0,-136.82610351,-5.70108764625,"{'tags': ['Ytterbium aluminium boride (1/1/4) - alpha', 'Aluminium yttrium boride (1/1/4) - alpha', 'Ytterbium aluminium boride (1/1/4)', 'YbAlB4 orth1', 'YCrB4']}",-136.82610351,-5.70108764625,-0.3672957806944434,['bandstructure'],True,"[606132, 260796, 656222, 167532]",True,2021-05-12 10:58:33.577000,NM,24,8,mp-1191244,,YbAlB4,"{'functional': 'PBE', 'labels': ['Yb_2', 'Al', 'B'], 'pot_type': 'paw'}","{'Yb': 1.0, 'Al': 1.0, 'B': 4.0}",GGA,mp-1191244,"['mp-1191244', 'mp-1191303', 'mp-1191343', 'mp-1191895', 'mp-1431043', 'mp-1670841', 'mp-1774820', 'mp-1609177']",3.925e-05,"{'Yb': 4.0, 'Al': 4.0, 'B': 16.0}",242.412867136344,[],NM,False,55,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.476553899743946e-07,3.925e-05,0,0.000157,MP,data/source/MP/cleaned/cifs/MP-mp-1191244.cif,False,,data/final/MP/graphs/Al1B4Yb1-MP-mp-1191244.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
C1Hf0.6Nb0.4,3,0.0999999999999999,2.0,False,C2Hf1.2Nb0.8,C2Hf1Nb1,4.5,Other,True,C50Hf30Nb20,C-Hf-Nb,3,Supercon,C1Hf0.6Nb0.4,MP-mp-1224334,Hf1Nb1C2,C-Hf-Nb,C50Hf25Nb25,R -3 m,trigonal,3.2283724814233605,3.228372481423361,5.61495687,data/final/MP/cifs/C1Hf0.6Nb0.4-MP-mp-1224334-synth_doped.cif,data/source/MP/raw/cifs/mp-1224334.cif,mp-1224334,0.0,,2019-01-13 00:35:56.434000,10.261089831989311,,,{'GGA': {'task_id': 'mp-1767424'}},0.0,6.85563077,520.0,-41.42178362,-10.355445905,{'tags': []},-41.42178362,-10.355445905,-0.7274320824999982,['bandstructure'],True,[],True,2021-05-12 10:58:45.495000,NM,4,5,mp-1224334,,HfNbC2,"{'functional': 'PBE', 'labels': ['Hf_pv', 'Nb_pv', 'C'], 'pot_type': 'paw'}","{'Hf': 1.0, 'Nb': 1.0, 'C': 2.0}",GGA,mp-1224334,"['mp-1224334', 'mp-1414286', 'mp-1767424', 'mp-1793357', 'mp-1609501']",0.0053282,"{'Hf': 1.0, 'Nb': 1.0, 'C': 2.0}",47.80708216089565,[],NM,False,166,0,"[0, 0, 0, 0]",0.0001114521062395,0.0053282,0,0.0053282,MP,data/source/MP/cleaned/cifs/MP-mp-1224334.cif,True,,data/final/MP/graphs/C1Hf0.6Nb0.4-MP-mp-1224334-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ge0.3Sn0.7,3,0.1,4.0,False,Ge1.2Sn2.8,Ge1Sn3,0.0,Other,True,Ge30Sn70,Ge-Sn,2,Supercon,Ge0.3Sn0.7,MP-mp-1187023,Sn3Ge1,Ge-Sn,Ge25Sn75,P m -3 m,cubic,4.685681,4.685681,4.685681,data/final/MP/cifs/Ge0.3Sn0.7-MP-mp-1187023-synth_doped.cif,data/source/MP/raw/cifs/mp-1187023.cif,mp-1187023,0.0,,2019-01-11 14:46:14.675000,6.920784603682166,,,{'GGA': {'task_id': 'mp-1760748'}},0.1575231024999999,7.64373654,520.0,-16.02165101,-4.0054127525,{'tags': []},-16.02165101,-4.0054127525,0.1575231024999999,['bandstructure'],True,[],True,2021-05-12 10:58:31.620000,NM,4,5,mp-1187023,,Sn3Ge,"{'functional': 'PBE', 'labels': ['Sn_d', 'Ge_d'], 'pot_type': 'paw'}","{'Sn': 3.0, 'Ge': 1.0}",GGA,mp-1187023,"['mp-1187023', 'mp-1406584', 'mp-1760748', 'mp-1798099', 'mp-1613112']",0.0049766,"{'Sn': 3.0, 'Ge': 1.0}",102.87696791015166,[],NM,False,221,0,"[0, 0, 0, 0]",4.837428727824045e-05,0.0049766,0,0.0049766,MP,data/source/MP/cleaned/cifs/MP-mp-1187023.cif,True,,data/final/MP/graphs/Ge0.3Sn0.7-MP-mp-1187023-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ca1.84Cl2Cu1Na0.16O2,3,0.0457142857142857,1.0,True,Ca1.84Cl2Cu1Na0.16O2,Ca2Cl2Cu1O2,19.7,Cuprate,True,Ca26.286Cl28.571Cu14.286Na2.286O28.571428571428573,Ca-Cl-Cu-Na-O,5,Supercon,Ca1.84Na0.16Cu1Cl2O2,MP-mp-23143,Ca2Cu1Cl2O2,Ca-Cl-Cu-O,Ca28.571Cl28.571Cu14.286O28.571428571428573,I 4/m m m,tetragonal,3.88024600076171,3.880246000761709,8.12907187,data/final/MP/cifs/Ca1.84Cl2Cu1Na0.16O2-MP-mp-23143-synth_doped.cif,data/source/MP/raw/cifs/mp-23143.cif,mp-23143,0.0,,2014-02-21 09:50:06,3.554337150605878,10.17188/1199263,"@misc{osti_1199263,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ca2Cu(ClO)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199263"",
    place = ""United States"",
    year = ""2016"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700223'}},0.0191527683333321,4.19679796,520.0,-35.95348475,-5.136212107142858,"{'tags': ['Dicalcium copper dioxide dichloride', 'Dicalcium dichlorodioxocuprate']}",-35.95348475,-5.136212107142858,-2.407440427142858,"['xas', 'elasticity', 'bandstructure']",True,"[1027, 83117, 41581]",True,2021-05-12 10:56:16.728000,NM,7,8,mp-23143,oxide,Ca2Cu(ClO)2,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Cu_pv', 'Cl', 'O'], 'pot_type': 'paw'}","{'Ca': 2.0, 'Cu': 1.0, 'Cl': 2.0, 'O': 2.0}",GGA,mp-23143,"['mp-992231', 'mp-990553', 'mp-23143', 'mp-1436301', 'mp-1700223', 'mp-1803462', 'mp-993865', 'mp-1592909']",0.0134962,"{'Ca': 2.0, 'Cu': 1.0, 'Cl': 2.0, 'O': 2.0}",115.21141865211318,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001171429026557,0.0134962,0,0.0134962,MP,data/source/MP/cleaned/cifs/MP-mp-23143.cif,True,,data/final/MP/graphs/Ca1.84Cl2Cu1Na0.16O2-MP-mp-23143-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ce0.4La0.6Ru2,3,0.0666666666666666,2.0,False,Ce0.8La1.2Ru4,Ce1La1Ru4,0.727,Heavy_fermion,True,Ce13.333La20Ru66.667,Ce-La-Ru,3,Supercon,La0.6Ce0.4Ru2,MP-mp-1222913,La1Ce1Ru4,Ce-La-Ru,Ce16.667La16.667Ru66.667,F -4 3 m,cubic,5.407204540000001,5.40720454,5.40720454,data/final/MP/cifs/Ce0.4La0.6Ru2-MP-mp-1222913-synth_doped.cif,data/source/MP/raw/cifs/mp-1222913.cif,mp-1222913,0.0,,2019-01-12 23:22:50.626000,10.149813335401207,,,{'GGA': {'task_id': 'mp-1717130'}},0.0,8.64426336,520.0,-49.23252279,-8.205420465,{'tags': []},-49.23252279,-8.205420465,-0.2109779849999995,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,6,5,mp-1222913,,LaCeRu4,"{'functional': 'PBE', 'labels': ['La', 'Ce', 'Ru_pv'], 'pot_type': 'paw'}","{'La': 1.0, 'Ce': 1.0, 'Ru': 4.0}",GGA,mp-1222913,"['mp-1222913', 'mp-1394759', 'mp-1717130', 'mp-1804881', 'mp-1626317']",0.0208777,"{'La': 1.0, 'Ce': 1.0, 'Ru': 4.0}",111.79011354255184,[],NM,False,216,0,"[0.0, -0.0, 0.0, 0.0, 0.0, 0.0]",0.0001867580176672,0.0208777,0,0.0208777,MP,data/source/MP/cleaned/cifs/MP-mp-1222913.cif,True,,data/final/MP/graphs/Ce0.4La0.6Ru2-MP-mp-1222913-synth_doped.json,0,True,-43m,5,0,0,0,0,0,0,0,0,0,1,1.0,False
Bi1F0.5La0.7S2Sm0.3O0.5,3,0.12,2.0,False,Bi2F1La1.4S4Sm0.6O1,Bi2F1La2S4O1,3.11,Oxide,True,Bi20F10La14S40Sm6O10,Bi-F-La-S-Sm-O,6,Supercon,La0.7Sm0.3Bi1S2F0.5O0.5,MP-mp-1223274,La2Bi2S4O1F1,Bi-F-La-S-O,Bi20F10La20S40O10,P -4 m 2,tetragonal,4.109577,4.109577,13.150136,data/final/MP/cifs/Bi1F0.5La0.7S2Sm0.3O0.5-MP-mp-1223274-synth_doped.cif,data/source/MP/raw/cifs/mp-1223274.cif,mp-1223274,0.0,,2019-01-12 23:41:28.903000,6.422922901673022,,,{'GGA': {'task_id': 'mp-1744170'}},0.0471324534999961,7.2695309,520.0,-59.26664004,-5.926664004,{'tags': []},-59.26664004,-5.926664004,-2.137031777,[],False,[],True,2021-05-12 11:00:52.054000,NM,10,4,mp-1223274,oxide,La2Bi2S4OF,"{'functional': 'PBE', 'labels': ['La', 'Bi', 'S', 'O', 'F'], 'pot_type': 'paw'}","{'La': 2.0, 'Bi': 2.0, 'S': 4.0, 'O': 1.0, 'F': 1.0}",GGA,mp-1223274,"['mp-1223274', 'mp-1388342', 'mp-1744170', 'mp-1861685']",0.0001151,"{'La': 2.0, 'Bi': 2.0, 'S': 4.0, 'O': 1.0, 'F': 1.0}",222.0876908666605,[],NM,False,115,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.182637522630872e-07,0.0001151,0,0.0001151,MP,data/source/MP/cleaned/cifs/MP-mp-1223274.cif,True,,data/final/MP/graphs/Bi1F0.5La0.7S2Sm0.3O0.5-MP-mp-1223274-synth_doped.json,0,True,-42m,0,0,0,0,6,0,0,1,0,0,0,1.0,False
Rh1Ti2,1,0.0,1.0,True,Rh1Ti2,Rh1Ti2,0.0,Other,True,Rh33.333Ti66.667,Rh-Ti,2,Supercon,Rh1Ti2,MP-mp-1018124,Ti2Rh1,Rh-Ti,Rh33.333Ti66.667,I 4/m m m,tetragonal,3.0720839979068684,3.072083997906868,5.38775841,data/final/MP/cifs/Rh1Ti2-MP-mp-1018124.cif,data/source/MP/raw/cifs/mp-1018124.cif,mp-1018124,0.0,,2017-04-07 02:41:52,7.088660567074917,10.17188/1350163,"@article{osti_1350163,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ti2Rh (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1350163"",
    place = ""United States"",
    year = ""2017"",
    month = ""4""
}
",{'GGA': {'task_id': 'mp-1673180'}},0.0,6.61814616,520.0,-25.0196782,-8.339892733333334,"{'tags': ['close-packed structure', 'Ti2Rh rt', 'CuZr2', 'Rhodium titanium (1/2)']}",-25.0196782,-8.339892733333334,-0.6214620988888898,"['bandstructure', 'elasticity']",True,[650481],True,2021-05-12 10:56:08.727000,NM,3,12,mp-1018124,,Ti2Rh,"{'functional': 'PBE', 'labels': ['Ti_pv', 'Rh_pv'], 'pot_type': 'paw'}","{'Ti': 2.0, 'Rh': 1.0}",GGA,mp-1018124,"['mp-1018124', 'mp-1018257', 'mp-1018476', 'mp-1018370', 'mp-1063040', 'mp-1062987', 'mp-1063115', 'mp-1438575', 'mp-1673180', 'mp-1793428', 'mp-1587962', 'mp-1063080']",4.65e-05,"{'Ti': 2.0, 'Rh': 1.0}",46.53187253060987,[],NM,False,139,0,"[0, 0, 0]",9.993150387277258e-07,4.65e-05,0,4.65e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1018124.cif,False,,data/final/MP/graphs/Rh1Ti2-MP-mp-1018124.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
C2Os1U2,1,0.0,1.0,True,C2Os1U2,C2Os1U2,0.0,Heavy_fermion,True,C40Os20U40,C-Os-U,3,Supercon,C2Os1U2,MP-mp-1069004,U2Os1C2,C-Os-U,C40Os20U40,I 4/m m m,tetragonal,3.449749997892435,3.449749997892435,6.71216976,data/final/MP/cifs/C2Os1U2-MP-mp-1069004.cif,data/source/MP/raw/cifs/mp-1069004.cif,mp-1069004,0.0,,2018-03-22 00:02:45,15.403286732206327,,,{'GGA': {'task_id': 'mp-1069524'}},0.0,10.84473677,520.0,-53.23640402,-10.647280804,"{'tags': ['Uranium osmium carbide (2/1/2)', 'U2OsC2', 'Osmium uranium carbide (1/2/2)', 'Na2HgO2']}",-53.23640402,-10.647280804,-0.1945312689999994,[],False,"[618614, 618616]",True,2021-05-12 10:59:18.323000,NM,5,12,mp-1069004,,U2OsC2,"{'functional': 'PBE', 'labels': ['U', 'Os_pv', 'C'], 'pot_type': 'paw'}","{'U': 2.0, 'Os': 1.0, 'C': 2.0}",GGA,mp-1069004,"['mp-1069004', 'mp-1069167', 'mp-1069360', 'mp-1069400', 'mp-1069047', 'mp-1069524', 'mp-1441363', 'mp-1697181', 'mp-1798296', 'mp-1593085', 'mp-1069125', 'mp-1069487']",0.0004772,"{'U': 2.0, 'Os': 1.0, 'C': 2.0}",74.41823604097662,[],NM,False,139,0,"[0, 0, 0, 0, 0]",6.412406761929176e-06,0.0004772,0,0.0004772,MP,data/source/MP/cleaned/cifs/MP-mp-1069004.cif,False,,data/final/MP/graphs/C2Os1U2-MP-mp-1069004.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ge2V1,1,0.0,3.0,False,Ge6V3,Ge6V3,0.0,Other,True,Ge66.667V33.333,Ge-V,2,Supercon,V1Ge2,MP-mp-1084800,V3Ge6,Ge-V,Ge66.667V33.333,P 62 2 2,hexagonal,4.8136339986630805,4.81363458,6.658007,data/final/MP/cifs/Ge2V1-MP-mp-1084800.cif,data/source/MP/raw/cifs/mp-1084800.cif,mp-1084800,0.0,,2018-04-25 13:20:28,7.316373404167832,,,{'GGA': {'task_id': 'mp-1703970'}},0.0325717323232321,6.08038181,520.0,-56.5066187,-6.278513188888889,"{'tags': ['CrSi2', 'VGe2 hp', 'Vanadium germanide (1/2)']}",-56.5066187,-6.278513188888889,-0.1685259288888884,['bandstructure'],True,[638088],True,2021-05-12 10:58:18.470000,FM,9,5,mp-1084800,,VGe2,"{'functional': 'PBE', 'labels': ['V_pv', 'Ge_d'], 'pot_type': 'paw'}","{'V': 1.0, 'Ge': 2.0}",GGA,mp-1084800,"['mp-1084800', 'mp-1428980', 'mp-1703970', 'mp-1778631', 'mp-1602243']",0.2179609,"{'V': 3.0, 'Ge': 6.0}",133.6044984819548,[],FM,True,180,1,"[0.2, 0.2, 0.2, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0048941667940044,0.2179609,3,0.6538827,MP,data/source/MP/cleaned/cifs/MP-mp-1084800.cif,False,,data/final/MP/graphs/Ge2V1-MP-mp-1084800.json,0,True,622,0,4,0,0,0,0,0,1,0,0,0,1.0,False
Al0.022B2Mg0.978,2,0.0146666666666666,1.0,True,Al0.022B2Mg0.978,B2Mg1,34.7,Other,True,Al0.733B66.667Mg32.6,Al-B-Mg,3,Supercon,Mg0.978Al0.022B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/Al0.022B2Mg0.978-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/Al0.022B2Mg0.978-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Bi2Pt1,1,0.0,8.0,False,Bi16Pt8,Bi16Pt8,0.0775,Other,True,Bi66.667Pt33.333,Bi-Pt,2,Supercon,Bi2Pt1,MP-mp-568531,Bi16Pt8,Bi-Pt,Bi66.667Pt33.333,P b c a,orthorhombic,6.872734,6.92979,13.619009,data/final/MP/cifs/Bi2Pt1-MP-mp-568531.cif,data/source/MP/raw/cifs/mp-568531.cif,mp-568531,0.0,,2014-02-23 21:05:54,12.555562699312894,10.17188/1274481,"@misc{osti_1274481,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Bi2Pt (SG:61) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1274481"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1755005'}},0.0,6.14785621,520.0,-116.74371544,-4.8643214766666665,{'tags': ['Bismuth platinum (2/1) - LT']},-116.74371544,-4.8643214766666665,-0.2473293666666668,"['xas', 'bandstructure']",True,[58846],True,2021-05-12 10:57:24.969000,NM,24,9,mp-568531,,Bi2Pt,"{'functional': 'PBE', 'labels': ['Bi', 'Pt'], 'pot_type': 'paw'}","{'Bi': 2.0, 'Pt': 1.0}",GGA,mp-568531,"['mp-941110', 'mp-568531', 'mp-580060', 'mp-941424', 'mp-934586', 'mp-1399624', 'mp-1755005', 'mp-1889447', 'mp-1620313']",6.81125e-05,"{'Bi': 16.0, 'Pt': 8.0}",648.6271396066975,[],NM,False,61,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",8.400820235958772e-07,6.81125e-05,0,0.0005449,MP,data/source/MP/cleaned/cifs/MP-mp-568531.cif,False,,data/final/MP/graphs/Bi2Pt1-MP-mp-568531.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ba2Cu1Hg1O4.3,2,0.0361445783132529,0.9300581395348836,True,Ba1.86Cu0.93Hg0.93O4,Ba2Cu1Hg1O4,81.0,Cuprate,True,Ba24.096Cu12.048Hg12.048O51.80722891566264,Ba-Cu-Hg-O,4,Supercon,Hg1Ba2Cu1O4.3,MP-mp-6562,Ba2Cu1Hg1O4,Ba-Cu-Hg-O,Ba25Cu12.5Hg12.5O50,P 4/m m m,tetragonal,3.933714,3.933714,9.827602,data/final/MP/cifs/Ba2Cu1Hg1O4.3-MP-mp-6562-synth_doped.cif,data/source/MP/raw/cifs/mp-6562.cif,mp-6562,0.0,,2011-05-13 18:18:06,6.582036471328142,10.17188/1281336,"@misc{osti_1281336,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2CuHgO4 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281336"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697135'}},0.0234340381250053,2.58068675,520.0,-40.91481298,-5.1143516225,"{'tags': ['Mercury dibarium copper oxide', 'High pressure experimental phase']}",-40.91481298,-5.1143516225,-1.953767533125,"['xas', 'bandstructure']",True,"[75722, 75720, 75724, 75721, 75723]",True,2021-05-12 10:57:32.679000,NM,8,8,mp-6562,oxide,Ba2CuHgO4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Cu_pv', 'Hg', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",GGA,mp-6562,"['mp-6562', 'mp-990899', 'mp-992892', 'mp-1435690', 'mp-1697135', 'mp-1878488', 'mp-994198', 'mp-1592659']",0.0003984,"{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",152.07335344042525,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0, 0, 0]",2.619788352047311e-06,0.0003984,0,0.0003984,MP,data/source/MP/cleaned/cifs/MP-mp-6562.cif,True,,data/final/MP/graphs/Ba2Cu1Hg1O4.3-MP-mp-6562-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Nd2Ni1O4,1,0.0,4.0,False,Nd8Ni4O16,Nd8Ni4O16,0.0,Oxide,True,Nd28.571Ni14.286O57.142857142857146,Nd-Ni-O,3,Supercon,Nd2Ni1O4,MP-mp-505052,Nd8Ni4O16,Nd-Ni-O,Nd28.571Ni14.286O57.142857142857146,P 42/n c m,tetragonal,5.575695,5.575695,12.142091,data/final/MP/cifs/Nd2Ni1O4-MP-mp-505052.cif,data/source/MP/raw/cifs/mp-505052.cif,mp-505052,0.0,,2013-10-11 00:19:28,7.235095838323551,,,{'GGA+U': {'task_id': 'mp-1766480'}},0.0702856853571409,5.41041378,520.0,-202.6847323,-7.238740439285714,{'tags': ['Dineodymium niccolate']},-202.6847323,-7.238740439285714,-2.978845136428572,"['xas', 'bandstructure']",True,"[248653, 248652, 66061]",True,2021-05-12 10:57:10.838000,FM,28,13,mp-505052,oxide,Nd2NiO4,"{'functional': 'PBE', 'labels': ['Nd_3', 'Ni_pv', 'O'], 'pot_type': 'paw'}","{'Nd': 2.0, 'Ni': 1.0, 'O': 4.0}",GGA+U,mp-505052,"['mp-680962', 'mp-701154', 'mp-712548', 'mp-1193098', 'mp-1193588', 'mp-541246', 'mp-505052', 'mp-616289', 'mp-1414547', 'mp-1766480', 'mp-1772186', 'mp-1844108', 'mp-1610984']",2.0004828,"{'Nd': 8.0, 'Ni': 4.0, 'O': 16.0}",377.47787505049024,[],FM,True,138,1,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 1.8, 1.8, 1.8, 1.8, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0211984111623222,2.0004828,4,8.0019312,MP,data/source/MP/cleaned/cifs/MP-mp-505052.cif,False,,data/final/MP/graphs/Nd2Ni1O4-MP-mp-505052.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Sn0.975Te1,2,0.0126582278481012,1.0,True,Sn0.975Te1,Sn1Te1,0.165,Other,True,Sn49.367Te50.633,Sn-Te,2,Supercon,Sn0.975Te1,MP-mp-1883,Sn1Te1,Sn-Te,Sn50Te50,F m -3 m,cubic,4.53766968,4.53766968,4.53766968,data/final/MP/cifs/Sn0.975Te1-MP-mp-1883-synth_doped.cif,data/source/MP/raw/cifs/mp-1883.cif,mp-1883,0.6623999999999999,,2011-05-12 18:43:07,6.19081042904143,10.17188/1193534,"@misc{osti_1193534,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SnTe (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1193534"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686906'}},0.0,6.06645058,520.0,-7.72519638,-3.86259819,"{'tags': ['Tin telluride (1/1)', 'Tin telluride']}",-7.72519638,-3.86259819,-0.4971617975000004,"['eos', 'elasticity', 'bandstructure', 'xas']",True,"[52489, 652760, 652744, 652756, 652761, 600865, 652763, 652745, 652742, 604177, 600813, 652741, 601065, 652750, 652755, 652753, 652751, 652749, 652752, 600136, 652754, 652746, 652759]",True,2021-05-12 10:56:14.760000,NM,2,9,mp-1883,,SnTe,"{'functional': 'PBE', 'labels': ['Sn_d', 'Te'], 'pot_type': 'paw'}","{'Sn': 1.0, 'Te': 1.0}",GGA,mp-1883,"['mp-663289', 'mp-655511', 'mp-657302', 'mp-1883', 'mp-1440781', 'mp-1686906', 'mp-1784332', 'mp-1596407', 'mp-1596974']",0.0,"{'Sn': 1.0, 'Te': 1.0}",66.06685541129963,[],NM,False,225,0,"[0, 0]",0.0,0.0,0,0.0,MP,data/source/MP/cleaned/cifs/MP-mp-1883.cif,True,,data/final/MP/graphs/Sn0.975Te1-MP-mp-1883-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Cu2Gd1Ru1Sr2O8,1,0.0,2.0,False,Cu4Gd2Ru2Sr4O16,Cu4Gd2Ru2Sr4O16,16.45,Cuprate,True,Cu14.286Gd7.143Ru7.143Sr14.286O57.142857142857146,Cu-Gd-Ru-Sr-O,5,Supercon,Gd1Sr2Ru1Cu2O8,MP-mp-1194240,Sr4Gd2Cu4Ru2O16,Cu-Gd-Ru-Sr-O,Cu14.286Gd7.143Ru7.143Sr14.286O57.142857142857146,P 4/m b m,tetragonal,5.472451,5.472451,11.740702,data/final/MP/cifs/Cu2Gd1Ru1Sr2O8-MP-mp-1194240.cif,data/source/MP/raw/cifs/mp-1194240.cif,mp-1194240,0.0,,2019-01-11 23:51:58.932000,6.504561898971391,,,{'GGA': {'task_id': 'mp-1765260'}},0.0213449239285443,3.93502801,520.0,-201.55352223,-7.198340079642857,"{'tags': ['Sr2Cu2GdRuO8 orth', 'Sr2Cu2GdRuO8', 'Ruthenium distrontium gadolinium dicopper octaoxide']}",-201.55352223,-7.198340079642857,-2.268654352380952,['bandstructure'],True,[245741],True,2021-05-12 10:58:35.561000,FiM,28,6,mp-1194240,oxide,Sr2GdCu2RuO8,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Gd', 'Cu_pv', 'Ru_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Gd': 1.0, 'Cu': 2.0, 'Ru': 1.0, 'O': 8.0}",GGA,mp-1194240,"['mp-1194240', 'mp-1396976', 'mp-1659973', 'mp-1765260', 'mp-1841948', 'mp-1638264']",4.23696715,"{'Sr': 4.0, 'Gd': 2.0, 'Cu': 4.0, 'Ru': 2.0, 'O': 16.0}",351.6072554818909,[],FiM,True,127,2,"[-0.0, -0.0, -0.0, -0.0, 6.9, 6.9, 0.0, 0.0, 0.0, 0.0, -1.8, -1.8, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0241005672319991,4.23696715,4,8.4739343,MP,data/source/MP/cleaned/cifs/MP-mp-1194240.cif,False,,data/final/MP/graphs/Cu2Gd1Ru1Sr2O8-MP-mp-1194240.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Gd0.04La0.96Ru2,2,0.0266666666666666,2.0,False,Gd0.08La1.92Ru4,La2Ru4,2.27,Other,True,Gd1.333La32Ru66.667,Gd-La-Ru,3,Supercon,La0.96Gd0.04Ru2,MP-mp-2019,La2Ru4,La-Ru,La33.333Ru66.667,F d -3 m,cubic,5.46409128,5.464091279999999,5.464091279999999,data/final/MP/cifs/Gd0.04La0.96Ru2-MP-mp-2019-synth_doped.cif,data/source/MP/raw/cifs/mp-2019.cif,mp-2019,0.0,,2011-05-13 21:42:56,9.818667150990734,10.17188/1195329,"@misc{osti_1195329,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaRu2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195329"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686817'}},0.0017745359523804,8.6251779,520.0,-47.76122776,-7.960204626666666,"{'tags': ['Lanthanum ruthenium hydride (1/2/4)', 'Lanthanum ruthenium (1/2)']}",-47.76122776,-7.960204626666666,-0.1319424883333321,"['xas', 'elasticity', 'bandstructure']",True,"[104712, 641760, 641778, 638256, 641771, 641766, 641774, 638255, 641762, 104713, 641761, 641775, 641777]",True,2021-05-12 10:56:14.760000,NM,6,14,mp-2019,,LaRu2,"{'functional': 'PBE', 'labels': ['La', 'Ru_pv'], 'pot_type': 'paw'}","{'La': 1.0, 'Ru': 2.0}",GGA,mp-2019,"['mp-935098', 'mp-941760', 'mp-941909', 'mp-2019', 'mp-1072861', 'mp-1072969', 'mp-1072939', 'mp-1077306', 'mp-1442150', 'mp-1686817', 'mp-1803378', 'mp-1590466', 'mp-1596026', 'mp-1072974']",0.000191,"{'La': 2.0, 'Ru': 4.0}",115.35564200581236,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",3.311498192526659e-06,0.000191,0,0.000382,MP,data/source/MP/cleaned/cifs/MP-mp-2019.cif,True,,data/final/MP/graphs/Gd0.04La0.96Ru2-MP-mp-2019-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
C1Fe0.005Mg1Ni2.995,2,0.0019999999999999,1.0,True,C1Fe0.005Mg1Ni2.995,C1Mg1Ni3,6.44,Other,True,C20Fe0.1Mg20Ni59.9,C-Fe-Mg-Ni,4,Supercon,Mg1C1Ni2.995Fe0.005,MP-mp-10700,Mg1Ni3C1,C-Mg-Ni,C20Mg20Ni60,P m -3 m,cubic,3.810209,3.810209,3.810209,data/final/MP/cifs/C1Fe0.005Mg1Ni2.995-MP-mp-10700-synth_doped.cif,data/source/MP/raw/cifs/mp-10700.cif,mp-10700,0.0,,2011-05-28 10:04:44,6.376007671789427,10.17188/1187303,"@misc{osti_1187303,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MgNi3C (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187303"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678621'}},0.0,6.64260176,520.0,-28.85099542,-5.770199084,{'tags': ['Magnesium nickel carbide (1/3/1)']},-28.85099542,-5.770199084,-0.1367049259999994,"['xas', 'elasticity', 'bandstructure']",True,[77152],True,2021-05-12 10:56:10.715000,NM,5,8,mp-10700,,MgNi3C,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Ni_pv', 'C'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",GGA,mp-10700,"['mp-927245', 'mp-927653', 'mp-911184', 'mp-10700', 'mp-1438083', 'mp-1678621', 'mp-1791467', 'mp-1591421']",0.0387875,"{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",55.31544309398296,[],NM,False,221,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",0.0007012056277683,0.0387875,0,0.0387875,MP,data/source/MP/cleaned/cifs/MP-mp-10700.cif,True,,data/final/MP/graphs/C1Fe0.005Mg1Ni2.995-MP-mp-10700-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
C0.55W0.45,3,0.1,2.0,False,C1.1W0.9,C1W1,8.1,Other,True,C55W45,C-W,2,Supercon,C0.55W0.45,MP-mp-1894,W1C1,C-W,C50W50,P -6 m 2,hexagonal,2.852907,2.9283199959743635,2.92832042,data/final/MP/cifs/C0.55W0.45-MP-mp-1894-synth_doped.cif,data/source/MP/raw/cifs/mp-1894.cif,mp-1894,0.0,,2011-05-12 17:47:36,15.350369295511475,10.17188/1193675,"@misc{osti_1193675,
    author = ""Persson, Kristin"",
    title = ""Materials Data on WC (SG:187) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1193675"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668674'}},0.0,7.78064382,520.0,-22.43019027,-11.215095135,"{'tags': ['Tungsten carbide (1/1) - h', 'Qusongite', 'Tungsten carbide (1/1)', 'Tungsten carbide - h', 'High pressure experimental phase', 'Tungsten carbide']}",-22.43019027,-11.215095135,-0.1226415499999991,"['xas', 'elasticity', 'bandstructure']",True,"[5212, 290352, 246151, 165099, 246149, 22258, 162416, 167895, 619091, 43380, 260168, 15406, 77566, 619090, 619096, 260171, 169401, 260166, 246150, 619088]",True,2021-05-12 10:56:14.760000,NM,2,18,mp-1894,,WC,"{'functional': 'PBE', 'labels': ['W_pv', 'C'], 'pot_type': 'paw'}","{'W': 1.0, 'C': 1.0}",GGA,mp-1894,"['mp-906287', 'mp-920052', 'mp-919065', 'mp-1894', 'mp-1056906', 'mp-1056929', 'mp-1056966', 'mp-1057325', 'mp-1057365', 'mp-1057304', 'mp-1115952', 'mp-1441004', 'mp-1668674', 'mp-1923176', 'mp-1590542', 'mp-1589375', 'mp-1056943', 'mp-1057342']",5.59e-05,"{'W': 1.0, 'C': 1.0}",21.18631365214464,[],NM,False,187,0,"[0, 0]",2.638495819415068e-06,5.59e-05,0,5.59e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1894.cif,True,,data/final/MP/graphs/C0.55W0.45-MP-mp-1894-synth_doped.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Fe2Ge2Sm1,1,0.0,1.0,True,Fe2Ge2Sm1,Fe2Ge2Sm1,0.0,Other,True,Fe40Ge40Sm20,Fe-Ge-Sm,3,Supercon,Sm1Fe2Ge2,MP-mp-22349,Sm1Fe2Ge2,Fe-Ge-Sm,Fe40Ge40Sm20,I 4/m m m,tetragonal,3.995371998898602,3.995371998898602,6.08121249,data/final/MP/cifs/Fe2Ge2Sm1-MP-mp-22349.cif,data/source/MP/raw/cifs/mp-22349.cif,mp-22349,0.0,,2014-02-21 14:32:32,7.868368627305664,10.17188/1197577,"@misc{osti_1197577,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sm(FeGe)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197577"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678052'}},0.0,5.61956174,520.0,-33.13954521,-6.627909042000001,"{'tags': ['Iron samarium germanide (2/1/2)', 'Samarium iron germanide (1/2/2)']}",-33.13954521,-6.627909042000001,-0.4469772930000005,"['xas', 'bandstructure']",True,"[632127, 107211, 600228]",True,2021-05-12 10:56:59.077000,FM,5,8,mp-22349,,Sm(FeGe)2,"{'functional': 'PBE', 'labels': ['Sm_3', 'Fe_pv', 'Ge_d'], 'pot_type': 'paw'}","{'Sm': 1.0, 'Fe': 2.0, 'Ge': 2.0}",GGA,mp-22349,"['mp-991001', 'mp-992992', 'mp-22349', 'mp-1441650', 'mp-1678052', 'mp-1801559', 'mp-994366', 'mp-1596644']",4.6567334,"{'Sm': 1.0, 'Fe': 2.0, 'Ge': 2.0}",85.96284821365707,[],FM,True,139,1,"[0.0, 2.3, 2.3, 0.0, 0.0]",0.0541714647288778,4.6567334,2,4.6567334,MP,data/source/MP/cleaned/cifs/MP-mp-22349.cif,False,,data/final/MP/graphs/Fe2Ge2Sm1-MP-mp-22349.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ce0.837Co1In5Yb0.163,3,0.0465714285714285,1.0,True,Ce0.837Co1In5Yb0.163,Ce1Co1In5,1.4,Heavy_fermion,True,Ce11.957Co14.286In71.429Yb2.329,Ce-Co-In-Yb,4,Supercon,Ce0.837Yb0.163Co1In5,MP-mp-19961,Ce1In5Co1,Ce-Co-In,Ce14.286Co14.286In71.429,P 4/m m m,tetragonal,4.635989,4.635989,7.564124,data/final/MP/cifs/Ce0.837Co1In5Yb0.163-MP-mp-19961-synth_doped.cif,data/source/MP/raw/cifs/mp-19961.cif,mp-19961,0.0,,2014-02-21 14:08:25,7.897022127398995,10.17188/1195145,"@misc{osti_1195145,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeIn5Co (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195145"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701944'}},0.0,7.80626318,520.0,-28.52795357,-4.075421938571429,{'tags': ['Cerium cobalt indium (1/1/5)']},-28.52795357,-4.075421938571429,-0.2468754242857146,"['xas', 'bandstructure']",True,[102108],True,2021-05-12 10:56:57.051000,FM,7,8,mp-19961,,CeIn5Co,"{'functional': 'PBE', 'labels': ['Ce', 'In_d', 'Co'], 'pot_type': 'paw'}","{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",GGA,mp-19961,"['mp-928775', 'mp-912209', 'mp-928270', 'mp-19961', 'mp-1504062', 'mp-1701944', 'mp-1785253', 'mp-1593180']",0.9310323,"{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",162.57113333428427,[],FM,True,123,1,"[0.7, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0057269226147644,0.9310323,1,0.9310323,MP,data/source/MP/cleaned/cifs/MP-mp-19961.cif,True,,data/final/MP/graphs/Ce0.837Co1In5Yb0.163-MP-mp-19961-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ce0.02Cu2Gd0.98Ru1Sr2O8,2,0.0028571428571428,2.0,False,Ce0.04Cu4Gd1.96Ru2Sr4O16,Cu4Gd2Ru2Sr4O16,13.0,Cuprate,True,Ce0.143Cu14.286Gd7Ru7.143Sr14.286O57.142857142857146,Ce-Cu-Gd-Ru-Sr-O,6,Supercon,Ru1Sr2Gd0.98Ce0.02Cu2O8,MP-mp-1194240,Sr4Gd2Cu4Ru2O16,Cu-Gd-Ru-Sr-O,Cu14.286Gd7.143Ru7.143Sr14.286O57.142857142857146,P 4/m b m,tetragonal,5.472451,5.472451,11.740702,data/final/MP/cifs/Ce0.02Cu2Gd0.98Ru1Sr2O8-MP-mp-1194240-synth_doped.cif,data/source/MP/raw/cifs/mp-1194240.cif,mp-1194240,0.0,,2019-01-11 23:51:58.932000,6.504561898971391,,,{'GGA': {'task_id': 'mp-1765260'}},0.0213449239285443,3.93502801,520.0,-201.55352223,-7.198340079642857,"{'tags': ['Sr2Cu2GdRuO8 orth', 'Sr2Cu2GdRuO8', 'Ruthenium distrontium gadolinium dicopper octaoxide']}",-201.55352223,-7.198340079642857,-2.268654352380952,['bandstructure'],True,[245741],True,2021-05-12 10:58:35.561000,FiM,28,6,mp-1194240,oxide,Sr2GdCu2RuO8,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Gd', 'Cu_pv', 'Ru_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Gd': 1.0, 'Cu': 2.0, 'Ru': 1.0, 'O': 8.0}",GGA,mp-1194240,"['mp-1194240', 'mp-1396976', 'mp-1659973', 'mp-1765260', 'mp-1841948', 'mp-1638264']",4.23696715,"{'Sr': 4.0, 'Gd': 2.0, 'Cu': 4.0, 'Ru': 2.0, 'O': 16.0}",351.6072554818909,[],FiM,True,127,2,"[-0.0, -0.0, -0.0, -0.0, 6.9, 6.9, 0.0, 0.0, 0.0, 0.0, -1.8, -1.8, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0241005672319991,4.23696715,4,8.4739343,MP,data/source/MP/cleaned/cifs/MP-mp-1194240.cif,True,,data/final/MP/graphs/Ce0.02Cu2Gd0.98Ru1Sr2O8-MP-mp-1194240-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Cu1La2O4.095,2,0.0114768951978253,0.9769336589336588,True,Cu0.977La1.954O4,Cu1La2O4,37.8,Cuprate,True,Cu14.094La28.189O57.71670190274841,Cu-La-O,3,Supercon,La2Cu1O4.095,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La2O4.095-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La2O4.095-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Bi3La5,3,0.1071428571428571,1.6,False,Bi4.8La8,Bi6La8,0.64,Other,True,Bi37.5La62.5,Bi-La,2,Supercon,Bi3La5,MP-mp-23187,La8Bi6,Bi-La,Bi42.857La57.143,I -4 3 d,cubic,8.572362851900358,8.57236285,8.57236285,data/final/MP/cifs/Bi3La5-MP-mp-23187-synth_doped.cif,data/source/MP/raw/cifs/mp-23187.cif,mp-23187,0.0,,2015-02-14 22:11:16,8.098855738108531,10.17188/1199308,"@misc{osti_1199308,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La4Bi3 (SG:220) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199308"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1709178'}},0.0090124692857171,7.47358142,520.0,-75.64336009,-5.403097149285714,{'tags': ['Lanthanum bismuthide (4/3)']},-75.64336009,-5.403097149285714,-0.9153640992857148,"['xas', 'bandstructure']",True,"[616759, 616755, 602181]",True,2021-05-12 10:56:59.077000,NM,14,8,mp-23187,,La4Bi3,"{'functional': 'PBE', 'labels': ['La', 'Bi'], 'pot_type': 'paw'}","{'La': 4.0, 'Bi': 3.0}",GGA,mp-23187,"['mp-943647', 'mp-944300', 'mp-933384', 'mp-23187', 'mp-1417713', 'mp-1709178', 'mp-1823584', 'mp-1584485']",0.2794345,"{'La': 8.0, 'Bi': 6.0}",484.9307745583912,[],NM,False,220,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.001152471712089,0.2794345,0,0.558869,MP,data/source/MP/cleaned/cifs/MP-mp-23187.cif,True,,data/final/MP/graphs/Bi3La5-MP-mp-23187-synth_doped.json,0,True,-43m,5,0,0,0,0,0,0,0,0,1,0,1.0,False
Al0.04Nb3Sn0.96,2,0.02,2.0,False,Al0.08Nb6Sn1.92,Nb6Sn2,18.0,Other,True,Al1Nb75Sn24,Al-Nb-Sn,3,Supercon,Nb3Sn0.96Al0.04,MP-mp-1326,Nb6Sn2,Nb-Sn,Nb75Sn25,P m -3 n,cubic,5.334611,5.334611,5.334611,data/final/MP/cifs/Al0.04Nb3Sn0.96-MP-mp-1326-synth_doped.cif,data/source/MP/raw/cifs/mp-1326.cif,mp-1326,0.0,,2011-05-14 09:51:48,8.694218121896231,10.17188/1189484,"@misc{osti_1189484,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Sn (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189484"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668415'}},0.0,6.59372491,520.0,-69.93787048,-8.74223381,{'tags': ['Niobium tin (3/1)']},-69.93787048,-8.74223381,-0.163862066250001,"['xas', 'elasticity', 'bandstructure']",True,"[105230, 645503, 645489, 105231, 645498, 645485, 645474, 645496, 645480, 645488, 645482, 645487, 645500, 645493, 645477, 645484, 645502, 645483, 150878, 645479, 645481, 645486, 645473]",True,2021-05-12 10:56:12.755000,NM,8,9,mp-1326,,Nb3Sn,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Sn_d'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Sn': 1.0}",GGA,mp-1326,"['mp-930046', 'mp-913770', 'mp-930577', 'mp-1326', 'mp-1440651', 'mp-1668415', 'mp-1880085', 'mp-1594093', 'mp-1594507']",0.62023085,"{'Nb': 6.0, 'Sn': 2.0}",151.81275738025872,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0081709977567491,0.62023085,0,1.2404617,MP,data/source/MP/cleaned/cifs/MP-mp-1326.cif,True,,data/final/MP/graphs/Al0.04Nb3Sn0.96-MP-mp-1326-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
B1W1,1,0.0,4.0,False,B4W4,B4W4,0.0,Other,True,B50W50,B-W,2,Supercon,B1W1,MP-mp-7832,B4W4,B-W,B50W50,I 41/a m d,tetragonal,3.145742000257106,3.145742000257106,8.80738784,data/final/MP/cifs/B1W1-MP-mp-7832.cif,data/source/MP/raw/cifs/mp-7832.cif,mp-7832,0.0,,2011-05-28 10:19:05,15.331502687920084,10.17188/1307729,"@misc{osti_1307729,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BW (SG:141) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1307729"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704651'}},0.0,8.99280616,520.0,-81.49148885,-10.18643610625,"{'tags': ['Tungsten boride (1/1) - delta', 'Tungsten boride', 'Tungsten boride (1/1)']}",-81.49148885,-10.18643610625,-0.3676769858333326,"['bandstructure', 'elasticity']",True,"[424240, 615685, 24281, 191911, 615698]",True,2021-05-12 10:56:31.128000,NM,8,10,mp-7832,,BW,"{'functional': 'PBE', 'labels': ['B', 'W_pv'], 'pot_type': 'paw'}","{'B': 1.0, 'W': 1.0}",GGA,mp-7832,"['mp-929820', 'mp-930330', 'mp-913353', 'mp-7832', 'mp-1078513', 'mp-1079154', 'mp-1438124', 'mp-1704651', 'mp-1799973', 'mp-1592729']",4.775e-06,"{'B': 4.0, 'W': 4.0}",84.32978721842596,[],NM,False,141,0,"[0, 0, 0, 0, 0, 0, 0, 0]",2.264917371429899e-07,4.775e-06,0,1.91e-05,MP,data/source/MP/cleaned/cifs/MP-mp-7832.cif,False,,data/final/MP/graphs/B1W1-MP-mp-7832.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As1.846Ba1Ni2P0.154,3,0.0615999999999999,1.0,True,As1.846Ba1Ni2P0.154,As2Ba1Ni2,3.28,Ferrite,True,As36.92Ba20Ni40P3.08,As-Ba-Ni-P,4,Supercon,Ba1Ni2As1.846P0.154,MP-mp-568280,Ba1Ni2As2,As-Ba-Ni,As40Ba20Ni40,I 4/m m m,tetragonal,4.156554001148825,4.156554001148825,6.57789079,data/final/MP/cifs/As1.846Ba1Ni2P0.154-MP-mp-568280-synth_doped.cif,data/source/MP/raw/cifs/mp-568280.cif,mp-568280,0.0,,2014-02-16 06:02:25,6.607461026403792,10.17188/1274340,"@misc{osti_1274340,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba(NiAs)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1274340"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698065'}},0.0,5.18272169,520.0,-26.07345637,-5.214691274,"{'tags': ['Barium nickel arsenide (1/2/2)', 'Barium dinickel diarsenide']}",-26.07345637,-5.214691274,-0.6551950740000002,"['xas', 'elasticity', 'bandstructure']",True,"[185463, 609856, 164197]",True,2021-05-12 10:56:22.739000,NM,5,10,mp-568280,,Ba(NiAs)2,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ni_pv', 'As'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Ni': 2.0, 'As': 2.0}",GGA,mp-568280,"['mp-568280', 'mp-1069503', 'mp-1069542', 'mp-1069572', 'mp-1441346', 'mp-1698065', 'mp-1795849', 'mp-1923070', 'mp-1595137', 'mp-1069566']",0.0042893,"{'Ba': 1.0, 'Ni': 2.0, 'As': 2.0}",101.67032396892152,[],NM,False,139,0,"[0, 0, 0, 0, 0]",4.218831840558656e-05,0.0042893,0,0.0042893,MP,data/source/MP/cleaned/cifs/MP-mp-568280.cif,True,,data/final/MP/graphs/As1.846Ba1Ni2P0.154-MP-mp-568280-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As2Ba0.677Fe2K0.323,3,0.0708,2.0,False,As4Ba1.354Fe4K0.646,As4Ba1Fe4K1,37.0,Ferrite,True,As40Ba13.54Fe40K6.46,As-Ba-Fe-K,4,Supercon,Ba0.677K0.323Fe2As2,MP-mp-1223517,K1Ba1Fe4As4,As-Ba-Fe-K,As40Ba10Fe40K10,C m m m,orthorhombic,5.479027,5.480024002658328,7.13170472,data/final/MP/cifs/As2Ba0.677Fe2K0.323-MP-mp-1223517-synth_doped.cif,data/source/MP/raw/cifs/mp-1223517.cif,mp-1223517,0.0,,2019-01-12 23:54:03.876000,5.87534599912672,,,{'GGA': {'task_id': 'mp-1743010'}},0.0132513644999994,4.21185628,520.0,-59.66633886,-5.966633886,{'tags': []},-59.66633886,-5.966633886,-0.4120461663000007,[],False,[],True,2021-05-12 11:00:52.054000,FM,10,4,mp-1223517,,KBa(FeAs)4,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",GGA,mp-1223517,"['mp-1223517', 'mp-1396881', 'mp-1743010', 'mp-1827585']",0.9947188,"{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",197.6961518155852,[],FM,True,65,1,"[0.0, 0.0, 0.3, 0.3, 0.3, 0.3, 0.0, 0.0, 0.0, 0.0]",0.0050315536790412,0.9947188,4,0.9947188,MP,data/source/MP/cleaned/cifs/MP-mp-1223517.cif,True,,data/final/MP/graphs/As2Ba0.677Fe2K0.323-MP-mp-1223517-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
As12Fe4La1,1,0.0,1.0,True,As12Fe4La1,As12Fe4La1,0.0,Ferrite,True,As70.588Fe23.529La5.882,As-Fe-La,3,Supercon,La1Fe4As12,MP-mp-22470,La1Fe4As12,As-Fe-La,As70.588Fe23.529La5.882,I m -3,cubic,7.242650131605583,7.24265013,7.242650130000001,data/final/MP/cifs/As12Fe4La1-MP-mp-22470.cif,data/source/MP/raw/cifs/mp-22470.cif,mp-22470,0.0,,2014-02-22 14:55:24,7.161636045938163,10.17188/1198374,"@misc{osti_1198374,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La(FeAs3)4 (SG:204) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198374"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1670263'}},0.0,6.30866078,520.0,-101.60338379,-5.976669634705882,{'tags': ['Lanthanum iron arsenide (1/4/12)']},-101.60338379,-5.976669634705882,-0.4045836485294111,"['xas', 'bandstructure']",True,"[168584, 23080]",True,2021-05-12 10:56:59.077000,NM,17,8,mp-22470,,La(FeAs3)4,"{'functional': 'PBE', 'labels': ['La', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'La': 1.0, 'Fe': 4.0, 'As': 12.0}",GGA,mp-22470,"['mp-993400', 'mp-991442', 'mp-22470', 'mp-1421248', 'mp-1670263', 'mp-1806613', 'mp-994847', 'mp-1605117']",0.0655078,"{'La': 1.0, 'Fe': 4.0, 'As': 12.0}",292.46279586779906,[],NM,False,204,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0002239867802864,0.0655078,0,0.0655078,MP,data/source/MP/cleaned/cifs/MP-mp-22470.cif,False,,data/final/MP/graphs/As12Fe4La1-MP-mp-22470.json,0,True,m-3,2,0,0,0,0,0,0,0,0,1,0,1.0,False
Bi2Ca1Cu2Sr2O8.428,2,0.025892316999395,1.8983867584243,False,Bi3.797Ca1.898Cu3.797Sr3.797O16,Bi4Ca2Cu4Sr4O16,42.1,Cuprate,True,Bi12.963Ca6.482Cu12.963Sr12.963O54.62794918330309,Bi-Ca-Cu-Sr-O,5,Supercon,Bi2Sr2Ca1Cu2O8.428,MP-mp-1218930,Sr4Ca2Cu4Bi4O16,Bi-Ca-Cu-Sr-O,Bi13.333Ca6.667Cu13.333Sr13.333O53.333333333333336,C c c 2,orthorhombic,5.417115,5.472898000129128,16.11398919,data/final/MP/cifs/Bi2Ca1Cu2Sr2O8.428-MP-mp-1218930-synth_doped.cif,data/source/MP/raw/cifs/mp-1218930.cif,mp-1218930,0.0,,2019-01-12 20:01:06.544000,6.266668983881059,,,,0.039252223722225,4.51768334,520.0,-173.15021002,-5.771673667333333,{'tags': []},-173.15021002,-5.771673667333333,-2.074956548222222,[],False,[],True,2021-05-12 11:00:42.526000,NM,30,3,mp-1218930,oxide,Sr2CaCu2(BiO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",GGA,mp-1218930,"['mp-1218930', 'mp-1359698', 'mp-1817714']",0.00011165,"{'Sr': 4.0, 'Ca': 2.0, 'Cu': 4.0, 'Bi': 4.0, 'O': 16.0}",470.7976286073367,[],NM,False,37,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.743014544498498e-07,0.00011165,0,0.0002233,MP,data/source/MP/cleaned/cifs/MP-mp-1218930.cif,True,,data/final/MP/graphs/Bi2Ca1Cu2Sr2O8.428-MP-mp-1218930-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
C0.906Mg1Ni3,2,0.0306563391765185,1.0,True,C0.906Mg1Ni3,C1Mg1Ni3,3.38,Other,True,C18.467Mg20.383Ni61.15,C-Mg-Ni,3,Supercon,Mg1C0.906Ni3,MP-mp-10700,Mg1Ni3C1,C-Mg-Ni,C20Mg20Ni60,P m -3 m,cubic,3.810209,3.810209,3.810209,data/final/MP/cifs/C0.906Mg1Ni3-MP-mp-10700-synth_doped.cif,data/source/MP/raw/cifs/mp-10700.cif,mp-10700,0.0,,2011-05-28 10:04:44,6.376007671789427,10.17188/1187303,"@misc{osti_1187303,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MgNi3C (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187303"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678621'}},0.0,6.64260176,520.0,-28.85099542,-5.770199084,{'tags': ['Magnesium nickel carbide (1/3/1)']},-28.85099542,-5.770199084,-0.1367049259999994,"['xas', 'elasticity', 'bandstructure']",True,[77152],True,2021-05-12 10:56:10.715000,NM,5,8,mp-10700,,MgNi3C,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Ni_pv', 'C'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",GGA,mp-10700,"['mp-927245', 'mp-927653', 'mp-911184', 'mp-10700', 'mp-1438083', 'mp-1678621', 'mp-1791467', 'mp-1591421']",0.0387875,"{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",55.31544309398296,[],NM,False,221,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",0.0007012056277683,0.0387875,0,0.0387875,MP,data/source/MP/cleaned/cifs/MP-mp-10700.cif,True,,data/final/MP/graphs/C0.906Mg1Ni3-MP-mp-10700-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
B2C1Dy0.75Ni2Tb0.25,3,0.0833333333333333,1.0,True,B2C1Dy0.75Ni2Tb0.25,B2C1Dy1Ni2,3.24,Other,True,B33.333C16.667Dy12.5Ni33.333Tb4.167,B-C-Dy-Ni-Tb,5,Supercon,Dy0.75Tb0.25Ni2B2C1,MP-mp-6223,Dy1Ni2B2C1,B-C-Dy-Ni,B33.333C16.667Dy16.667Ni33.333,I 4/m m m,tetragonal,3.5485979995620824,3.548597999562083,5.74460959,data/final/MP/cifs/B2C1Dy0.75Ni2Tb0.25-MP-mp-6223-synth_doped.cif,data/source/MP/raw/cifs/mp-6223.cif,mp-6223,0.0,,2011-05-13 04:15:09,8.00036369104547,10.17188/1278123,"@misc{osti_1278123,
    author = ""Persson, Kristin"",
    title = ""Materials Data on DyNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278123"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687390'}},0.0,6.75219219,520.0,-41.84976027,-6.974960045,{'tags': []},-41.84976027,-6.974960045,-0.5161893047222215,"['xas', 'elasticity', 'bandstructure']",True,"[56596, 56593, 56595, 79573, 56649, 56594]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-6223,,DyNi2B2C,"{'functional': 'PBE', 'labels': ['Dy_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Dy': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6223,"['mp-1007344', 'mp-1000899', 'mp-6223', 'mp-1439353', 'mp-1687390', 'mp-1795426', 'mp-1012086', 'mp-1593735']",0.004911,"{'Dy': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.07346390684725,[],NM,False,139,0,"[0.0, -0.0, -0.0, 0.0, 0.0, 0.0]",7.546855054512086e-05,0.004911,0,0.004911,MP,data/source/MP/cleaned/cifs/MP-mp-6223.cif,True,,data/final/MP/graphs/B2C1Dy0.75Ni2Tb0.25-MP-mp-6223-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Mo6Pb0.3Se8Yb0.7,3,0.04,1.0,True,Mo6Pb0.3Se8Yb0.7,Mo6Se8Yb1,7.1,Heavy_fermionChevrel,False,Mo40Pb2Se53.333Yb4.667,Mo-Pb-Se-Yb,4,Supercon,Pb0.3Yb0.7Mo6Se8,MP-mp-1103921,Yb1Mo6Se8,Mo-Se-Yb,Mo40Se53.333Yb6.667,R -3,trigonal,6.82637283,6.82637283,6.82637258,data/final/MP/cifs/Mo6Pb0.3Se8Yb0.7-MP-mp-1103921-synth_doped.cif,data/source/MP/raw/cifs/mp-1103921.cif,mp-1103921,0.0,,2018-07-18 20:18:04,7.207876122112935,,,{'GGA': {'task_id': 'mp-1673657'}},0.0413582060000008,4.81150279,520.0,-105.19901031,-7.013267354000001,"{'tags': ['Ytterbium molybdenum(II/III) selenide  (1/6/8)', 'Ytterbium molybdenum selenide (1/6/8)']}",-105.19901031,-7.013267354000001,-0.9596168019166668,['bandstructure'],True,"[644390, 600676]",True,2021-05-12 10:58:20.361000,NM,15,6,mp-1103921,,Yb(Mo3Se4)2,"{'functional': 'PBE', 'labels': ['Yb_2', 'Mo_pv', 'Se'], 'pot_type': 'paw'}","{'Yb': 1.0, 'Mo': 6.0, 'Se': 8.0}",GGA,mp-1103921,"['mp-1103921', 'mp-1104021', 'mp-1430393', 'mp-1673657', 'mp-1806630', 'mp-1603284']",0.0008047,"{'Yb': 1.0, 'Mo': 6.0, 'Se': 8.0}",318.005147027978,[],NM,False,148,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.530462187548188e-06,0.0008047,0,0.0008047,MP,data/source/MP/cleaned/cifs/MP-mp-1103921.cif,True,,data/final/MP/graphs/Mo6Pb0.3Se8Yb0.7-MP-mp-1103921-synth_doped.json,0,True,-3,0,0,0,0,0,0,2,1,0,0,0,1.0,False
B1.92F0.08Mg1,3,0.0533333333333333,1.0,True,B1.92F0.08Mg1,B2Mg1,21.0,Other,True,B64F2.667Mg33.333,B-F-Mg,3,Supercon,Mg1B1.92F0.08,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B1.92F0.08Mg1-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B1.92F0.08Mg1-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ce1Pt5,1,0.0,1.0,True,Ce1Pt5,Ce1Pt5,0.0,Heavy_fermion,True,Ce16.667Pt83.333,Ce-Pt,2,Supercon,Ce1Pt5,MP-mp-542777,Ce1Pt5,Ce-Pt,Ce16.667Pt83.333,P 6/m m m,hexagonal,4.4561,5.384818003904789,5.38481698,data/final/MP/cifs/Ce1Pt5-MP-mp-542777.cif,data/source/MP/raw/cifs/mp-542777.cif,mp-542777,0.0,,2014-02-26 15:06:05,16.554084937206174,10.17188/1266718,"@misc{osti_1266718,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CePt5 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1266718"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-929976'}},0.0,7.27981042,520.0,-40.49845784,-6.749742973333333,{'tags': ['Cerium platinum (1/5)']},-40.49845784,-6.749742973333333,-0.7018050225000003,"['xas', 'elasticity']",False,"[621875, 621879, 602756, 621867, 102259, 150747, 102260]",True,2021-05-12 10:56:22.739000,FM,6,7,mp-542777,,CePt5,"{'functional': 'PBE', 'labels': ['Ce', 'Pt'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Pt': 5.0}",GGA,mp-542777,"['mp-913635', 'mp-929976', 'mp-930508', 'mp-542777', 'mp-1439771', 'mp-1803744', 'mp-1590012']",0.2246355,"{'Ce': 1.0, 'Pt': 5.0}",111.89933573648348,[],FM,True,191,1,"[0.1, 0.0, 0.0, 0.0, 0.0, 0.0]",0.002007478404778,0.2246355,1,0.2246355,MP,data/source/MP/cleaned/cifs/MP-mp-542777.cif,False,,data/final/MP/graphs/Ce1Pt5-MP-mp-542777.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
B2C1Ni2Tm1,1,0.0,1.0,True,B2C1Ni2Tm1,B2C1Ni2Tm1,9.659,Other,True,B33.333C16.667Ni33.333Tm16.667,B-C-Ni-Tm,4,Supercon,Tm1Ni2B2C1,MP-mp-6754,Tm1Ni2B2C1,B-C-Ni-Tm,B33.333C16.667Ni33.333Tm16.667,I 4/m m m,tetragonal,3.4928639994202824,3.492863999420283,5.7937603300000005,data/final/MP/cifs/B2C1Ni2Tm1-MP-mp-6754.cif,data/source/MP/raw/cifs/mp-6754.cif,mp-6754,0.0,,2011-05-13 04:35:22,8.309262229712736,10.17188/1282688,"@misc{osti_1282688,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TmNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1282688"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696752'}},0.0,6.71149537,520.0,-41.76249282,-6.96041547,{'tags': []},-41.76249282,-6.96041547,-0.5234699658333332,"['xas', 'elasticity', 'bandstructure']",True,"[79577, 56652, 164574]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-6754,,TmNi2B2C,"{'functional': 'PBE', 'labels': ['Tm_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Tm': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6754,"['mp-6754', 'mp-1000684', 'mp-1007145', 'mp-1412917', 'mp-1696752', 'mp-1790753', 'mp-1011888', 'mp-1590290']",0.0028138,"{'Tm': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",63.94016944835002,[],NM,False,139,0,"[0.0, -0.0, -0.0, 0.0, 0.0, 0.0]",4.40067648283752e-05,0.0028138,0,0.0028138,MP,data/source/MP/cleaned/cifs/MP-mp-6754.cif,False,,data/final/MP/graphs/B2C1Ni2Tm1-MP-mp-6754.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As1Ir1La1,1,0.0,2.0,False,As2Ir2La2,As2Ir2La2,3.1,Other,True,As33.333Ir33.333La33.333,As-Ir-La,3,Supercon,La1Ir1As1,MP-mp-1071028,La2As2Ir2,As-Ir-La,As33.333Ir33.333La33.333,I 41 m d,tetragonal,4.24115399827885,4.24115399827885,8.06575723,data/final/MP/cifs/As1Ir1La1-MP-mp-1071028.cif,data/source/MP/raw/cifs/mp-1071028.cif,mp-1071028,0.0,,2018-03-22 04:30:33,10.012603013316,,,{'GGA': {'task_id': 'mp-1702239'}},0.0023557900000019,7.97160371,520.0,-43.11719081,-7.186198468333333,{'tags': ['Lanthanum iridium arsenide (1/1/1)']},-43.11719081,-7.186198468333333,-1.0416798250000003,['bandstructure'],True,[193890],True,2021-05-12 10:58:14.654000,NM,6,8,mp-1071028,,LaAsIr,"{'functional': 'PBE', 'labels': ['La', 'As', 'Ir'], 'pot_type': 'paw'}","{'La': 1.0, 'As': 1.0, 'Ir': 1.0}",GGA,mp-1071028,"['mp-1071135', 'mp-1071028', 'mp-1071063', 'mp-1418504', 'mp-1702239', 'mp-1790175', 'mp-1600712', 'mp-1071133']",0.00053645,"{'La': 2.0, 'As': 2.0, 'Ir': 2.0}",134.68066997154705,[],NM,False,109,0,"[0, 0, 0, 0, 0, 0]",7.966250837827458e-06,0.00053645,0,0.0010729,MP,data/source/MP/cleaned/cifs/MP-mp-1071028.cif,False,,data/final/MP/graphs/As1Ir1La1-MP-mp-1071028.json,0,True,4mm,0,0,0,0,5,0,0,0,0,1,0,1.0,False
Ir1Si1Y1,1,0.0,4.0,False,Ir4Si4Y4,Ir4Si4Y4,2.7,Other,True,Ir33.333Si33.333Y33.333,Ir-Si-Y,3,Supercon,Y1Ir1Si1,MP-mp-1102268,Y4Si4Ir4,Ir-Si-Y,Ir33.333Si33.333Y33.333,P n m a,orthorhombic,4.238546,6.866414,7.505181,data/final/MP/cifs/Ir1Si1Y1-MP-mp-1102268.cif,data/source/MP/raw/cifs/mp-1102268.cif,mp-1102268,0.0,,2018-07-18 13:57:18,9.402692767907618,,,{'GGA': {'task_id': 'mp-1705070'}},0.0,6.94423419,520.0,-95.72820629,-7.977350524166667,"{'tags': ['Yttrium iridium silicide (1/1/1)', 'YIrSi', 'AlB2 family', 'TiNiSi', 'Iridium yttrium silicide (1/1/1)']}",-95.72820629,-7.977350524166667,-1.0672786730555568,['bandstructure'],True,"[641028, 427253]",True,2021-05-12 10:58:20.361000,NM,12,6,mp-1102268,,YSiIr,"{'functional': 'PBE', 'labels': ['Y_sv', 'Si', 'Ir'], 'pot_type': 'paw'}","{'Y': 1.0, 'Si': 1.0, 'Ir': 1.0}",GGA,mp-1102268,"['mp-1102268', 'mp-1103412', 'mp-1424462', 'mp-1705070', 'mp-1785432', 'mp-1599048']",2.4575e-05,"{'Y': 4.0, 'Si': 4.0, 'Ir': 4.0}",218.42787276699875,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.500341405826834e-07,2.4575e-05,0,9.83e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1102268.cif,False,,data/final/MP/graphs/Ir1Si1Y1-MP-mp-1102268.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
La1Os2,1,0.0,4.0,False,La4Os8,La4Os8,7.575,Other,True,La33.333Os66.667,La-Os,2,Supercon,La1Os2,MP-mp-1102043,La4Os8,La-Os,La33.333Os66.667,P 63/m m c,hexagonal,5.383518002703246,5.383517699999999,9.28895,data/final/MP/cifs/La1Os2-MP-mp-1102043.cif,data/source/MP/raw/cifs/mp-1102043.cif,mp-1102043,0.0,,2018-07-18 13:19:05,14.796281927223832,,,{'GGA': {'task_id': 'mp-1695155'}},0.0027869052777766,8.8961223,520.0,-110.34031649,-9.195026374166668,{'tags': ['Lanthanum osmium (1/2)']},-110.34031649,-9.195026374166668,-0.0647798358333335,['bandstructure'],True,"[641607, 641609]",True,2021-05-12 10:58:18.470000,NM,12,6,mp-1102043,,LaOs2,"{'functional': 'PBE', 'labels': ['La', 'Os_pv'], 'pot_type': 'paw'}","{'La': 1.0, 'Os': 2.0}",GGA,mp-1102043,"['mp-1102043', 'mp-1102479', 'mp-1420321', 'mp-1695155', 'mp-1881956', 'mp-1602090']",0.00150405,"{'La': 4.0, 'Os': 8.0}",233.14685595204355,[],NM,False,63,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, 0.0, 0.0, -0.0, 0.0, 0.0]",2.5804336822099307e-05,0.00150405,0,0.0060162,MP,data/source/MP/cleaned/cifs/MP-mp-1102043.cif,False,,data/final/MP/graphs/La1Os2-MP-mp-1102043.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ce0.14Cu1Sm1.86O4,2,0.0399999999999999,1.0,True,Ce0.14Cu1Sm1.86O4,Cu1Sm2O4,22.7,Cuprate,True,Ce2Cu14.286Sm26.571O57.142857142857146,Ce-Cu-Sm-O,4,Supercon,Sm1.86Ce0.14Cu1O4,MP-mp-4210,Sm2Cu1O4,Cu-Sm-O,Cu14.286Sm28.571O57.142857142857146,I 4/m m m,tetragonal,3.936481999770292,3.936481999770292,6.66682973,data/final/MP/cifs/Ce0.14Cu1Sm1.86O4-MP-mp-4210-synth_doped.cif,data/source/MP/raw/cifs/mp-4210.cif,mp-4210,0.0,,2011-05-13 10:20:22,7.575626216473968,10.17188/1207966,"@misc{osti_1207966,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sm2CuO4 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207966"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-670158'}},0.0084157301785579,3.24265454,520.0,-51.71666507,-7.38809501,"{'tags': ['Samarium cuprate', 'Disamarium copper oxide', 'Disamarium copper tetraoxide']}",-51.71666507,-7.38809501,-3.0194917299999995,"['xas', 'elasticity', 'bandstructure']",True,"[261378, 72243, 71182, 95371, 261377]",True,2021-05-12 10:56:20.740000,NM,7,8,mp-4210,oxide,Sm2CuO4,"{'functional': 'PBE', 'labels': ['Sm_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sm': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-4210,"['mp-660482', 'mp-670158', 'mp-4210', 'mp-1412888', 'mp-1702500', 'mp-1798108', 'mp-1589420', 'mp-688388']",0.0004776,"{'Sm': 2.0, 'Cu': 1.0, 'O': 4.0}",93.8732216032902,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",5.087712894507291e-06,0.0004776,0,0.0004776,MP,data/source/MP/cleaned/cifs/MP-mp-4210.cif,True,,data/final/MP/graphs/Ce0.14Cu1Sm1.86O4-MP-mp-4210-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
C1Ru1,1,0.0,2.0,False,C2Ru2,C2Ru2,2.02,Other,True,C50Ru50,C-Ru,2,Supercon,C1Ru1,MP-mp-999259,Ru2C2,C-Ru,C50Ru50,R -3 m,trigonal,2.7855112459342983,2.7855112459342983,6.4878295,data/final/MP/cifs/C1Ru1-MP-mp-999259.cif,data/source/MP/raw/cifs/mp-999259.cif,mp-999259,0.0,,2016-05-23 04:27:27,8.89196664776632,10.17188/1317518,"@misc{osti_1317518,
    author = ""Persson, Kristin"",
    title = ""Materials Data on RuC (SG:166) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1317518"",
    place = ""United States"",
    year = ""2016"",
    month = ""5"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1734956'}},0.3651841850000004,7.75143495,520.0,-35.54160397,-8.8854009925,{'tags': ['Ruthenium carbide (1/1)']},-35.54160397,-8.8854009925,0.3651841850000004,"['xas', 'elasticity', 'bandstructure']",True,[188285],True,2021-05-12 10:56:37.246000,NM,4,9,mp-999259,,RuC,"{'functional': 'PBE', 'labels': ['Ru_pv', 'C'], 'pot_type': 'paw'}","{'Ru': 1.0, 'C': 1.0}",GGA,mp-999259,"['mp-999259', 'mp-1065612', 'mp-1065653', 'mp-1065724', 'mp-1414118', 'mp-1734956', 'mp-1782449', 'mp-1629604', 'mp-1065678']",1.48e-05,"{'Ru': 2.0, 'C': 2.0}",42.234733319798046,[],NM,False,166,0,"[0, 0, 0, 0]",7.008449603758866e-07,1.48e-05,0,2.96e-05,MP,data/source/MP/cleaned/cifs/MP-mp-999259.cif,False,,data/final/MP/graphs/C1Ru1-MP-mp-999259.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
N0.93Nb1,2,0.0362694300518134,1.0,True,N0.93Nb1,N1Nb1,13.3,Other,True,N48.187Nb51.813,N-Nb,2,Supercon,N0.93Nb1,MP-mp-2634,Nb1N1,N-Nb,N50Nb50,P -6 m 2,hexagonal,2.898656,2.9761920047347994,2.97619211,data/final/MP/cifs/N0.93Nb1-MP-mp-2634-synth_doped.cif,data/source/MP/raw/cifs/mp-2634.cif,mp-2634,0.0,,2011-05-12 17:49:04,7.984187332554685,10.17188/1201157,"@misc{osti_1201157,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbN (SG:187) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201157"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671304'}},0.0,7.12357548,520.0,-20.57319827,-10.286599135,"{'tags': ['Niobium nitride (1/1)', 'Niobium nitride', 'Niobium nitride (1/1) - gamma']}",-20.57319827,-10.286599135,-1.2481991524999998,"['xas', 'elasticity', 'bandstructure']",True,"[185569, 644536, 76385, 191062]",True,2021-05-12 10:56:18.721000,NM,2,17,mp-2634,,NbN,"{'functional': 'PBE', 'labels': ['Nb_pv', 'N'], 'pot_type': 'paw'}","{'Nb': 1.0, 'N': 1.0}",GGA,mp-2634,"['mp-926732', 'mp-910421', 'mp-926222', 'mp-2634', 'mp-1058402', 'mp-1058440', 'mp-1058487', 'mp-1061535', 'mp-1061589', 'mp-1061648', 'mp-1116126', 'mp-1442283', 'mp-1671304', 'mp-1924826', 'mp-1594881', 'mp-1061618', 'mp-1058457']",0.0002504,"{'Nb': 1.0, 'N': 1.0}",22.23561881453577,[],NM,False,187,0,"[0, 0]",1.1261211216496917e-05,0.0002504,0,0.0002504,MP,data/source/MP/cleaned/cifs/MP-mp-2634.cif,True,,data/final/MP/graphs/N0.93Nb1-MP-mp-2634-synth_doped.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Ru3Si4Zr2,1,0.0,4.0,False,Ru12Si16Zr8,Ru12Si16Zr8,5.7,Other,True,Ru33.333Si44.444Zr22.222,Ru-Si-Zr,3,Supercon,Zr2Ru3Si4,MP-mp-510274,Zr8Si16Ru12,Ru-Si-Zr,Ru33.333Si44.444Zr22.222,C 1 2/c 1,monoclinic,5.390807997996872,9.91847089,10.999643262359672,data/final/MP/cifs/Ru3Si4Zr2-MP-mp-510274.cif,data/source/MP/raw/cifs/mp-510274.cif,mp-510274,0.0,,2014-02-25 19:42:56,7.296629248664746,10.17188/1262867,"@misc{osti_1262867,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Zr2Si4Ru3 (SG:15) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1262867"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1737295'}},0.0,8.49696702,520.0,-298.15396659,-8.282054627499999,{'tags': ['Zirconium ruthenium silicide (2/3/4)']},-298.15396659,-8.282054627499999,-0.8482961491666651,"['xas', 'bandstructure']",True,[60072],True,2021-05-12 10:57:08.928000,NM,36,9,mp-510274,,Zr2Si4Ru3,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Si', 'Ru_pv'], 'pot_type': 'paw'}","{'Zr': 2.0, 'Si': 4.0, 'Ru': 3.0}",GGA,mp-510274,"['mp-943289', 'mp-933024', 'mp-942237', 'mp-510274', 'mp-1125009', 'mp-1133276', 'mp-1444881', 'mp-1737295', 'mp-1926016']",3.225e-06,"{'Zr': 8.0, 'Si': 16.0, 'Ru': 12.0}",544.3622406927228,[],NM,False,15,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.369745554648359e-08,3.225e-06,0,1.29e-05,MP,data/source/MP/cleaned/cifs/MP-mp-510274.cif,False,,data/final/MP/graphs/Ru3Si4Zr2-MP-mp-510274.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
Gd1Re2,1,0.0,4.0,False,Gd4Re8,Gd4Re8,0.0,Other,True,Gd33.333Re66.667,Gd-Re,2,Supercon,Gd1Re2,MP-mp-1102209,Gd4Re8,Gd-Re,Gd33.333Re66.667,P 63/m m c,hexagonal,5.4545599959243765,5.45455954,8.873143,data/final/MP/cifs/Gd1Re2-MP-mp-1102209.cif,data/source/MP/raw/cifs/mp-1102209.cif,mp-1102209,0.0,,2018-07-18 13:49:06,15.387994914446944,,,{'GGA': {'task_id': 'mp-1702726'}},1.5471031408333342,5.05043203,520.0,-137.29546875,-11.4412890625,"{'tags': ['Gadolinium rhenium (1/2)', 'GdRe2', 'MgZn2', 'Friauf-Laves phase, Frank-Kasper phase']}",-137.29546875,-11.4412890625,1.5471031408333336,['bandstructure'],True,"[636244, 636248, 636247, 636246]",True,2021-05-12 10:58:20.361000,FM,12,5,mp-1102209,,GdRe2,"{'functional': 'PBE', 'labels': ['Gd', 'Re_pv'], 'pot_type': 'paw'}","{'Gd': 1.0, 'Re': 2.0}",GGA,mp-1102209,"['mp-1102209', 'mp-1103133', 'mp-1422985', 'mp-1702726', 'mp-1600549']",1.174120025,"{'Gd': 4.0, 'Re': 8.0}",228.62699632058803,[],FM,True,194,1,"[1.1, 1.1, 1.1, 1.1, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0205421064685399,1.174120025,4,4.6964801,MP,data/source/MP/cleaned/cifs/MP-mp-1102209.cif,False,,data/final/MP/graphs/Gd1Re2-MP-mp-1102209.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Os0.3Re0.7,3,0.1,8.0,False,Os2.4Re5.6,Os2Re6,1.54,Other,True,Os30Re70,Os-Re,2,Supercon,Os0.3Re0.7,MP-mp-867264,Re6Os2,Os-Re,Os25Re75,P 63/m m c,hexagonal,4.438103,5.564941999181245,5.56494101,data/final/MP/cifs/Os0.3Re0.7-MP-mp-867264-synth_doped.cif,data/source/MP/raw/cifs/mp-867264.cif,mp-867264,0.0,,2014-10-15 20:53:17,20.894179274689,10.17188/1311932,"@misc{osti_1311932,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Re3Os (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1311932"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1722178'}},0.0,7.53498815,520.0,-97.59450991,-12.19931373875,{'tags': []},-97.59450991,-12.19931373875,-0.0590767862499994,"['xas', 'bandstructure']",True,[],True,2021-05-12 10:57:53.781000,NM,8,8,mp-867264,,Re3Os,"{'functional': 'PBE', 'labels': ['Re_pv', 'Os_pv'], 'pot_type': 'paw'}","{'Re': 3.0, 'Os': 1.0}",GGA,mp-867264,"['mp-867264', 'mp-1055142', 'mp-1055120', 'mp-1401307', 'mp-1722178', 'mp-1803075', 'mp-1618512', 'mp-1055143']",5.15e-06,"{'Re': 6.0, 'Os': 2.0}",119.0280148566386,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",8.65342500452996e-08,5.15e-06,0,1.03e-05,MP,data/source/MP/cleaned/cifs/MP-mp-867264.cif,True,,data/final/MP/graphs/Os0.3Re0.7-MP-mp-867264-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ce1In3,1,0.0,1.0,True,Ce1In3,Ce1In3,0.13,Heavy_fermion,True,Ce25In75,Ce-In,2,Supercon,Ce1In3,MP-mp-20369,Ce1In3,Ce-In,Ce25In75,P m -3 m,cubic,4.70762,4.70762,4.70762,data/final/MP/cifs/Ce1In3-MP-mp-20369.cif,data/source/MP/raw/cifs/mp-20369.cif,mp-20369,0.0,,2014-02-21 08:42:17,7.712610919583898,10.17188/1195489,"@misc{osti_1195489,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeIn3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195489"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686666'}},0.0,7.91705052,520.0,-15.80240686,-3.950601715,"{'tags': ['Cerium indide (1/3)', 'Cerium triindide', 'Cerium indium (1/3)']}",-15.80240686,-3.950601715,-0.4035666287499997,"['xas', 'elasticity', 'bandstructure']",True,"[621358, 621368, 621350, 621361, 171678, 621357, 102185, 603839, 621362, 621359, 621363]",True,2021-05-12 10:56:14.760000,FM,4,9,mp-20369,,CeIn3,"{'functional': 'PBE', 'labels': ['Ce', 'In_d'], 'pot_type': 'paw'}","{'Ce': 1.0, 'In': 3.0}",GGA,mp-20369,"['mp-991417', 'mp-993369', 'mp-20369', 'mp-1442062', 'mp-1686666', 'mp-1931034', 'mp-994701', 'mp-1596348', 'mp-1587583']",0.6244861,"{'Ce': 1.0, 'In': 3.0}",104.32879655049076,[],FM,True,221,1,"[0.6, 0.0, 0.0, 0.0]",0.0059857500579696,0.6244861,1,0.6244861,MP,data/source/MP/cleaned/cifs/MP-mp-20369.cif,False,,data/final/MP/graphs/Ce1In3-MP-mp-20369.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
La0.2Os4Pr0.8Sb12,3,0.0235294117647058,1.0,True,La0.2Os4Pr0.8Sb12,Os4Pr1Sb12,1.7225,Heavy_fermion,True,La1.176Os23.529Pr4.706Sb70.588,La-Os-Pr-Sb,4,Supercon,Pr0.8La0.2Os4Sb12,MP-mp-4251,Pr1Sb12Os4,Os-Pr-Sb,Os23.529Pr5.882Sb70.588,I m -3,cubic,8.16020751180899,8.16020751,8.16020751,data/final/MP/cifs/La0.2Os4Pr0.8Sb12-MP-mp-4251-synth_doped.cif,data/source/MP/raw/cifs/mp-4251.cif,mp-4251,0.0,,2011-05-15 09:44:04,9.380402650313032,10.17188/1208003,"@misc{osti_1208003,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Pr(Sb3Os)4 (SG:204) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208003"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700242'}},0.0086126564705901,7.28147826,520.0,-102.089288,-6.005252235294117,{'tags': ['Praseodymium osmium antimonide (1/4/12)']},-102.089288,-6.005252235294117,-0.1677005267647063,"['xas', 'elasticity', 'bandstructure']",True,"[155178, 155187, 165911, 155182, 155185, 155181, 647731, 155183, 155188, 155180, 155179, 165910, 155184, 155186, 183087]",True,2021-05-12 10:56:20.740000,NM,17,9,mp-4251,,Pr(Sb3Os)4,"{'functional': 'PBE', 'labels': ['Pr_3', 'Sb', 'Os_pv'], 'pot_type': 'paw'}","{'Pr': 1.0, 'Sb': 12.0, 'Os': 4.0}",GGA,mp-4251,"['mp-1000443', 'mp-1006919', 'mp-4251', 'mp-1188290', 'mp-1430112', 'mp-1700242', 'mp-1817791', 'mp-1011635', 'mp-1609307']",0.0526026,"{'Pr': 1.0, 'Sb': 12.0, 'Os': 4.0}",418.2940787754696,[],NM,False,204,0,"[-0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.000125755067234,0.0526026,0,0.0526026,MP,data/source/MP/cleaned/cifs/MP-mp-4251.cif,True,,data/final/MP/graphs/La0.2Os4Pr0.8Sb12-MP-mp-4251-synth_doped.json,0,True,m-3,2,0,0,0,0,0,0,0,0,1,0,1.0,False
Au1Zn3,1,0.0,8.0,False,Au8Zn24,Au8Zn24,1.245,Other,True,Au25Zn75,Au-Zn,2,Supercon,Au1Zn3,MP-mp-30424,Zn24Au8,Au-Zn,Au25Zn75,P m -3 n,cubic,7.980166,7.980166,7.980166,data/final/MP/cifs/Au1Zn3-MP-mp-30424.cif,data/source/MP/raw/cifs/mp-30424.cif,mp-30424,0.0,,2014-02-15 07:04:59,10.278026049845352,10.17188/1204833,"@misc{osti_1204833,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Zn3Au (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1204833"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1752587'}},0.0,3.83132057,520.0,-61.96758224,-1.936486945,{'tags': ['Gold zinc (1/3)']},-61.96758224,-1.936486945,-0.1732088525000001,"['xas', 'bandstructure']",True,[58626],True,2021-05-12 10:57:04.957000,NM,32,8,mp-30424,,Zn3Au,"{'functional': 'PBE', 'labels': ['Zn', 'Au'], 'pot_type': 'paw'}","{'Zn': 3.0, 'Au': 1.0}",GGA,mp-30424,"['mp-934537', 'mp-941389', 'mp-941070', 'mp-30424', 'mp-1383312', 'mp-1752587', 'mp-1825781', 'mp-1623426']",0.000126925,"{'Zn': 24.0, 'Au': 8.0}",508.2013054988952,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.998027138090868e-06,0.000126925,0,0.0010154,MP,data/source/MP/cleaned/cifs/MP-mp-30424.cif,False,,data/final/MP/graphs/Au1Zn3-MP-mp-30424.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
La4Pb1Sb2,1,0.0,2.0,False,La8Pb2Sb4,La8Pb2Sb4,0.0,Other,True,La57.143Pb14.286Sb28.571,La-Pb-Sb,3,Supercon,La4Pb1Sb2,MP-mp-1223115,La8Sb4Pb2,La-Pb-Sb,La57.143Pb14.286Sb28.571,I -4 2 d,tetragonal,8.457248939720131,8.45724894,8.45724894,data/final/MP/cifs/La4Pb1Sb2-MP-mp-1223115.cif,data/source/MP/raw/cifs/mp-1223115.cif,mp-1223115,0.0,,2019-01-12 23:33:17.373000,7.177335573286128,,,{'GGA': {'task_id': 'mp-1684927'}},0.0074619361904781,7.88006749,520.0,-76.83478539,-5.488198956428571,{'tags': []},-76.83478539,-5.488198956428571,-1.0123878178571424,[],False,[],True,2021-05-12 11:00:52.054000,NM,14,4,mp-1223115,,La4Sb2Pb,"{'functional': 'PBE', 'labels': ['La', 'Sb', 'Pb_d'], 'pot_type': 'paw'}","{'La': 4.0, 'Sb': 2.0, 'Pb': 1.0}",GGA,mp-1223115,"['mp-1223115', 'mp-1331228', 'mp-1684927', 'mp-1823043']",0.02860235,"{'La': 8.0, 'Sb': 4.0, 'Pb': 2.0}",465.651909133348,[],NM,False,122,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0001228486319458,0.02860235,0,0.0572047,MP,data/source/MP/cleaned/cifs/MP-mp-1223115.cif,False,,data/final/MP/graphs/La4Pb1Sb2-MP-mp-1223115.json,0,True,-42m,0,0,0,0,6,0,0,0,0,1,0,1.0,False
Ce0.7Cu2Eu1.3Ru1Sr2O10,3,0.0352941176470588,1.0,True,Ce0.7Cu2Eu1.3Ru1Sr2O10,Ce1Cu2Eu1Ru1Sr2O10,33.0,Cuprate,True,Ce4.118Cu11.765Eu7.647Ru5.882Sr11.765O58.82352941176471,Ce-Cu-Eu-Ru-Sr-O,6,Supercon,Eu1.3Ce0.7Sr2Ru1Cu2O10,MP-mp-1218883,Sr2Ce1Eu1Cu2Ru1O10,Ce-Cu-Eu-Ru-Sr-O,Ce5.882Cu11.765Eu5.882Ru5.882Sr11.765O58.82352941176471,C 1 m 1,monoclinic,3.89765054,3.89765054,14.72856415,data/final/MP/cifs/Ce0.7Cu2Eu1.3Ru1Sr2O10-MP-mp-1218883-synth_doped.cif,data/source/MP/raw/cifs/mp-1218883.cif,mp-1218883,0.0,,2019-01-12 19:58:44.354000,6.461952007932866,,,,0.0307225061764704,4.2426979,520.0,-121.19651369,-7.129206687647059,{'tags': []},-121.19651369,-7.129206687647059,-2.441763594607844,[],False,[],True,2021-05-12 11:00:42.526000,FiM,17,2,mp-1218883,oxide,Sr2CeEuCu2RuO10,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ce', 'Eu', 'Cu_pv', 'Ru_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ce': 1.0, 'Eu': 1.0, 'Cu': 2.0, 'Ru': 1.0, 'O': 10.0}",GGA,mp-1218883,"['mp-1218883', 'mp-1331028']",3.9050614,"{'Sr': 2.0, 'Ce': 1.0, 'Eu': 1.0, 'Cu': 2.0, 'Ru': 1.0, 'O': 10.0}",219.83315827706463,[],FiM,True,8,5,"[-0.0, -0.0, 0.1, 6.3, -0.1, -0.1, -1.2, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0177637506125363,3.9050614,5,3.9050614,MP,data/source/MP/cleaned/cifs/MP-mp-1218883.cif,True,,data/final/MP/graphs/Ce0.7Cu2Eu1.3Ru1Sr2O10-MP-mp-1218883-synth_doped.json,0,True,m,0,0,5,0,0,0,0,0,1,0,0,1.0,False
Ba0.9Bi1K0.1O3,2,0.0399999999999999,4.0,False,Ba3.6Bi4K0.4O12,Ba4Bi4O12,0.0,Oxide,True,Ba18Bi20K2O60,Ba-Bi-K-O,4,Supercon,Ba0.9K0.1Bi1O3,MP-mp-559051,Ba4Bi4O12,Ba-Bi-O,Ba20Bi20O60,P 1 21/c 1,monoclinic,6.244045,6.28001,8.808393428799683,data/final/MP/cifs/Ba0.9Bi1K0.1O3-MP-mp-559051-synth_doped.cif,data/source/MP/raw/cifs/mp-559051.cif,mp-559051,0.0769000000000001,,2015-02-15 08:08:39,7.5826930836026865,10.17188/1270621,"@misc{osti_1270621,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BaBiO3 (SG:14) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1270621"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1709167'}},0.0,3.73830111,520.0,-119.03610928,-5.951805464,"{'tags': ['Barium bismuth(III) bismuth(V) oxide', 'Perovskite, double']}",-119.03610928,-5.951805464,-2.2334278330000004,"['xas', 'elasticity', 'bandstructure']",True,[172756],True,2021-05-12 10:56:22.739000,NM,20,8,mp-559051,oxide,BaBiO3,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Bi': 1.0, 'O': 3.0}",GGA,mp-559051,"['mp-944043', 'mp-933995', 'mp-944705', 'mp-559051', 'mp-1422516', 'mp-1709167', 'mp-1843835', 'mp-1607458']",9.0625e-05,"{'Ba': 4.0, 'Bi': 4.0, 'O': 12.0}",345.39699590112576,[],NM,False,14,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.0495169451438142e-06,9.0625e-05,0,0.0003625,MP,data/source/MP/cleaned/cifs/MP-mp-559051.cif,True,,data/final/MP/graphs/Ba0.9Bi1K0.1O3-MP-mp-559051-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,1,0,0,0,1.0,False
H0.963Pd1,2,0.0188487009679062,2.0,False,H1.926Pd2,H2Pd2,6.377,Other,True,H49.058Pd50.942,H-Pd,2,Supercon,H0.963Pd1,MP-mp-1184548,H2Pd2,H-Pd,H50Pd50,P 63 m c,hexagonal,2.968136003881316,2.96813585,5.040799,data/final/MP/cifs/H0.963Pd1-MP-mp-1184548-synth_doped.cif,data/source/MP/raw/cifs/mp-1184548.cif,mp-1184548,0.0,,2019-01-11 12:52:40.348000,9.276812227294194,,,{'GGA': {'task_id': 'mp-1734957'}},0.0,3.52113336,520.0,-17.47744839,-4.3693620975,{'tags': []},-17.47744839,-4.3693620975,-0.0830581699999992,['bandstructure'],True,[],True,2021-05-12 10:58:27.755000,NM,4,5,mp-1184548,,HPd,"{'functional': 'PBE', 'labels': ['H', 'Pd'], 'pot_type': 'paw'}","{'H': 1.0, 'Pd': 1.0}",GGA,mp-1184548,"['mp-1184548', 'mp-1426775', 'mp-1734957', 'mp-1792734', 'mp-1612181']",3.7e-05,"{'H': 2.0, 'Pd': 2.0}",38.45896345503417,[],NM,False,186,0,"[0, 0, 0, 0]",1.924128820749941e-06,3.7e-05,0,7.4e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1184548.cif,True,,data/final/MP/graphs/H0.963Pd1-MP-mp-1184548-synth_doped.json,0,True,6mm,0,5,0,0,0,0,0,1,0,0,0,1.0,False
Cu1La0.8Sr1.2Tl1O5,3,0.0444444444444444,1.0,True,Cu1La0.8Sr1.2Tl1O5,Cu1La1Sr1Tl1O5,27.0,Cuprate,True,Cu11.111La8.889Sr13.333Tl11.111O55.55555555555556,Cu-La-Sr-Tl-O,5,Supercon,Tl1Sr1.2La0.8Cu1O5,MP-mp-1218170,Sr1La1Tl1Cu1O5,Cu-La-Sr-Tl-O,Cu11.111La11.111Sr11.111Tl11.111O55.55555555555556,P 4 m m,tetragonal,3.808314,3.808314,8.940218,data/final/MP/cifs/Cu1La0.8Sr1.2Tl1O5-MP-mp-1218170-synth_doped.cif,data/source/MP/raw/cifs/mp-1218170.cif,mp-1218170,0.0,,2019-01-12 19:23:00.047000,7.356801903811997,,,{'GGA': {'task_id': 'mp-1751231'}},0.0235770105555133,5.93274247,520.0,-55.01092809,-6.1123253433333335,{'tags': []},-55.01092809,-6.1123253433333335,-2.2909747433333343,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,9,5,mp-1218170,oxide,SrLaTlCuO5,"{'functional': 'PBE', 'labels': ['Sr_sv', 'La', 'Tl_d', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 1.0, 'La': 1.0, 'Tl': 1.0, 'Cu': 1.0, 'O': 5.0}",GGA,mp-1218170,"['mp-1218170', 'mp-1444406', 'mp-1751231', 'mp-1787322', 'mp-1618863']",0.0033628,"{'Sr': 1.0, 'La': 1.0, 'Tl': 1.0, 'Cu': 1.0, 'O': 5.0}",129.66226608171218,[],NM,False,99,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",2.593507040730561e-05,0.0033628,0,0.0033628,MP,data/source/MP/cleaned/cifs/MP-mp-1218170.cif,True,,data/final/MP/graphs/Cu1La0.8Sr1.2Tl1O5-MP-mp-1218170-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
Ru2Y1,1,0.0,4.0,False,Ru8Y4,Ru8Y4,2.23,Other,True,Ru66.667Y33.333,Ru-Y,2,Supercon,Ru2Y1,MP-mp-568186,Y4Ru8,Ru-Y,Ru66.667Y33.333,P 63/m m c,hexagonal,5.276516003067581,5.27651609,8.969022,data/final/MP/cifs/Ru2Y1-MP-mp-568186.cif,data/source/MP/raw/cifs/mp-568186.cif,mp-568186,0.0,,2014-02-24 13:08:31,8.939232862246756,10.17188/1272553,"@misc{osti_1272553,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YRu2 (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1272553"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697189'}},0.0,5.96303687,520.0,-103.83404772,-8.65283731,"{'tags': ['Yttrium ruthenium (1/2)', 'Ruthenium yttrium (2/1)']}",-103.83404772,-8.65283731,-0.3144205022222219,"['xas', 'elasticity', 'bandstructure']",True,"[150516, 650775, 650778]",True,2021-05-12 10:56:22.739000,NM,12,10,mp-568186,,YRu2,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ru_pv'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ru': 2.0}",GGA,mp-568186,"['mp-1001392', 'mp-914500', 'mp-568186', 'mp-1102880', 'mp-1103240', 'mp-1432386', 'mp-1697189', 'mp-1829069', 'mp-1007832', 'mp-1599952']",0.006526575,"{'Y': 4.0, 'Ru': 8.0}",216.25703750839943,[],NM,False,194,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001207188459658,0.006526575,0,0.0261063,MP,data/source/MP/cleaned/cifs/MP-mp-568186.cif,False,,data/final/MP/graphs/Ru2Y1-MP-mp-568186.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Hf1Os2,1,0.0,4.0,False,Hf4Os8,Hf4Os8,2.27,Other,True,Hf33.333Os66.667,Hf-Os,2,Supercon,Hf1Os2,MP-mp-570960,Hf4Os8,Hf-Os,Hf33.333Os66.667,P 63/m m c,hexagonal,5.215806004820378,5.21580644,8.560314,data/final/MP/cifs/Hf1Os2-MP-mp-570960.cif,data/source/MP/raw/cifs/mp-570960.cif,mp-570960,0.0,,2014-02-16 04:48:47,18.408517502191824,10.17188/1276023,"@misc{osti_1276023,
    author = ""Persson, Kristin"",
    title = ""Materials Data on HfOs2 (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1276023"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695357'}},0.0648174999999948,7.09405952,520.0,-134.54029958,-11.211691631666667,{'tags': ['Hafnium osmium (1/2)']},-134.54029958,-11.211691631666667,-0.4077178450000005,"['bandstructure', 'elasticity']",True,"[290938, 150513, 638749]",True,2021-05-12 10:56:27.046000,NM,12,9,mp-570960,,HfOs2,"{'functional': 'PBE', 'labels': ['Hf_pv', 'Os_pv'], 'pot_type': 'paw'}","{'Hf': 1.0, 'Os': 2.0}",GGA,mp-570960,"['mp-570960', 'mp-914498', 'mp-977904', 'mp-1095518', 'mp-1102102', 'mp-1414645', 'mp-1695357', 'mp-1827895', 'mp-1597450']",0.000332775,"{'Hf': 4.0, 'Os': 8.0}",201.68018661265,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.600053393229603e-06,0.000332775,0,0.0013311,MP,data/source/MP/cleaned/cifs/MP-mp-570960.cif,False,,data/final/MP/graphs/Hf1Os2-MP-mp-570960.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Al1Nb2.73Ti0.27,3,0.135,2.0,False,Al2Nb5.46Ti0.54,Al2Nb6,11.5,Other,True,Al25Nb68.25Ti6.75,Al-Nb-Ti,3,Supercon,Nb2.73Ti0.27Al1,MP-mp-796,Nb6Al2,Al-Nb,Al25Nb75,P m -3 n,cubic,5.215254,5.215254,5.215254,data/final/MP/cifs/Al1Nb2.73Ti0.27-MP-mp-796-synth_doped.cif,data/source/MP/raw/cifs/mp-796.cif,mp-796,0.0,,2011-05-13 16:07:37,7.157298025966356,,,{'GGA': {'task_id': 'mp-1686893'}},0.0460773865000003,5.52947534,520.0,-69.48918494,-8.6861481175,"{'tags': ['Aluminium niobium (1/3)', 'Niobium aluminide (3/1)', 'Aluminum niobium (1/3)']}",-69.48918494,-8.6861481175,-0.1737753800000003,"['bandstructure', 'elasticity']",True,"[608675, 608654, 608688, 608668, 608669, 608685, 608676, 608683, 58014, 608657, 107856, 608655, 608666, 608691, 608656, 608665, 608673, 608653, 608661]",True,2021-05-12 10:56:31.128000,NM,8,10,mp-796,,Nb3Al,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Al': 1.0}",GGA,mp-796,"['mp-911586', 'mp-927906', 'mp-796', 'mp-927472', 'mp-1260512', 'mp-1440919', 'mp-1686893', 'mp-1927652', 'mp-1591599', 'mp-1587739']",0.16323955,"{'Nb': 6.0, 'Al': 2.0}",141.8490379078192,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0023015954483396,0.16323955,0,0.3264791,MP,data/source/MP/cleaned/cifs/MP-mp-796.cif,True,,data/final/MP/graphs/Al1Nb2.73Ti0.27-MP-mp-796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Lu3Rh1,3,0.1,2.0,False,Lu6Rh2,Lu8Rh2,0.0,Other,True,Lu75Rh25,Lu-Rh,2,Supercon,Lu3Rh1,MP-mp-1210757,Lu8Rh2,Lu-Rh,Lu80Rh20,F d -3 m,cubic,7.4699821,7.469982099999999,7.469982099999999,data/final/MP/cifs/Lu3Rh1-MP-mp-1210757-synth_doped.cif,data/source/MP/raw/cifs/mp-1210757.cif,mp-1210757,0.0,,2019-01-12 13:14:43.073000,9.04541370793192,,,{'GGA': {'task_id': 'mp-1739018'}},0.5019736036666673,2.69795155,520.0,-50.21194835,-5.021194835,"{'tags': ['MgCu2', 'LuRh2', 'Friauf-Laves phase, Frank-Kasper phase']}",-50.21194835,-5.021194835,0.0684271550000005,[],False,[],True,2021-05-12 11:00:26.500000,NM,10,4,mp-1210757,,Lu4Rh,"{'functional': 'PBE', 'labels': ['Lu_3', 'Rh_pv'], 'pot_type': 'paw'}","{'Lu': 4.0, 'Rh': 1.0}",GGA,mp-1210757,"['mp-1210757', 'mp-1405869', 'mp-1739018', 'mp-1807011']",0.03816995,"{'Lu': 8.0, 'Rh': 2.0}",294.7431265000683,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0002590048524846,0.03816995,0,0.0763399,MP,data/source/MP/cleaned/cifs/MP-mp-1210757.cif,True,,data/final/MP/graphs/Lu3Rh1-MP-mp-1210757-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Bi1F0.2La1S2O0.8,3,0.0799999999999999,2.0,False,Bi2F0.4La2S4O1.6,Bi2La2S4O2,7.11,Oxide,True,Bi20F4La20S40O16,Bi-F-La-S-O,5,Supercon,La1Bi1S2F0.2O0.8,MP-mp-1078397,La2Bi2S4O2,Bi-La-S-O,Bi20La20S40O20,P 4/n m m,tetragonal,4.055497,4.055497,14.173265,data/final/MP/cifs/Bi1F0.2La1S2O0.8-MP-mp-1078397-synth_doped.cif,data/source/MP/raw/cifs/mp-1078397.cif,mp-1078397,1.0743999999999998,,2018-04-11 10:57:38,6.097899749460756,,,{'GGA': {'task_id': 'mp-1676377'}},0.0053330699999989,4.69184382,520.0,-61.66700475,-6.166700475,{'tags': ['Lanthanum bismuth oxodisulphate']},-61.66700475,-6.166700475,-2.09592004425,['bandstructure'],True,[196231],True,2021-05-12 10:58:14.654000,NM,10,5,mp-1078397,oxide,LaBiS2O,"{'functional': 'PBE', 'labels': ['La', 'Bi', 'S', 'O'], 'pot_type': 'paw'}","{'La': 1.0, 'Bi': 1.0, 'S': 2.0, 'O': 1.0}",GGA,mp-1078397,"['mp-1078397', 'mp-1380859', 'mp-1676377', 'mp-1776923', 'mp-1600973']",6.57e-05,"{'La': 2.0, 'Bi': 2.0, 'S': 4.0, 'O': 2.0}",233.1084819815865,[],NM,False,129,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.636860524465146e-07,6.57e-05,0,0.0001314,MP,data/source/MP/cleaned/cifs/MP-mp-1078397.cif,True,,data/final/MP/graphs/Bi1F0.2La1S2O0.8-MP-mp-1078397-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B4Er1Ir2Rh2,1,0.0,2.0,False,B8Er2Ir4Rh4,B8Er2Ir4Rh4,7.065,Other,True,B44.444Er11.111Ir22.222Rh22.222,B-Er-Ir-Rh,4,Supercon,Er1Rh2Ir2B4,MP-mp-1225576,Er2B8Ir4Rh4,B-Er-Ir-Rh,B44.444Er11.111Ir22.222Rh22.222,P 42 m c,tetragonal,5.373674,5.373674,7.450693,data/final/MP/cifs/B4Er1Ir2Rh2-MP-mp-1225576.cif,data/source/MP/raw/cifs/mp-1225576.cif,mp-1225576,0.0,,2019-01-13 01:40:02.211000,12.360489069135896,,,,0.0218039285802538,7.54522839,520.0,-137.42633869,-7.634796593888889,{'tags': []},-137.42633869,-7.634796593888889,-0.5580452079629623,[],False,[],True,2021-05-12 11:00:54.298000,NM,18,3,mp-1225576,,ErB4(IrRh)2,"{'functional': 'PBE', 'labels': ['Er_3', 'B', 'Ir', 'Rh_pv'], 'pot_type': 'paw'}","{'Er': 1.0, 'B': 4.0, 'Ir': 2.0, 'Rh': 2.0}",GGA,mp-1225576,"['mp-1225576', 'mp-1376795', 'mp-1830573']",0.0007184,"{'Er': 2.0, 'B': 8.0, 'Ir': 4.0, 'Rh': 4.0}",215.1489846501312,[],NM,False,105,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.67816305215886e-06,0.0007184,0,0.0014368,MP,data/source/MP/cleaned/cifs/MP-mp-1225576.cif,False,,data/final/MP/graphs/B4Er1Ir2Rh2-MP-mp-1225576.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
C2Na1,1,0.0,4.0,False,C8Na4,C8Na4,5.0,Carbon,True,C66.667Na33.333,C-Na,2,Supercon,C2Na1,MP-mp-1102647,Na4C8,C-Na,C66.667Na33.333,P 43 3 2,cubic,4.622103,4.622103,4.622103,data/final/MP/cifs/C2Na1-MP-mp-1102647.cif,data/source/MP/raw/cifs/mp-1102647.cif,mp-1102647,0.0,,2018-07-18 14:53:47,3.162214200014108,,,,1.1394859278160876,6.35120717,520.0,-65.43051564,-5.45254297,{'tags': ['Sodium carbon (1/2)']},-65.43051564,-5.45254297,1.139485927816093,[],False,[186177],True,2021-05-12 10:59:31.014000,NM,12,2,mp-1102647,,NaC2,"{'functional': 'PBE', 'labels': ['Na_pv', 'C'], 'pot_type': 'paw'}","{'Na': 1.0, 'C': 2.0}",GGA,mp-1102647,"['mp-1102647', 'mp-1870649']",5.09e-05,"{'Na': 4.0, 'C': 8.0}",98.74585112626148,[],NM,False,212,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.061858778650524e-06,5.09e-05,0,0.0002036,MP,data/source/MP/cleaned/cifs/MP-mp-1102647.cif,False,,data/final/MP/graphs/C2Na1-MP-mp-1102647.json,0,True,432,4,0,0,0,0,0,0,1,0,0,0,1.0,False
Gd0.08La0.92Ru2,3,0.0533333333333333,2.0,False,Gd0.16La1.84Ru4,La2Ru4,0.0,Other,True,Gd2.667La30.667Ru66.667,Gd-La-Ru,3,Supercon,La0.92Gd0.08Ru2,MP-mp-2019,La2Ru4,La-Ru,La33.333Ru66.667,F d -3 m,cubic,5.46409128,5.464091279999999,5.464091279999999,data/final/MP/cifs/Gd0.08La0.92Ru2-MP-mp-2019-synth_doped.cif,data/source/MP/raw/cifs/mp-2019.cif,mp-2019,0.0,,2011-05-13 21:42:56,9.818667150990734,10.17188/1195329,"@misc{osti_1195329,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaRu2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195329"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686817'}},0.0017745359523804,8.6251779,520.0,-47.76122776,-7.960204626666666,"{'tags': ['Lanthanum ruthenium hydride (1/2/4)', 'Lanthanum ruthenium (1/2)']}",-47.76122776,-7.960204626666666,-0.1319424883333321,"['xas', 'elasticity', 'bandstructure']",True,"[104712, 641760, 641778, 638256, 641771, 641766, 641774, 638255, 641762, 104713, 641761, 641775, 641777]",True,2021-05-12 10:56:14.760000,NM,6,14,mp-2019,,LaRu2,"{'functional': 'PBE', 'labels': ['La', 'Ru_pv'], 'pot_type': 'paw'}","{'La': 1.0, 'Ru': 2.0}",GGA,mp-2019,"['mp-935098', 'mp-941760', 'mp-941909', 'mp-2019', 'mp-1072861', 'mp-1072969', 'mp-1072939', 'mp-1077306', 'mp-1442150', 'mp-1686817', 'mp-1803378', 'mp-1590466', 'mp-1596026', 'mp-1072974']",0.000191,"{'La': 2.0, 'Ru': 4.0}",115.35564200581236,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",3.311498192526659e-06,0.000191,0,0.000382,MP,data/source/MP/cleaned/cifs/MP-mp-2019.cif,True,,data/final/MP/graphs/Gd0.08La0.92Ru2-MP-mp-2019-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ce0.12Cu1La1.88O4,2,0.0342857142857143,1.0,True,Ce0.12Cu1La1.88O4,Cu1La2O4,24.3,Cuprate,True,Ce1.714Cu14.286La26.857O57.142857142857146,Ce-Cu-La-O,4,Supercon,La1.88Ce0.12Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ce0.12Cu1La1.88O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ce0.12Cu1La1.88O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Cu1Er2O4,1,0.0,2.0,False,Cu2Er4O8,Cu2Er4O8,0.0,Cuprate,True,Cu14.286Er28.571O57.142857142857146,Cu-Er-O,3,Supercon,Er2Cu1O4,MP-mp-753901,Er4Cu2O8,Cu-Er-O,Cu14.286Er28.571O57.142857142857146,C m c a,orthorhombic,5.467002,5.470782001681266,6.48362809,data/final/MP/cifs/Cu1Er2O4-MP-mp-753901.cif,data/source/MP/raw/cifs/mp-753901.cif,mp-753901,0.0,,2014-05-05 16:02:47,8.728195086722497,10.17188/1289176,"@misc{osti_1289176,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Er2CuO4 (SG:64) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1289176"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1738758'}},0.0330383578571389,3.33325406,520.0,-104.43656035,-7.459754310714286,{'tags': []},-104.43656035,-7.459754310714286,-3.134255980714286,['bandstructure'],True,[],True,2021-05-12 10:58:57.544000,NM,14,7,mp-753901,oxide,Er2CuO4,"{'functional': 'PBE', 'labels': ['Er_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Er': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-753901,"['mp-753901', 'mp-852314', 'mp-854777', 'mp-1388917', 'mp-1738758', 'mp-1786168', 'mp-855591']",0.00075245,"{'Er': 4.0, 'Cu': 2.0, 'O': 8.0}",175.81443364914944,[],NM,False,12,0,"[0.0, 0.0, 0.0, 0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",8.559593025241249e-06,0.00075245,0,0.0015049,MP,data/source/MP/cleaned/cifs/MP-mp-753901.cif,False,,data/final/MP/graphs/Cu1Er2O4-MP-mp-753901.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
In0.25Tl0.75,1,0.0,4.0,False,In1Tl3,In1Tl3,3.64,Other,True,In25Tl75,In-Tl,2,Supercon,In0.25Tl0.75,MP-mp-1216558,Tl3In1,In-Tl,In25Tl75,C m m m,orthorhombic,3.44988303,3.44988303,10.754694,data/final/MP/cifs/In0.25Tl0.75-MP-mp-1216558.cif,data/source/MP/raw/cifs/mp-1216558.cif,mp-1216558,0.0,,2019-01-12 18:02:48.894000,9.907247771117246,,,{'GGA': {'task_id': 'mp-1758790'}},0.0109591624999998,5.95976121,520.0,-9.79577652,-2.44894413,{'tags': []},-9.79577652,-2.44894413,0.0109591624999998,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,4,5,mp-1216558,,Tl3In,"{'functional': 'PBE', 'labels': ['Tl_d', 'In_d'], 'pot_type': 'paw'}","{'Tl': 3.0, 'In': 1.0}",GGA,mp-1216558,"['mp-1216558', 'mp-1410132', 'mp-1758790', 'mp-1804190', 'mp-1625757']",0.0077125,"{'Tl': 3.0, 'In': 1.0}",122.01361721313272,[],NM,False,65,0,"[0, 0, 0, 0]",6.321015781810522e-05,0.0077125,0,0.0077125,MP,data/source/MP/cleaned/cifs/MP-mp-1216558.cif,False,,data/final/MP/graphs/In0.25Tl0.75-MP-mp-1216558.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Cr0.95Cu1Fe0.05O2,2,0.025,1.0,True,Cr0.95Cu1Fe0.05O2,Cr1Cu1O2,117.5,Cuprate,True,Cr23.75Cu25Fe1.25O50,Cr-Cu-Fe-O,4,Supercon,Cu1Cr0.95Fe0.05O2,MP-mp-510625,Cr2Cu2O4,Cr-Cu-O,Cr25Cu25O50,R -3 m,trigonal,3.0581244400000003,3.0581244400000003,5.978846852858602,data/final/MP/cifs/Cr0.95Cu1Fe0.05O2-MP-mp-510625-synth_doped.cif,data/source/MP/raw/cifs/mp-510625.cif,mp-510625,1.6568999999999998,,2013-05-24 06:28:56,5.295622232369865,10.17188/1263037,"@misc{osti_1263037,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CrCuO2 (SG:166) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1263037"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-1668463'}},0.0,3.93382979,520.0,-54.8289095,-6.8536136875,"{'tags': ['Copper(I) chromium(III) oxide', 'Copper chromate(II)', 'Mcconnellite', 'Delafossite', 'Copper(I) chromium oxide', 'High pressure experimental phase', 'Copper chromate(III)', 'Copper phyllo-chromate(III)']}",-54.8289095,-6.8536136875,-1.7848196500000002,"['diel', 'xas', 'elasticity', 'bandstructure']",True,"[194152, 194151, 163255, 157800, 163254, 163253, 189047, 402290, 26676, 184467]",True,2021-05-12 10:56:20.740000,AFM,8,76,mp-510625,oxide,CrCuO2,"{'functional': 'PBE', 'labels': ['Cr_pv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Cr': 1.0, 'Cu': 1.0, 'O': 2.0}",GGA+U,mp-510625,"['mp-795616', 'mp-797327', 'mp-797897', 'mp-773929', 'mp-797253', 'mp-797810', 'mp-796545', 'mp-818910', 'mp-603355', 'mp-510625', 'mp-1063675', 'mp-1063694', 'mp-1063667', 'mp-1063806', 'mp-1063784', 'mp-1063789', 'mp-1065894', 'mp-1065949', 'mp-1065921', 'mp-1066767', 'mp-1066725', 'mp-1066738', 'mp-1141280', 'mp-774030', 'mp-773391', 'mp-826047', 'mp-826790', 'mp-826786', 'mp-827727', 'mp-654963', 'mp-795614', 'mp-1273190', 'mp-1273411', 'mp-1273225', 'mp-1273677', 'mp-1273699', 'mp-1288167', 'mp-1274828', 'mp-1298222', 'mp-1294903', 'mp-1280458', 'mp-1279356', 'mp-1278287', 'mp-1278301', 'mp-1298390', 'mp-1292886', 'mp-1281782', 'mp-1276336', 'mp-1294276', 'mp-1295444', 'mp-1279881', 'mp-1278777', 'mp-1298808', 'mp-1296621', 'mp-1296628', 'mp-1281142', 'mp-1280053', 'mp-1298984', 'mp-1276750', 'mp-1291252', 'mp-1279028', 'mp-1442290', 'mp-1658860', 'mp-1668463', 'mp-1798257', 'mp-827547', 'mp-849126', 'mp-827819', 'mp-819586', 'mp-849147', 'mp-1593873', 'mp-1588350', 'mp-1063797', 'mp-1063685', 'mp-1066750', 'mp-1065935']",0.0,"{'Cr': 2.0, 'Cu': 2.0, 'O': 4.0}",92.52828756317238,[],AFM,True,166,1,"[-3.0, 3.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0,0.0,2,0.0,MP,data/source/MP/cleaned/cifs/MP-mp-510625.cif,True,,data/final/MP/graphs/Cr0.95Cu1Fe0.05O2-MP-mp-510625-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ag3Sb1,1,0.0,2.0,False,Ag6Sb2,Ag6Sb2,0.0,Other,True,Ag75Sb25,Ag-Sb,2,Supercon,Ag3Sb1,MP-mp-16240,Ag6Sb2,Ag-Sb,Ag75Sb25,P m m n,orthorhombic,4.948358,5.318272,6.084502,data/final/MP/cifs/Ag3Sb1-MP-mp-16240.cif,data/source/MP/raw/cifs/mp-16240.cif,mp-16240,0.0,,2011-05-29 08:20:32,9.23715202956206,10.17188/1191691,"@misc{osti_1191691,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ag3Sb (SG:59) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191691"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695457'}},0.0,5.26904194,520.0,-25.05895406,-3.1323692575,{'tags': ['Silver antimonide']},-25.05895406,-3.1323692575,-0.0237019450000004,"['xas', 'bandstructure']",True,[52600],True,2021-05-12 10:56:53.126000,NM,8,6,mp-16240,,Ag3Sb,"{'functional': 'PBE', 'labels': ['Ag', 'Sb'], 'pot_type': 'paw'}","{'Ag': 3.0, 'Sb': 1.0}",GGA,mp-16240,"['mp-16240', 'mp-996499', 'mp-1434575', 'mp-1695457', 'mp-1927873', 'mp-1591722']",0.0003407,"{'Ag': 6.0, 'Sb': 2.0}",160.12409773356185,[],NM,False,59,0,"[0, 0, 0, 0, 0, 0, 0, 0]",4.255449427317392e-06,0.0003407,0,0.0006814,MP,data/source/MP/cleaned/cifs/MP-mp-16240.cif,False,,data/final/MP/graphs/Ag3Sb1-MP-mp-16240.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Au2Nb3,1,0.0,1.0,True,Au2Nb3,Au2Nb3,0.0,Other,True,Au40Nb60,Au-Nb,2,Supercon,Au2Nb3,MP-mp-2123,Nb3Au2,Au-Nb,Au40Nb60,I 4/m m m,tetragonal,3.4272879984193465,3.427287998419346,8.08258623,data/final/MP/cifs/Au2Nb3-MP-mp-2123.cif,data/source/MP/raw/cifs/mp-2123.cif,mp-2123,0.0,,2011-05-13 06:01:10,12.332301802068637,10.17188/1196502,"@misc{osti_1196502,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Au2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196502"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702993'}},0.0,5.36709843,520.0,-37.58911848,-7.517823696000001,"{'tags': ['Gold niobium (2/3)', 'Niobium gold (3/2)']}",-37.58911848,-7.517823696000001,-0.1474880560000002,"['xas', 'elasticity', 'bandstructure']",True,"[54403, 58559]",True,2021-05-12 10:56:16.728000,NM,5,8,mp-2123,,Nb3Au2,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Au'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Au': 2.0}",GGA,mp-2123,"['mp-990241', 'mp-990214', 'mp-2123', 'mp-1475986', 'mp-1702993', 'mp-1926015', 'mp-990254', 'mp-1593369']",0.0364395,"{'Nb': 3.0, 'Au': 2.0}",90.57233627457305,[],NM,False,139,0,"[0, 0, 0, 0, 0]",0.0004023248322703,0.0364395,0,0.0364395,MP,data/source/MP/cleaned/cifs/MP-mp-2123.cif,False,,data/final/MP/graphs/Au2Nb3-MP-mp-2123.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Al0.8Be0.2Nb3,3,0.0999999999999999,2.0,False,Al1.6Be0.4Nb6,Al2Nb6,17.0,Other,True,Al20Be5Nb75,Al-Be-Nb,3,Supercon,Nb3Al0.8Be0.2,MP-mp-796,Nb6Al2,Al-Nb,Al25Nb75,P m -3 n,cubic,5.215254,5.215254,5.215254,data/final/MP/cifs/Al0.8Be0.2Nb3-MP-mp-796-synth_doped.cif,data/source/MP/raw/cifs/mp-796.cif,mp-796,0.0,,2011-05-13 16:07:37,7.157298025966356,,,{'GGA': {'task_id': 'mp-1686893'}},0.0460773865000003,5.52947534,520.0,-69.48918494,-8.6861481175,"{'tags': ['Aluminium niobium (1/3)', 'Niobium aluminide (3/1)', 'Aluminum niobium (1/3)']}",-69.48918494,-8.6861481175,-0.1737753800000003,"['bandstructure', 'elasticity']",True,"[608675, 608654, 608688, 608668, 608669, 608685, 608676, 608683, 58014, 608657, 107856, 608655, 608666, 608691, 608656, 608665, 608673, 608653, 608661]",True,2021-05-12 10:56:31.128000,NM,8,10,mp-796,,Nb3Al,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Al': 1.0}",GGA,mp-796,"['mp-911586', 'mp-927906', 'mp-796', 'mp-927472', 'mp-1260512', 'mp-1440919', 'mp-1686893', 'mp-1927652', 'mp-1591599', 'mp-1587739']",0.16323955,"{'Nb': 6.0, 'Al': 2.0}",141.8490379078192,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0023015954483396,0.16323955,0,0.3264791,MP,data/source/MP/cleaned/cifs/MP-mp-796.cif,True,,data/final/MP/graphs/Al0.8Be0.2Nb3-MP-mp-796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Bi1Na1,1,0.0,1.0,True,Bi1Na1,Bi1Na1,2.25,Other,True,Bi50Na50,Bi-Na,2,Supercon,Bi1Na1,MP-mp-22924,Na1Bi1,Bi-Na,Bi50Na50,P 4/m m m,tetragonal,3.430193,3.430193,4.939507,data/final/MP/cifs/Bi1Na1-MP-mp-22924.cif,data/source/MP/raw/cifs/mp-22924.cif,mp-22924,0.0,,2014-02-21 05:56:44,6.627664548383457,10.17188/1199089,"@misc{osti_1199089,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NaBi (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199089"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672776'}},0.0,3.83220869,520.0,-5.7970444,-2.8985222,{'tags': ['Bismuth sodium (1/1)']},-5.7970444,-2.8985222,-0.2922423982758619,"['xas', 'elasticity', 'bandstructure']",True,"[58816, 616837]",True,2021-05-12 10:56:16.728000,NM,2,8,mp-22924,,NaBi,"{'functional': 'PBE', 'labels': ['Na_pv', 'Bi'], 'pot_type': 'paw'}","{'Na': 1.0, 'Bi': 1.0}",GGA,mp-22924,"['mp-912128', 'mp-928724', 'mp-928218', 'mp-22924', 'mp-1476031', 'mp-1672776', 'mp-1790921', 'mp-1591735']",2.05e-05,"{'Na': 1.0, 'Bi': 1.0}",58.11934589676955,[],NM,False,123,0,"[0, 0]",3.527224830852656e-07,2.05e-05,0,2.05e-05,MP,data/source/MP/cleaned/cifs/MP-mp-22924.cif,False,,data/final/MP/graphs/Bi1Na1-MP-mp-22924.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Gd0.067La0.933Sn3,2,0.0334999999999999,1.0,True,Gd0.067La0.933Sn3,La1Sn3,4.64,Other,True,Gd1.675La23.325Sn75,Gd-La-Sn,3,Supercon,La0.933Gd0.067Sn3,MP-mp-633,La1Sn3,La-Sn,La25Sn75,P m -3 m,cubic,4.820061,4.820061,4.820061,data/final/MP/cifs/Gd0.067La0.933Sn3-MP-mp-633-synth_doped.cif,data/source/MP/raw/cifs/mp-633.cif,mp-633,0.0,,2011-05-13 04:30:54,7.340536659909055,10.17188/1279358,"@misc{osti_1279358,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaSn3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1279358"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688008'}},0.0,8.68748013,520.0,-19.26482408,-4.81620602,"{'tags': ['Lanthanum stannide (1/3)', 'Lanthanum tin (1/3)']}",-19.26482408,-4.81620602,-0.5750253525,"['xas', 'bandstructure']",True,"[641991, 104721, 641986, 261870, 104720, 151359, 642000, 641998, 191074]",True,2021-05-12 10:57:30.779000,NM,4,12,mp-633,,LaSn3,"{'functional': 'PBE', 'labels': ['La', 'Sn_d'], 'pot_type': 'paw'}","{'La': 1.0, 'Sn': 3.0}",GGA,mp-633,"['mp-991111', 'mp-993073', 'mp-633', 'mp-1066557', 'mp-1066573', 'mp-1066594', 'mp-1442023', 'mp-1688008', 'mp-1787436', 'mp-994393', 'mp-1590336', 'mp-1066601']",0.0055557,"{'La': 1.0, 'Sn': 3.0}",111.98441958300587,[],NM,False,221,0,"[0, 0, 0, 0]",4.961136576577034e-05,0.0055557,0,0.0055557,MP,data/source/MP/cleaned/cifs/MP-mp-633.cif,True,,data/final/MP/graphs/Gd0.067La0.933Sn3-MP-mp-633-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Al0.9B0.1Nb3,2,0.0499999999999999,2.0,False,Al1.8B0.2Nb6,Al2Nb6,19.8,Other,True,Al22.5B2.5Nb75,Al-B-Nb,3,Supercon,Nb3Al0.9B0.1,MP-mp-796,Nb6Al2,Al-Nb,Al25Nb75,P m -3 n,cubic,5.215254,5.215254,5.215254,data/final/MP/cifs/Al0.9B0.1Nb3-MP-mp-796-synth_doped.cif,data/source/MP/raw/cifs/mp-796.cif,mp-796,0.0,,2011-05-13 16:07:37,7.157298025966356,,,{'GGA': {'task_id': 'mp-1686893'}},0.0460773865000003,5.52947534,520.0,-69.48918494,-8.6861481175,"{'tags': ['Aluminium niobium (1/3)', 'Niobium aluminide (3/1)', 'Aluminum niobium (1/3)']}",-69.48918494,-8.6861481175,-0.1737753800000003,"['bandstructure', 'elasticity']",True,"[608675, 608654, 608688, 608668, 608669, 608685, 608676, 608683, 58014, 608657, 107856, 608655, 608666, 608691, 608656, 608665, 608673, 608653, 608661]",True,2021-05-12 10:56:31.128000,NM,8,10,mp-796,,Nb3Al,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Al': 1.0}",GGA,mp-796,"['mp-911586', 'mp-927906', 'mp-796', 'mp-927472', 'mp-1260512', 'mp-1440919', 'mp-1686893', 'mp-1927652', 'mp-1591599', 'mp-1587739']",0.16323955,"{'Nb': 6.0, 'Al': 2.0}",141.8490379078192,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0023015954483396,0.16323955,0,0.3264791,MP,data/source/MP/cleaned/cifs/MP-mp-796.cif,True,,data/final/MP/graphs/Al0.9B0.1Nb3-MP-mp-796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ga0.32Nb0.68,3,0.1399999999999999,8.0,False,Ga2.56Nb5.44,Ga2Nb6,20.2,Other,True,Ga32Nb68,Ga-Nb,2,Supercon,Ga0.32Nb0.68,MP-mp-2670,Nb6Ga2,Ga-Nb,Ga25Nb75,P m -3 n,cubic,5.189021,5.189021,5.189021,data/final/MP/cifs/Ga0.32Nb0.68-MP-mp-2670-synth_doped.cif,data/source/MP/raw/cifs/mp-2670.cif,mp-2670,0.0,,2011-05-14 07:55:50,8.28234811962253,10.17188/1201220,"@misc{osti_1201220,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Ga (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201220"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686575'}},0.0550303606249986,4.96610647,520.0,-68.03986833,-8.50498354125,"{'tags': ['Gallium niobium (1/3)', 'Niobium gallide (3/1)']}",-68.03986833,-8.50498354125,-0.1719807556250003,"['xas', 'elasticity', 'bandstructure']",True,"[634772, 634745, 634746, 634774, 634731, 634748, 634762, 634767, 108484, 634734, 634761, 103831]",True,2021-05-12 10:56:18.721000,NM,8,9,mp-2670,,Nb3Ga,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Ga_d'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Ga': 1.0}",GGA,mp-2670,"['mp-928915', 'mp-912435', 'mp-929292', 'mp-2670', 'mp-1078851', 'mp-1440107', 'mp-1686575', 'mp-1781117', 'mp-1594502']",0.0001134,"{'Nb': 6.0, 'Ga': 2.0}",139.71926259628808,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.6232550600794926e-06,0.0001134,0,0.0002268,MP,data/source/MP/cleaned/cifs/MP-mp-2670.cif,True,,data/final/MP/graphs/Ga0.32Nb0.68-MP-mp-2670-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Nb0.5V0.5,1,0.0,2.0,False,Nb1V1,Nb1V1,4.25,Other,True,Nb50V50,Nb-V,2,Supercon,Nb0.5V0.5,MP-mp-1220334,Nb1V1,Nb-V,Nb50V50,C m m m,orthorhombic,2.85089901,2.85089901,4.22517656,data/final/MP/cifs/Nb0.5V0.5-MP-mp-1220334.cif,data/source/MP/raw/cifs/mp-1220334.cif,mp-1220334,0.0,,2019-01-12 21:11:52.806000,7.448907973695285,,,,0.0908060949999978,5.25695983,520.0,-19.00359892,-9.50179946,{'tags': []},-19.00359892,-9.50179946,0.0908060949999978,[],False,[],True,2021-05-12 11:00:44.908000,NM,2,2,mp-1220334,,NbV,"{'functional': 'PBE', 'labels': ['Nb_pv', 'V_pv'], 'pot_type': 'paw'}","{'Nb': 1.0, 'V': 1.0}",GGA,mp-1220334,"['mp-1220334', 'mp-1938795']",0.0108905,"{'Nb': 1.0, 'V': 1.0}",32.067119802138144,[],NM,False,65,0,"[0.0, 0.0]",0.000339615782995,0.0108905,0,0.0108905,MP,data/source/MP/cleaned/cifs/MP-mp-1220334.cif,False,,data/final/MP/graphs/Nb0.5V0.5-MP-mp-1220334.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Pd1Se1Te1,1,0.0,1.0,True,Pd1Se1Te1,Pd1Se1Te1,0.6,Other,True,Pd33.333Se33.333Te33.333,Pd-Se-Te,3,Supercon,Pd1Se1Te1,MP-mp-1217263,Te1Pd1Se1,Pd-Se-Te,Pd33.333Se33.333Te33.333,P 3 m 1,trigonal,3.9701940005811673,3.97019412,5.10918,data/final/MP/cifs/Pd1Se1Te1-MP-mp-1217263.cif,data/source/MP/raw/cifs/mp-1217263.cif,mp-1217263,0.0,,2019-01-12 18:37:47.752000,7.451785988786256,,,{'GGA': {'task_id': 'mp-1767469'}},0.0,5.46762548,520.0,-12.74413547,-4.248045156666667,{'tags': []},-12.74413547,-4.248045156666667,-0.6063470841145833,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,3,5,mp-1217263,,TePdSe,"{'functional': 'PBE', 'labels': ['Te', 'Pd', 'Se'], 'pot_type': 'paw'}","{'Te': 1.0, 'Pd': 1.0, 'Se': 1.0}",GGA,mp-1217263,"['mp-1217263', 'mp-1429975', 'mp-1767469', 'mp-1800560', 'mp-1612370']",0.0005589,"{'Te': 1.0, 'Pd': 1.0, 'Se': 1.0}",69.74375241674365,[],NM,False,156,0,"[0, 0, 0]",8.01362101454442e-06,0.0005589,0,0.0005589,MP,data/source/MP/cleaned/cifs/MP-mp-1217263.cif,False,,data/final/MP/graphs/Pd1Se1Te1-MP-mp-1217263.json,0,True,3m,0,0,0,0,0,0,5,1,0,0,0,1.0,False
Cu1La0.1Sr0.9O2,2,0.0499999999999999,2.0,False,Cu2La0.2Sr1.8O4,Cu2Sr2O4,41.45,Cuprate,True,Cu25La2.5Sr22.5O50,Cu-La-Sr-O,4,Supercon,Sr0.9La0.1Cu1O2,MP-mp-5787,Sr2Cu2O4,Cu-Sr-O,Cu25Sr25O50,C m c m,orthorhombic,3.644437999912225,3.974263,8.32909336,data/final/MP/cifs/Cu1La0.1Sr0.9O2-MP-mp-5787-synth_doped.cif,data/source/MP/raw/cifs/mp-5787.cif,mp-5787,0.0,,2011-05-13 22:43:08,5.167573150857569,10.17188/1276630,"@misc{osti_1276630,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SrCuO2 (SG:63) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1276630"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703560'}},0.0,3.45760864,520.0,-45.24374469,-5.65546808625,"{'tags': ['Strontium cuprate', 'Strontium copper oxide']}",-45.24374469,-5.65546808625,-2.0778125529166664,"['xas', 'elasticity', 'bandstructure']",True,"[77291, 93653, 202992, 16217, 83051, 77293]",True,2021-05-12 10:56:27.046000,NM,8,8,mp-5787,oxide,SrCuO2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Cu': 1.0, 'O': 2.0}",GGA,mp-5787,"['mp-924142', 'mp-909103', 'mp-5787', 'mp-924940', 'mp-1475985', 'mp-1703560', 'mp-1802910', 'mp-1593696']",4e-07,"{'Sr': 2.0, 'Cu': 2.0, 'O': 4.0}",117.71572347282628,[],NM,False,63,0,"[0, 0, 0, 0, 0, 0, 0, 0]",6.796033498317439e-09,4e-07,0,8e-07,MP,data/source/MP/cleaned/cifs/MP-mp-5787.cif,True,,data/final/MP/graphs/Cu1La0.1Sr0.9O2-MP-mp-5787-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ce0.7La0.3Ru2,3,0.1333333333333333,2.0,False,Ce1.4La0.6Ru4,Ce1La1Ru4,2.134,Heavy_fermion,True,Ce23.333La10Ru66.667,Ce-La-Ru,3,Supercon,La0.3Ce0.7Ru2,MP-mp-1222913,La1Ce1Ru4,Ce-La-Ru,Ce16.667La16.667Ru66.667,F -4 3 m,cubic,5.407204540000001,5.40720454,5.40720454,data/final/MP/cifs/Ce0.7La0.3Ru2-MP-mp-1222913-synth_doped.cif,data/source/MP/raw/cifs/mp-1222913.cif,mp-1222913,0.0,,2019-01-12 23:22:50.626000,10.149813335401207,,,{'GGA': {'task_id': 'mp-1717130'}},0.0,8.64426336,520.0,-49.23252279,-8.205420465,{'tags': []},-49.23252279,-8.205420465,-0.2109779849999995,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,6,5,mp-1222913,,LaCeRu4,"{'functional': 'PBE', 'labels': ['La', 'Ce', 'Ru_pv'], 'pot_type': 'paw'}","{'La': 1.0, 'Ce': 1.0, 'Ru': 4.0}",GGA,mp-1222913,"['mp-1222913', 'mp-1394759', 'mp-1717130', 'mp-1804881', 'mp-1626317']",0.0208777,"{'La': 1.0, 'Ce': 1.0, 'Ru': 4.0}",111.79011354255184,[],NM,False,216,0,"[0.0, -0.0, 0.0, 0.0, 0.0, 0.0]",0.0001867580176672,0.0208777,0,0.0208777,MP,data/source/MP/cleaned/cifs/MP-mp-1222913.cif,True,,data/final/MP/graphs/Ce0.7La0.3Ru2-MP-mp-1222913-synth_doped.json,0,True,-43m,5,0,0,0,0,0,0,0,0,0,1,1.0,False
Nd1Si2,1,0.0,2.0,False,Nd2Si4,Nd2Si4,0.0,Other,True,Nd33.333Si66.667,Nd-Si,2,Supercon,Nd1Si2,MP-mp-884,Nd2Si4,Nd-Si,Nd33.333Si66.667,I 41/a m d,tetragonal,4.180281999329408,4.180281999329408,7.69749341,data/final/MP/cifs/Nd1Si2-MP-mp-884.cif,data/source/MP/raw/cifs/mp-884.cif,mp-884,0.0,,2011-05-12 22:19:17,5.359050262123705,10.17188/1312760,"@misc{osti_1312760,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NdSi2 (SG:141) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1312760"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686504'}},0.0,6.74619472,520.0,-34.85558736,-5.80926456,"{'tags': ['Neodymium silicon (1/2)', 'Neodymium silicide (1/2)']}",-34.85558736,-5.80926456,-0.5556741433333338,"['xas', 'bandstructure']",True,"[645985, 645987, 645949, 645972, 25666]",True,2021-05-12 10:57:55.580000,NM,6,28,mp-884,,NdSi2,"{'functional': 'PBE', 'labels': ['Nd_3', 'Si'], 'pot_type': 'paw'}","{'Nd': 1.0, 'Si': 2.0}",GGA,mp-884,"['mp-884', 'mp-943871', 'mp-944529', 'mp-933740', 'mp-1071688', 'mp-1071674', 'mp-1071707', 'mp-1072055', 'mp-1072079', 'mp-1072101', 'mp-1072840', 'mp-1072862', 'mp-1072914', 'mp-1072929', 'mp-1072942', 'mp-1072821', 'mp-1077199', 'mp-1077522', 'mp-1125175', 'mp-1138268', 'mp-1440164', 'mp-1686504', 'mp-1803344', 'mp-1595201', 'mp-1071712', 'mp-1072943', 'mp-1072859', 'mp-1072106']",0.0001411,"{'Nd': 2.0, 'Si': 4.0}",124.19872913176413,[],NM,False,141,0,"[0, 0, 0, 0, 0, 0]",2.272164956701048e-06,0.0001411,0,0.0002822,MP,data/source/MP/cleaned/cifs/MP-mp-884.cif,False,,data/final/MP/graphs/Nd1Si2-MP-mp-884.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ba0.075Sr0.925Ti1O3,2,0.0299999999999999,1.0,True,Ba0.075Sr0.925Ti1O3,Sr1Ti1O3,0.5,Oxide,True,Ba1.5Sr18.5Ti20O60,Ba-Sr-Ti-O,4,Supercon,Sr0.925Ba0.075Ti1O3,MP-mp-551830,Sr2Ti2O6,Sr-Ti-O,Sr20Ti20O60,P m -3 m,cubic,3.942851452350787,3.942851452692745,3.9464989993092807,data/final/MP/cifs/Ba0.075Sr0.925Ti1O3-MP-mp-551830-synth_doped.cif,data/source/MP/raw/cifs/mp-551830.cif,mp-551830,1.7869999999999997,,2014-02-21 05:23:00,4.966121139868444,,,{'GGA': {'task_id': 'mp-1759822'}},0.0005822479999988,3.22413565,520.0,-80.25240668,-8.025240668,{'tags': []},-80.25240668,-8.025240668,-3.551666971000001,"['bandstructure', 'elasticity']",True,[],True,2021-05-12 10:56:22.739000,NM,10,4,mp-551830,oxide,SrTiO3,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ti_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Ti': 1.0, 'O': 3.0}",GGA,mp-551830,"['mp-551830', 'mp-1406736', 'mp-1759822', 'mp-1627898']",0.00106425,"{'Sr': 2.0, 'Ti': 2.0, 'O': 6.0}",122.70515928291898,[],NM,False,221,0,"[0, 0, 0, 0, 0]",1.7346458881100164e-05,0.00106425,0,0.0021285,MP,data/source/MP/cleaned/cifs/MP-mp-551830.cif,True,,data/final/MP/graphs/Ba0.075Sr0.925Ti1O3-MP-mp-551830-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
B12Zr1,1,0.0,1.0,True,B12Zr1,B12Zr1,6.0335714285,Other,True,B92.308Zr7.692,B-Zr,2,Supercon,Zr1B12,MP-mp-1084,Zr1B12,B-Zr,B92.308Zr7.692,F m -3 m,cubic,5.23882121,5.23882121,5.23882121,data/final/MP/cifs/B12Zr1-MP-mp-1084.cif,data/source/MP/raw/cifs/mp-1084.cif,mp-1084,0.0,,2011-05-13 01:55:40,3.608852766615364,10.17188/1187388,"@misc{osti_1187388,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrB12 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187388"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701270'}},0.0158721137179496,6.88737846,520.0,-91.45613101,-7.03508700076923,{'tags': ['Zirconium boride (1/12)']},-91.45613101,-7.03508700076923,-0.2119791638461532,"['xas', 'elasticity', 'bandstructure']",True,"[615764, 615752, 35363, 23861, 409634, 76257, 409635]",True,2021-05-12 10:56:10.715000,NM,13,8,mp-1084,,ZrB12,"{'functional': 'PBE', 'labels': ['Zr_sv', 'B'], 'pot_type': 'paw'}","{'Zr': 1.0, 'B': 12.0}",GGA,mp-1084,"['mp-922210', 'mp-1084', 'mp-907581', 'mp-921959', 'mp-1427051', 'mp-1701270', 'mp-1798000', 'mp-1593176']",1.76e-05,"{'Zr': 1.0, 'B': 12.0}",101.66833997602512,[],NM,False,225,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.7311190488750325e-07,1.76e-05,0,1.76e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1084.cif,False,,data/final/MP/graphs/B12Zr1-MP-mp-1084.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Bi1Ce1S2O1,1,0.0,2.0,False,Bi2Ce2S4O2,Bi2Ce2S4O2,1.533333333,OxideHeavy_fermion,False,Bi20Ce20S40O20,Bi-Ce-S-O,4,Supercon,Ce1Bi1S2O1,MP-mp-610469,Ce2Bi2S4O2,Bi-Ce-S-O,Bi20Ce20S40O20,P 4/n m m,tetragonal,4.015541,4.015541,13.614615,data/final/MP/cifs/Bi1Ce1S2O1-MP-mp-610469.cif,data/source/MP/raw/cifs/mp-610469.cif,mp-610469,0.0,,2014-05-08 06:44:31,6.493388956885671,10.17188/1277674,"@misc{osti_1277674,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeBiS2O (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277674"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696129'}},0.0324931817500022,6.5998878,520.0,-63.11450623,-6.311450623000001,{'tags': ['Bismuth cerium oxide disulfide']},-63.11450623,-6.311450623000001,-2.04125378225,"['xas', 'bandstructure']",True,[80],True,2021-05-12 10:57:28.836000,FM,10,8,mp-610469,oxide,CeBiS2O,"{'functional': 'PBE', 'labels': ['Ce', 'Bi', 'S', 'O'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Bi': 1.0, 'S': 2.0, 'O': 1.0}",GGA,mp-610469,"['mp-909953', 'mp-925481', 'mp-925925', 'mp-610469', 'mp-1424098', 'mp-1696129', 'mp-1830050', 'mp-1599903']",0.8634528,"{'Ce': 2.0, 'Bi': 2.0, 'S': 4.0, 'O': 2.0}",219.5298060920356,[],FM,True,129,1,"[0.7, 0.7, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0078663832977468,0.8634528,2,1.7269056,MP,data/source/MP/cleaned/cifs/MP-mp-610469.cif,False,,data/final/MP/graphs/Bi1Ce1S2O1-MP-mp-610469.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Al0.95Ba1Si1.05,2,0.0333333333333333,1.0,True,Al0.95Ba1Si1.05,Al1Ba1Si1,2.8,Other,True,Al31.667Ba33.333Si35,Al-Ba-Si,3,Supercon,Ba1Al0.95Si1.05,MP-mp-13149,Ba1Al1Si1,Al-Ba-Si,Al33.333Ba33.333Si33.333,P -6 m 2,hexagonal,4.321636000482016,4.32163638,5.189042,data/final/MP/cifs/Al0.95Ba1Si1.05-MP-mp-13149-synth_doped.cif,data/source/MP/raw/cifs/mp-13149.cif,mp-13149,0.0,,2011-05-27 18:23:22,3.806505581790664,10.17188/1189416,"@misc{osti_1189416,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BaAlSi (SG:187) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189416"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1764250'}},0.0,4.21068016,520.0,-12.253411,-4.084470333333333,{'tags': ['Barium aluminium silicide (1/1/1) - (SrPtSb)-type']},-12.253411,-4.084470333333333,-0.3641834399999997,"['xas', 'elasticity', 'bandstructure']",True,[162866],True,2021-05-12 10:56:12.755000,NM,3,12,mp-13149,,BaAlSi,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Al', 'Si'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Al': 1.0, 'Si': 1.0}",GGA,mp-13149,"['mp-1006947', 'mp-1000475', 'mp-13149', 'mp-1156365', 'mp-1115778', 'mp-1248464', 'mp-1256285', 'mp-1386818', 'mp-1764250', 'mp-1782405', 'mp-1011669', 'mp-1610069']",0.0004086,"{'Ba': 1.0, 'Al': 1.0, 'Si': 1.0}",83.92942303947942,[],NM,False,187,0,"[0, 0, 0]",4.868376133216112e-06,0.0004086,0,0.0004086,MP,data/source/MP/cleaned/cifs/MP-mp-13149.cif,True,,data/final/MP/graphs/Al0.95Ba1Si1.05-MP-mp-13149-synth_doped.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
C1Ta0.4Ti0.6,3,0.0999999999999999,2.0,False,C2Ta0.8Ti1.2,C2Ta1Ti1,4.8,Other,True,C50Ta20Ti30,C-Ta-Ti,3,Supercon,C1Ta0.4Ti0.6,MP-mp-1217904,Ta1Ti1C2,C-Ta-Ti,C50Ta25Ti25,R -3 m,trigonal,3.126421682028229,3.126421682028229,5.39168273,data/final/MP/cifs/C1Ta0.4Ti0.6-MP-mp-1217904-synth_doped.cif,data/source/MP/raw/cifs/mp-1217904.cif,mp-1217904,0.0,,2019-01-12 19:09:46.806000,9.762281015855958,,,{'GGA': {'task_id': 'mp-1767811'}},0.0,7.87372828,520.0,-41.20926064,-10.30231516,{'tags': []},-41.20926064,-10.30231516,-0.750607398333333,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,4,5,mp-1217904,,TaTiC2,"{'functional': 'PBE', 'labels': ['Ta_pv', 'Ti_pv', 'C'], 'pot_type': 'paw'}","{'Ta': 1.0, 'Ti': 1.0, 'C': 2.0}",GGA,mp-1217904,"['mp-1217904', 'mp-1388145', 'mp-1767811', 'mp-1791155', 'mp-1610546']",0.0002074,"{'Ta': 1.0, 'Ti': 1.0, 'C': 2.0}",43.00680544965896,[],NM,False,166,0,"[0, 0, 0, 0]",4.822492576035886e-06,0.0002074,0,0.0002074,MP,data/source/MP/cleaned/cifs/MP-mp-1217904.cif,True,,data/final/MP/graphs/C1Ta0.4Ti0.6-MP-mp-1217904-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Hg1Zr3,1,0.0,2.0,False,Hg2Zr6,Hg2Zr6,0.0,Other,True,Hg25Zr75,Hg-Zr,2,Supercon,Hg1Zr3,MP-mp-1630,Zr6Hg2,Hg-Zr,Hg25Zr75,P m -3 n,cubic,5.609898,5.609898,5.609898,data/final/MP/cifs/Hg1Zr3-MP-mp-1630.cif,data/source/MP/raw/cifs/mp-1630.cif,mp-1630,0.0,,2011-05-14 11:26:21,8.921390035965816,10.17188/1191763,"@misc{osti_1191763,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Zr3Hg (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191763"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702311'}},0.0,4.18082809,520.0,-53.33924863,-6.66740607875,{'tags': ['Mercury zirconium (1/3)']},-53.33924863,-6.66740607875,-0.1807105150000003,"['xas', 'elasticity', 'bandstructure']",True,"[104375, 639315]",True,2021-05-12 10:56:12.755000,NM,8,8,mp-1630,,Zr3Hg,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Hg'], 'pot_type': 'paw'}","{'Zr': 3.0, 'Hg': 1.0}",GGA,mp-1630,"['mp-912603', 'mp-929387', 'mp-929018', 'mp-1630', 'mp-1430888', 'mp-1702311', 'mp-1789907', 'mp-1588521']",2.415e-05,"{'Zr': 6.0, 'Hg': 2.0}",176.54885071249828,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",2.735786713143454e-07,2.415e-05,0,4.83e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1630.cif,False,,data/final/MP/graphs/Hg1Zr3-MP-mp-1630.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
P4Re3,1,0.0,1.0,True,P4Re3,P4Re3,0.0,Other,True,P57.143Re42.857,P-Re,2,Supercon,P4Re3,MP-mp-1474,Re3P4,P-Re,P57.143Re42.857,C 1 2/m 1,monoclinic,3.0316720002541366,6.08339871,6.32196504,data/final/MP/cifs/P4Re3-MP-mp-1474.cif,data/source/MP/raw/cifs/mp-1474.cif,mp-1474,0.0,,2011-05-13 13:55:57,10.951742365204982,10.17188/1190875,"@misc{osti_1190875,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Re3P4 (SG:12) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1190875"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702027'}},0.0,8.42546266,520.0,-61.65632983,-8.808047118571428,{'tags': ['Rhenium(IV) phosphide']},-61.65632983,-8.808047118571428,-0.3813626069047617,"['xas', 'elasticity', 'bandstructure']",True,"[43210, 86894, 48124]",True,2021-05-12 10:56:12.755000,NM,7,8,mp-1474,,Re3P4,"{'functional': 'PBE', 'labels': ['Re_pv', 'P'], 'pot_type': 'paw'}","{'Re': 3.0, 'P': 4.0}",GGA,mp-1474,"['mp-990559', 'mp-992637', 'mp-1474', 'mp-1419445', 'mp-1702027', 'mp-1797556', 'mp-994094', 'mp-1594394']",0.0014488,"{'Re': 3.0, 'P': 4.0}",103.48531982328348,[],NM,False,12,0,"[0, 0, 0, 0, 0, 0, 0]",1.4000053364806145e-05,0.0014488,0,0.0014488,MP,data/source/MP/cleaned/cifs/MP-mp-1474.cif,False,,data/final/MP/graphs/P4Re3-MP-mp-1474.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
Bi2Ca1Cu2Sr2O8.16,2,0.0098504837291117,1.960956862745098,False,Bi3.922Ca1.961Cu3.922Sr3.922O16,Bi4Ca2Cu4Sr4O16,89.125,Cuprate,True,Bi13.193Ca6.596Cu13.193Sr13.193O53.82585751978892,Bi-Ca-Cu-Sr-O,5,Supercon,Bi2Sr2Ca1Cu2O8.16,MP-mp-1218930,Sr4Ca2Cu4Bi4O16,Bi-Ca-Cu-Sr-O,Bi13.333Ca6.667Cu13.333Sr13.333O53.333333333333336,C c c 2,orthorhombic,5.417115,5.472898000129128,16.11398919,data/final/MP/cifs/Bi2Ca1Cu2Sr2O8.16-MP-mp-1218930-synth_doped.cif,data/source/MP/raw/cifs/mp-1218930.cif,mp-1218930,0.0,,2019-01-12 20:01:06.544000,6.266668983881059,,,,0.039252223722225,4.51768334,520.0,-173.15021002,-5.771673667333333,{'tags': []},-173.15021002,-5.771673667333333,-2.074956548222222,[],False,[],True,2021-05-12 11:00:42.526000,NM,30,3,mp-1218930,oxide,Sr2CaCu2(BiO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",GGA,mp-1218930,"['mp-1218930', 'mp-1359698', 'mp-1817714']",0.00011165,"{'Sr': 4.0, 'Ca': 2.0, 'Cu': 4.0, 'Bi': 4.0, 'O': 16.0}",470.7976286073367,[],NM,False,37,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.743014544498498e-07,0.00011165,0,0.0002233,MP,data/source/MP/cleaned/cifs/MP-mp-1218930.cif,True,,data/final/MP/graphs/Bi2Ca1Cu2Sr2O8.16-MP-mp-1218930-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
As1Ga1,1,0.0,1.0,True,As1Ga1,As1Ga1,5.7,Other,True,As50Ga50,As-Ga,2,Supercon,As1Ga1,MP-mp-2534,Ga1As1,As-Ga,As50Ga50,F -4 3 m,cubic,4.06599269,4.06599269,4.06599269,data/final/MP/cifs/As1Ga1-MP-mp-2534.cif,data/source/MP/raw/cifs/mp-2534.cif,mp-2534,0.1839000000000004,,2011-05-12 18:22:06,5.053200624084066,10.17188/1200591,"@misc{osti_1200591,
    author = ""Persson, Kristin"",
    title = ""Materials Data on GaAs (SG:216) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1200591"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688464'}},0.0,2.67543991,520.0,-8.3922497,-4.19612485,"{'tags': ['Gallium arsenide - ZnS-type', 'Gallium arsenic', 'Gallium arsenide']}",-8.3922497,-4.19612485,-0.35251763625,"['piezo', 'eos', 'xas', 'bandstructure', 'diel', 'phonons', 'elasticity']",True,"[41981, 610533, 186761, 610537, 656314, 107946, 610547, 610545, 41674, 43359, 290606, 610539, 657341, 610540, 610546, 67786, 610543, 610538, 610541, 43424, 184923, 190411, 610535, 185082, 610536, 167764, 53964, 610534, 600516]",True,2021-05-12 10:56:16.728000,NM,2,31,mp-2534,,GaAs,"{'functional': 'PBE', 'labels': ['Ga_d', 'As'], 'pot_type': 'paw'}","{'Ga': 1.0, 'As': 1.0}",GGA,mp-2534,"['mp-655269', 'mp-655272', 'mp-655278', 'mp-2534', 'mp-1057638', 'mp-1057647', 'mp-1057666', 'mp-1059116', 'mp-1059129', 'mp-1059148', 'mp-1060073', 'mp-1060117', 'mp-1060086', 'mp-1060159', 'mp-1060144', 'mp-1060184', 'mp-1060428', 'mp-1060412', 'mp-1060456', 'mp-1141827', 'mp-1114993', 'mp-1300272', 'mp-1688464', 'mp-1792421', 'mp-1595846', 'mp-1593394', 'mp-1057667', 'mp-1059156', 'mp-1060185', 'mp-1060459', 'mp-1060118']",0.0013146,"{'Ga': 1.0, 'As': 1.0}",47.531856924098754,[],NM,False,216,0,"[0, 0]",2.765724053447394e-05,0.0013146,0,0.0013146,MP,data/source/MP/cleaned/cifs/MP-mp-2534.cif,False,,data/final/MP/graphs/As1Ga1-MP-mp-2534.json,0,True,-43m,5,0,0,0,0,0,0,0,0,0,1,1.0,False
B3Re7,1,0.0,2.0,False,B6Re14,B6Re14,3.19,Other,True,B30Re70,B-Re,2,Supercon,B3Re7,MP-mp-1106180,Re14B6,B-Re,B30Re70,P 63 m c,hexagonal,4.931986,7.554988001342127,7.554987540000001,data/final/MP/cifs/B3Re7-MP-mp-1106180.cif,data/source/MP/raw/cifs/mp-1106180.cif,mp-1106180,0.0,,2018-07-19 08:59:34,18.1981483931614,,,{'GGA': {'task_id': 'mp-1705769'}},0.0082994042999953,8.23746646,520.0,-218.74034563,-10.9370172815,"{'tags': ['Th7Fe3', 'Re7B3', 'Rhenium boride (7/3)']}",-218.74034563,-10.9370172815,-0.2220307207499999,['bandstructure'],True,"[615236, 615242, 191914]",True,2021-05-12 10:58:22.271000,NM,20,7,mp-1106180,,Re7B3,"{'functional': 'PBE', 'labels': ['Re_pv', 'B'], 'pot_type': 'paw'}","{'Re': 7.0, 'B': 3.0}",GGA,mp-1106180,"['mp-1106180', 'mp-1189019', 'mp-1189816', 'mp-1504360', 'mp-1705769', 'mp-1935569', 'mp-1603235']",9.84e-05,"{'Re': 14.0, 'B': 6.0}",243.7923025401135,[],NM,False,186,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",8.07244519000425e-07,9.84e-05,0,0.0001968,MP,data/source/MP/cleaned/cifs/MP-mp-1106180.cif,False,,data/final/MP/graphs/B3Re7-MP-mp-1106180.json,0,True,6mm,0,5,0,0,0,0,0,1,0,0,0,1.0,False
B2Mg1Ni3,1,0.0,3.0,False,B6Mg3Ni9,B6Mg3Ni9,0.0,Other,True,B33.333Mg16.667Ni50,B-Mg-Ni,3,Supercon,Mg1Ni3B2,MP-mp-571428,Mg3Ni9B6,B-Mg-Ni,B33.333Mg16.667Ni50,P 64 2 2,hexagonal,4.880172002549708,4.8801712,8.746693,data/final/MP/cifs/B2Mg1Ni3-MP-mp-571428.cif,data/source/MP/raw/cifs/mp-571428.cif,mp-571428,0.0,,2014-02-24 19:00:54,6.130455354703337,10.17188/1276253,"@misc{osti_1276253,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MgNi3B2 (SG:181) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1276253"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668297'}},0.0,7.61975277,520.0,-103.79162573,-5.766201429444445,{'tags': ['Magnesium nickel boride (1/3/2)']},-103.79162573,-5.766201429444445,-0.382955824166667,"['xas', 'elasticity', 'bandstructure']",True,[156018],True,2021-05-12 10:56:27.046000,NM,18,7,mp-571428,,MgNi3B2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Ni_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Ni': 3.0, 'B': 2.0}",GGA,mp-571428,"['mp-917885', 'mp-1001515', 'mp-571428', 'mp-1430294', 'mp-1668297', 'mp-1832746', 'mp-1008036']",0.0001315666666666,"{'Mg': 3.0, 'Ni': 9.0, 'B': 6.0}",180.40338311100177,[],NM,False,3,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, 0.0, 0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",2.1878747127327542e-06,0.0001315666666666,0,0.0003947,MP,data/source/MP/cleaned/cifs/MP-mp-571428.cif,False,,data/final/MP/graphs/B2Mg1Ni3-MP-mp-571428.json,0,True,622,0,4,0,0,0,0,0,1,0,0,0,1.0,False
Nd0.95Ni1Th0.05O3,2,0.02,4.0,False,Nd3.8Ni4Th0.2O12,Nd4Ni4O12,0.0,Oxide,True,Nd19Ni20Th1O60,Nd-Ni-Th-O,4,Supercon,Nd0.95Th0.05Ni1O3,MP-mp-22106,Nd4Ni4O12,Nd-Ni-O,Nd20Ni20O60,P n m a,orthorhombic,5.431762,5.495849,7.709429,data/final/MP/cifs/Nd0.95Ni1Th0.05O3-MP-mp-22106-synth_doped.cif,data/source/MP/raw/cifs/mp-22106.cif,mp-22106,0.0,,2014-02-19 13:18:08,7.242194237367626,,,{'GGA+U': {'task_id': 'mp-1701351'}},0.0,3.99854667,520.0,-131.66600273,-6.5833001365,"{'tags': ['Neodymium nickel(III) oxide', 'Dineodymium niccolate', 'Neodymium niccolate', 'Neodymium nickel oxide', 'Neodymium niccolate(III)']}",-131.66600273,-6.5833001365,-2.425267555500001,"['xas', 'bandstructure']",True,"[155746, 67725, 164825, 67724, 416213, 78319, 164562, 155747, 67723, 69788, 155748, 67722, 24875, 416212]",True,2021-05-12 10:57:01.079000,FM,20,11,mp-22106,oxide,NdNiO3,"{'functional': 'PBE', 'labels': ['Nd_3', 'Ni_pv', 'O'], 'pot_type': 'paw'}","{'Nd': 1.0, 'Ni': 1.0, 'O': 3.0}",GGA+U,mp-22106,"['mp-919926', 'mp-918860', 'mp-905914', 'mp-602303', 'mp-25591', 'mp-1189695', 'mp-22106', 'mp-1416651', 'mp-1701351', 'mp-1930748', 'mp-1599871']",1.00005245,"{'Nd': 4.0, 'Ni': 4.0, 'O': 12.0}",230.14298278419733,[],FM,True,62,1,"[0.0, 0.0, 0.0, 0.0, 1.4, 1.4, 1.4, 1.4, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0173814111193255,1.00005245,4,4.0002098,MP,data/source/MP/cleaned/cifs/MP-mp-22106.cif,True,,data/final/MP/graphs/Nd0.95Ni1Th0.05O3-MP-mp-22106-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
C2Pt0.1Rh0.9U2,2,0.0399999999999999,1.0,True,C2Pt0.1Rh0.9U2,C2Rh1U2,0.0,Heavy_fermion,True,C40Pt2Rh18U40,C-Pt-Rh-U,4,Supercon,U2Pt0.1Rh0.9C2,MP-mp-1069790,U2Rh1C2,C-Rh-U,C40Rh20U40,I 4/m m m,tetragonal,3.45519800165464,3.45519800165464,6.75012866,data/final/MP/cifs/C2Pt0.1Rh0.9U2-MP-mp-1069790-synth_doped.cif,data/source/MP/raw/cifs/mp-1069790.cif,mp-1069790,0.0,,2018-03-22 01:49:35,13.328741052294186,,,{'GGA': {'task_id': 'mp-1678120'}},0.0,10.53389718,520.0,-49.92071488,-9.984142976,"{'tags': ['Uranium rhodium carbide (2/1/2)', 'Rhodium uranium carbide (1/2/2)', 'Na2HgO2', 'U2RhC2']}",-49.92071488,-9.984142976,-0.3040051179999992,['bandstructure'],True,"[604010, 618732, 618730]",True,2021-05-12 10:58:14.654000,FM,5,16,mp-1069790,,U2RhC2,"{'functional': 'PBE', 'labels': ['U', 'Rh_pv', 'C'], 'pot_type': 'paw'}","{'U': 2.0, 'Rh': 1.0, 'C': 2.0}",GGA,mp-1069790,"['mp-1069790', 'mp-1069821', 'mp-1069857', 'mp-1069831', 'mp-1069934', 'mp-1069969', 'mp-1070617', 'mp-1070658', 'mp-1070795', 'mp-1438538', 'mp-1678120', 'mp-1799718', 'mp-1590168', 'mp-1070757', 'mp-1069902', 'mp-1069923']",2.1803942,"{'U': 2.0, 'Rh': 1.0, 'C': 2.0}",75.1218498577192,[],FM,True,139,1,"[1.1, 1.1, 0.0, 0.0, 0.0]",0.0290247671500324,2.1803942,2,2.1803942,MP,data/source/MP/cleaned/cifs/MP-mp-1069790.cif,True,,data/final/MP/graphs/C2Pt0.1Rh0.9U2-MP-mp-1069790-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As1Co0.15Fe0.85Sm1O1,3,0.075,2.0,False,As2Co0.3Fe1.7Sm2O2,As2Fe2Sm2O2,10.875,Ferrite,True,As25Co3.75Fe21.25Sm25O25,As-Co-Fe-Sm-O,5,Supercon,Sm1Fe0.85Co0.15As1O1,MP-mp-20349,Sm2Fe2As2O2,As-Fe-Sm-O,As25Fe25Sm25O25,P 4/n m m,tetragonal,4.026492,4.026492,9.046755,data/final/MP/cifs/As1Co0.15Fe0.85Sm1O1-MP-mp-20349-synth_doped.cif,data/source/MP/raw/cifs/mp-20349.cif,mp-20349,0.0,,2014-02-19 11:24:42,6.727802583283198,,,{'GGA+U': {'task_id': 'mp-1695938'}},0.3015723809374986,3.77685593,520.0,-52.73407138,-6.5917589225,{'tags': ['Samarium iron arsenic oxide (1/1/1/1)']},-52.73407138,-6.5917589225,-1.6285904237499995,"['xas', 'elasticity', 'bandstructure']",True,"[236652, 236653, 422002, 163457, 163458]",True,2021-05-12 10:56:16.728000,FM,8,10,mp-20349,oxide,SmFeAsO,"{'functional': 'PBE', 'labels': ['Sm_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Sm': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-20349,"['mp-24944', 'mp-1078897', 'mp-1079866', 'mp-1173321', 'mp-20349', 'mp-1425472', 'mp-1695938', 'mp-1772503', 'mp-1789694', 'mp-1588381']",3.75729895,"{'Sm': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",146.67176231613362,[],FM,True,129,1,"[0.0, 0.0, 3.5, 3.5, -0.0, -0.0, -0.0, -0.0]",0.0512341147425717,3.75729895,2,7.5145979,MP,data/source/MP/cleaned/cifs/MP-mp-20349.cif,True,,data/final/MP/graphs/As1Co0.15Fe0.85Sm1O1-MP-mp-20349-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B1.792C0.208Mg1,3,0.1386666666666666,1.0,True,B1.792C0.208Mg1,B2Mg1,25.5,Other,True,B59.733C6.933Mg33.333,B-C-Mg,3,Supercon,Mg1B1.792C0.208,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B1.792C0.208Mg1-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B1.792C0.208Mg1-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Si3Y1,1,0.0,4.0,False,Si12Y4,Si12Y4,4.63,Other,True,Si75Y25,Si-Y,2,Supercon,Si3Y1,MP-mp-1189560,Y4Si12,Si-Y,Si75Y25,I 4/m m m,tetragonal,7.233536003278208,7.45692518,7.233536003278208,data/final/MP/cifs/Si3Y1-MP-mp-1189560.cif,data/source/MP/raw/cifs/mp-1189560.cif,mp-1189560,0.0,,2019-01-11 20:17:14.870000,4.051025604452391,,,{'GGA': {'task_id': 'mp-1705276'}},0.1088033312499989,7.82030265,520.0,-96.61386686,-6.03836667875,"{'tags': ['Yttrium trisilicide', 'Lutetium trisilicide']}",-96.61386686,-6.03836667875,-0.2995133854166667,['bandstructure'],True,"[263006, 263005]",True,2021-05-12 10:58:33.577000,NM,16,6,mp-1189560,,YSi3,"{'functional': 'PBE', 'labels': ['Y_sv', 'Si'], 'pot_type': 'paw'}","{'Y': 1.0, 'Si': 3.0}",GGA,mp-1189560,"['mp-1189560', 'mp-1190247', 'mp-1420262', 'mp-1705276', 'mp-1935293', 'mp-1604490']",4.4375e-05,"{'Y': 4.0, 'Si': 12.0}",283.9210364143151,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.251738238267807e-07,4.4375e-05,0,0.0001775,MP,data/source/MP/cleaned/cifs/MP-mp-1189560.cif,False,,data/final/MP/graphs/Si3Y1-MP-mp-1189560.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B6Ho1,1,0.0,1.0,True,B6Ho1,B6Ho1,0.0,Other,True,B85.714Ho14.286,B-Ho,2,Supercon,B6Ho1,MP-mp-571491,Ho1B6,B-Ho,B85.714Ho14.286,P m -3 m,cubic,4.090593,4.090593,4.090593,data/final/MP/cifs/B6Ho1-MP-mp-571491.cif,data/source/MP/raw/cifs/mp-571491.cif,mp-571491,0.0,,2014-02-16 13:05:59,5.574852156432263,10.17188/1276287,"@misc{osti_1276287,
    author = ""Persson, Kristin"",
    title = ""Materials Data on HoB6 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1276287"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703413'}},0.0500426990178564,6.5399085,520.0,-47.34271348,-6.763244782857143,"{'tags': ['Holmium boride (1/6)', 'Holmium octahedro-hexaboride']}",-47.34271348,-6.763244782857143,-0.3834219978571421,"['xas', 'elasticity', 'bandstructure']",True,"[150624, 614470, 614466, 614465]",True,2021-05-12 10:56:27.046000,NM,7,8,mp-571491,,HoB6,"{'functional': 'PBE', 'labels': ['Ho_3', 'B'], 'pot_type': 'paw'}","{'Ho': 1.0, 'B': 6.0}",GGA,mp-571491,"['mp-1001183', 'mp-1007547', 'mp-571491', 'mp-1413028', 'mp-1703413', 'mp-1801876', 'mp-1012304', 'mp-1592055']",0.000581,"{'Ho': 1.0, 'B': 6.0}",68.44769260484178,[],NM,False,221,0,"[0, 0, 0, 0, 0, 0, 0]",8.488233538480184e-06,0.000581,0,0.000581,MP,data/source/MP/cleaned/cifs/MP-mp-571491.cif,False,,data/final/MP/graphs/B6Ho1-MP-mp-571491.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Co1Cu2La1O7.39,2,0.0268857356235996,0.947045196211096,True,Ba1.894Co0.947Cu1.894La0.947O7,Ba2Co1Cu2La1O7,0.0,Cuprate,True,Ba14.937Co7.468Cu14.937La7.468O55.19044062733383,Ba-Co-Cu-La-O,5,Supercon,La1Ba2Cu2Co1O7.39,MP-mp-1214652,Ba2La1Co1Cu2O7,Ba-Co-Cu-La-O,Ba15.385Co7.692Cu15.385La7.692O53.84615384615385,P m m m,orthorhombic,3.932809,3.961428,12.006921,data/final/MP/cifs/Ba2Co1Cu2La1O7.39-MP-mp-1214652-synth_doped.cif,data/source/MP/raw/cifs/mp-1214652.cif,mp-1214652,0.0,,2019-01-12 16:27:34.797000,6.3166503710349255,,,{'GGA+U': {'task_id': 'mp-1741397'}},0.0247075452083302,4.01033439,520.0,-81.01823883,-6.232172217692308,"{'tags': ['Ba2Cu2LaCoO7', 'high-Tc cuprate family', 'Ba2Cu2(Cu0.89Al0.11)YO7']}",-81.01823883,-6.232172217692308,-2.2114486073076924,[],False,[],True,2021-05-12 11:00:37.845000,FM,13,4,mp-1214652,oxide,Ba2LaCoCu2O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'La', 'Co', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'La': 1.0, 'Co': 1.0, 'Cu': 2.0, 'O': 7.0}",GGA+U,mp-1214652,"['mp-1214652', 'mp-1389127', 'mp-1741397', 'mp-1829578']",2.4674875,"{'Ba': 2.0, 'La': 1.0, 'Co': 1.0, 'Cu': 2.0, 'O': 7.0}",187.0623022892272,[],FM,True,47,1,"[0.0, 0.0, 0.0, 2.2, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0131907256021305,2.4674875,1,2.4674875,MP,data/source/MP/cleaned/cifs/MP-mp-1214652.cif,True,,data/final/MP/graphs/Ba2Co1Cu2La1O7.39-MP-mp-1214652-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
C0.922V1,2,0.0405827263267429,1.0,True,C0.922V1,C1V1,0.0,Other,True,C47.971V52.029,C-V,2,Supercon,C0.922V1,MP-mp-1282,V1C1,C-V,C50V50,F m -3 m,cubic,2.94294024,2.9429402399999995,2.942940239999999,data/final/MP/cifs/C0.922V1-MP-mp-1282-synth_doped.cif,data/source/MP/raw/cifs/mp-1282.cif,mp-1282,0.0,,2011-05-12 17:30:28,5.80003584596311,10.17188/1189215,"@misc{osti_1189215,
    author = ""Persson, Kristin"",
    title = ""Materials Data on VC (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189215"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686755'}},0.0879523363888896,8.1976432,520.0,-19.13191761,-9.565958805,"{'tags': ['Vanadium(IV) carbide', 'Vanadium carbide (1/1)']}",-19.13191761,-9.565958805,-0.4106154199999992,"['xas', 'elasticity', 'bandstructure']",True,"[619079, 619067, 619057, 619077, 619056, 619075, 619066, 77563, 181051, 619074, 619054, 619061, 159870, 26953, 619049, 22263, 619071, 619055, 619065]",True,2021-05-12 10:56:12.755000,NM,2,9,mp-1282,,VC,"{'functional': 'PBE', 'labels': ['V_pv', 'C'], 'pot_type': 'paw'}","{'V': 1.0, 'C': 1.0}",GGA,mp-1282,"['mp-995110', 'mp-995213', 'mp-1282', 'mp-1440640', 'mp-1686755', 'mp-1791361', 'mp-995260', 'mp-1595569', 'mp-1595238']",0.0008287,"{'V': 1.0, 'C': 1.0}",18.02309334022026,[],NM,False,225,0,"[0.0, 0.0]",4.5979898364654e-05,0.0008287,0,0.0008287,MP,data/source/MP/cleaned/cifs/MP-mp-1282.cif,True,,data/final/MP/graphs/C0.922V1-MP-mp-1282-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Re0.192Si1V2.808,3,0.096,2.0,False,Re0.384Si2V5.616,Si2V6,4.7,Other,True,Re4.8Si25V70.2,Re-Si-V,3,Supercon,V2.808Re0.192Si1,MP-mp-2567,V6Si2,Si-V,Si25V75,P m -3 n,cubic,4.702381,4.702381,4.702381,data/final/MP/cifs/Re0.192Si1V2.808-MP-mp-2567-synth_doped.cif,data/source/MP/raw/cifs/mp-2567.cif,mp-2567,0.0,,2011-05-13 19:15:43,5.778142190030859,10.17188/1200874,"@misc{osti_1200874,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Si (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1200874"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668672'}},0.0,7.30599425,520.0,-69.05773321,-8.63221665125,{'tags': ['Vanadium silicide (3/1)']},-69.05773321,-8.63221665125,-0.4452085937499994,"['xas', 'elasticity', 'bandstructure']",True,"[652491, 87328, 652522, 652502, 652510, 652520, 600518, 186003, 652507, 652513, 652497, 601150, 652514, 652487, 22412, 652509, 652529, 652532, 652499, 652539, 652537, 652533, 652512, 652538, 652490, 652493, 652494, 652511, 652519, 87329, 652526, 652500]",True,2021-05-12 10:56:18.721000,FM,8,13,mp-2567,,V3Si,"{'functional': 'PBE', 'labels': ['V_pv', 'Si'], 'pot_type': 'paw'}","{'V': 3.0, 'Si': 1.0}",GGA,mp-2567,"['mp-920081', 'mp-906309', 'mp-919083', 'mp-2567', 'mp-1078474', 'mp-1078852', 'mp-1138781', 'mp-1145907', 'mp-1440678', 'mp-1668672', 'mp-1795955', 'mp-1593554', 'mp-1596575']",0.8382519,"{'V': 6.0, 'Si': 2.0}",103.98086881866836,[],FM,True,131,1,"[0.2, 0.3, 0.3, 0.2, 0.3, 0.3, 0.0, 0.0]",0.0161231947669493,0.8382519,6,1.6765038,MP,data/source/MP/cleaned/cifs/MP-mp-2567.cif,True,,data/final/MP/graphs/Re0.192Si1V2.808-MP-mp-2567-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Cu3Eu0.7Pr0.3O7,3,0.0307692307692307,2.0,False,Ba4Cu6Eu1.4Pr0.6O14,Ba4Cu6Eu1Pr1O14,53.8,Cuprate,True,Ba15.385Cu23.077Eu5.385Pr2.308O53.84615384615385,Ba-Cu-Eu-Pr-O,5,Supercon,Eu0.7Pr0.3Ba2Cu3O7,MP-mp-1228601,Ba4Pr1Eu1Cu6O14,Ba-Cu-Eu-Pr-O,Ba15.385Cu23.077Eu3.846Pr3.846O53.84615384615385,C m m m,orthorhombic,3.879178,7.885327998393908,12.58992067,data/final/MP/cifs/Ba2Cu3Eu0.7Pr0.3O7-MP-mp-1228601-synth_doped.cif,data/source/MP/raw/cifs/mp-1228601.cif,mp-1228601,0.0,,2019-01-13 04:17:40.184000,6.571777011913311,,,,0.0156188576201969,3.16956422,520.0,-161.67470258,-6.218257791538462,{'tags': []},-161.67470258,-6.218257791538462,-2.1029685596153844,[],False,[],True,2021-05-12 11:00:59.151000,FM,26,3,mp-1228601,oxide,Ba4PrEu(Cu3O7)2,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Pr_3', 'Eu', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 4.0, 'Pr': 1.0, 'Eu': 1.0, 'Cu': 6.0, 'O': 14.0}",GGA,mp-1228601,"['mp-1228601', 'mp-1347083', 'mp-1836684']",6.3399007,"{'Ba': 4.0, 'Pr': 1.0, 'Eu': 1.0, 'Cu': 6.0, 'O': 14.0}",365.73710597766734,[],FM,True,65,1,"[0.0, 0.0, 0.0, 0.0, 0.0, 6.3, -0.0, -0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0173345843131025,6.3399007,1,6.3399007,MP,data/source/MP/cleaned/cifs/MP-mp-1228601.cif,True,,data/final/MP/graphs/Ba2Cu3Eu0.7Pr0.3O7-MP-mp-1228601-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ag1Mo6S8,1,0.0,1.0,True,Ag1Mo6S8,Ag1Mo6S8,7.7,Chevrel,True,Ag6.667Mo40S53.333,Ag-Mo-S,3,Supercon,Ag1Mo6S8,MP-mp-35109,Ag1Mo6S8,Ag-Mo-S,Ag6.667Mo40S53.333,R -3,trigonal,6.536517440000001,6.53651744,6.53651711,data/final/MP/cifs/Ag1Mo6S8-MP-mp-35109.cif,data/source/MP/raw/cifs/mp-35109.cif,mp-35109,0.0,,2013-11-09 18:36:40,5.600475155494086,,,{'GGA': {'task_id': 'mp-1670822'}},0.0619959402222241,5.64542518,520.0,-110.46276832,-7.364184554666666,"{'tags': ['Silver molybdenum(II/III) sulfide  (1/6/8)', 'Silver molybdenum sulfide (1/6/8)']}",-110.46276832,-7.364184554666666,-0.8992503467777766,"['xas', 'bandstructure']",True,"[605576, 600661]",True,2021-05-12 10:57:34.594000,NM,15,8,mp-35109,,Ag(Mo3S4)2,"{'functional': 'PBE', 'labels': ['Ag', 'Mo_pv', 'S'], 'pot_type': 'paw'}","{'Ag': 1.0, 'Mo': 6.0, 'S': 8.0}",GGA,mp-35109,"['mp-675553', 'mp-947864', 'mp-947278', 'mp-936852', 'mp-35109', 'mp-1420854', 'mp-1670822', 'mp-1598673']",0.0319905,"{'Ag': 1.0, 'Mo': 6.0, 'S': 8.0}",278.7180563196279,[],NM,False,148,0,"[0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001147772785962,0.0319905,0,0.0319905,MP,data/source/MP/cleaned/cifs/MP-mp-35109.cif,False,,data/final/MP/graphs/Ag1Mo6S8-MP-mp-35109.json,0,True,-3,0,0,0,0,0,0,2,1,0,0,0,1.0,False
Sr4V3O9.8,1,0.0,5.0,False,Sr20V15O49,Sr20V15O49,0.0,Oxide,True,Sr23.81V17.857O58.333333333333336,Sr-V-O,3,Supercon,Sr4V3O9.8,MP-mp-759591,Sr20V15O49,Sr-V-O,Sr23.81V17.857O58.333333333333336,I 4,tetragonal,8.773755997344155,8.773755997344157,15.47747799,data/final/MP/cifs/Sr4V3O9.8-MP-mp-759591.cif,data/source/MP/raw/cifs/mp-759591.cif,mp-759591,0.0,,2014-12-05 05:36:31,5.021006927398754,,,{'GGA+U': {'task_id': 'mp-894908'}},0.0021426595102385,4.35480791,520.0,-600.74476541,-7.151723397738095,{'tags': []},-600.74476541,-7.151723397738095,-2.945347810099207,[],False,[],True,2021-05-12 11:01:49.706000,FM,84,6,mp-759591,oxide,Sr20V15O49,"{'functional': 'PBE', 'labels': ['Sr_sv', 'V_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 20.0, 'V': 15.0, 'O': 49.0}",GGA+U,mp-759591,"['mp-762987', 'mp-894908', 'mp-880746', 'mp-759591', 'mp-1335217', 'mp-1850682']",17.0015759,"{'Sr': 20.0, 'V': 15.0, 'O': 49.0}",1091.5335929307485,[],FM,True,1,6,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.2, 1.1, 1.0, 1.2, 1.0, 0.9, 1.1, 1.0, 1.0, 1.3, 1.3, 1.2, 1.7, 1.3, 1.4, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0155758613478409,17.0015759,15,17.0015759,MP,data/source/MP/cleaned/cifs/MP-mp-759591.cif,False,,data/final/MP/graphs/Sr4V3O9.8-MP-mp-759591.json,0,True,4,0,0,0,0,1,0,0,0,0,1,0,1.0,False
B2C1Ni2U1,1,0.0,1.0,True,B2C1Ni2U1,B2C1Ni2U1,0.0,Heavy_fermion,True,B33.333C16.667Ni33.333U16.667,B-C-Ni-U,4,Supercon,U1Ni2B2C1,MP-mp-1025123,U1Ni2B2C1,B-C-Ni-U,B33.333C16.667Ni33.333U16.667,I 4/m m m,tetragonal,3.485049997638133,3.485049997638133,5.825271369999999,data/final/MP/cifs/B2C1Ni2U1-MP-mp-1025123.cif,data/source/MP/raw/cifs/mp-1025123.cif,mp-1025123,0.0,,2016-10-01 12:38:06,10.077118526734468,10.17188/1355285,"@article{osti_1355285,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1355285"",
    place = ""United States"",
    year = ""2017"",
    month = ""5""
}
",{'GGA': {'task_id': 'mp-1670442'}},0.0,9.78926972,520.0,-47.71748848,-7.952914746666667,"{'tags': ['LuNi2B2C', 'UNi2B2C']}",-47.71748848,-7.952914746666667,-0.3800401447222216,"['bandstructure', 'elasticity']",True,[659007],True,2021-05-12 10:56:10.715000,FM,6,6,mp-1025123,,UNi2B2C,"{'functional': 'PBE', 'labels': ['U', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'U': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-1025123,"['mp-1025123', 'mp-1077260', 'mp-1300752', 'mp-1670442', 'mp-1781380', 'mp-1591542']",0.6677007,"{'U': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",64.1086121880679,[],FM,True,139,1,"[0.7, -0.0, -0.0, 0.0, 0.0, 0.0]",0.0104151482493685,0.6677007,1,0.6677007,MP,data/source/MP/cleaned/cifs/MP-mp-1025123.cif,False,,data/final/MP/graphs/B2C1Ni2U1-MP-mp-1025123.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As2Ba0.63Fe2K0.37,3,0.1186666666666666,3.0,False,As6Ba1.89Fe6K1.11,As6Ba1Fe6K2,39.0,Ferrite,True,As40Ba12.6Fe40K7.4,As-Ba-Fe-K,4,Supercon,Ba0.63K0.37Fe2As2,MP-mp-1223766,K2Ba1Fe6As6,As-Ba-Fe-K,As40Ba6.667Fe40K13.333,C 1 2/m 1,monoclinic,5.437740001361472,7.18634711,8.612102760000003,data/final/MP/cifs/As2Ba0.63Fe2K0.37-MP-mp-1223766-synth_doped.cif,data/source/MP/raw/cifs/mp-1223766.cif,mp-1223766,0.0,,2019-01-13 00:06:57.709000,5.619425416151954,,,,0.0077898596666665,3.9822019,520.0,-88.48429402,-5.898952934666666,{'tags': []},-88.48429402,-5.898952934666666,-0.3713176110666666,[],False,[],True,2021-05-12 11:00:52.054000,FM,15,3,mp-1223766,,K2Ba(FeAs)6,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'K': 2.0, 'Ba': 1.0, 'Fe': 6.0, 'As': 6.0}",GGA,mp-1223766,"['mp-1223766', 'mp-1375545', 'mp-1808794']",0.1908756,"{'K': 2.0, 'Ba': 1.0, 'Fe': 6.0, 'As': 6.0}",295.5362020180066,[],FM,True,12,2,"[-0.0, -0.0, -0.0, -0.0, 0.1, 0.1, 0.1, 0.1, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0006458619915145,0.1908756,4,0.1908756,MP,data/source/MP/cleaned/cifs/MP-mp-1223766.cif,True,,data/final/MP/graphs/As2Ba0.63Fe2K0.37-MP-mp-1223766-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
B6Tm0.01Y0.99,2,0.0028571428571428,1.0,True,B6Tm0.01Y0.99,B6Y1,0.0,Other,True,B85.714Tm0.143Y14.143,B-Tm-Y,3,Supercon,B6Tm0.01Y0.99,MP-mp-2203,Y1B6,B-Y,B85.714Y14.286,P m -3 m,cubic,4.1021,4.1021,4.1021,data/final/MP/cifs/B6Tm0.01Y0.99-MP-mp-2203-synth_doped.cif,data/source/MP/raw/cifs/mp-2203.cif,mp-2203,0.0,,2011-05-12 20:11:15,3.699194842606093,10.17188/1197299,"@misc{osti_1197299,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YB6 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197299"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686414'}},0.0285229421428576,6.62579631,520.0,-49.33978236,-7.048540337142858,"{'tags': ['Yttrium boride (1/6)', 'Yttrium octahedro-hexaboride', 'Yttrium hexaboride']}",-49.33978236,-7.048540337142858,-0.3995658030952376,"['xas', 'elasticity', 'bandstructure']",True,"[194635, 615723, 54730, 615726, 615714, 659505, 76126, 615728, 615710]",True,2021-05-12 10:56:16.728000,NM,7,9,mp-2203,,YB6,"{'functional': 'PBE', 'labels': ['Y_sv', 'B'], 'pot_type': 'paw'}","{'Y': 1.0, 'B': 6.0}",GGA,mp-2203,"['mp-1000404', 'mp-1006875', 'mp-2203', 'mp-1077859', 'mp-1440131', 'mp-1686414', 'mp-1801281', 'mp-1011609', 'mp-1592923']",3.48e-05,"{'Y': 1.0, 'B': 6.0}",69.026957252261,[],NM,False,221,0,"[0, 0, 0, 0, 0, 0, 0]",5.041508620005138e-07,3.48e-05,0,3.48e-05,MP,data/source/MP/cleaned/cifs/MP-mp-2203.cif,True,,data/final/MP/graphs/B6Tm0.01Y0.99-MP-mp-2203-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
B2Ce1Ru3,1,0.0,1.0,True,B2Ce1Ru3,B2Ce1Ru3,0.55,Heavy_fermion,True,B33.333Ce16.667Ru50,B-Ce-Ru,3,Supercon,Ce1Ru3B2,MP-mp-5940,Ce1B2Ru3,B-Ce-Ru,B33.333Ce16.667Ru50,P 6/m m m,hexagonal,3.0119,5.548954001550303,5.548953890000001,data/final/MP/cifs/B2Ce1Ru3-MP-mp-5940.cif,data/source/MP/raw/cifs/mp-5940.cif,mp-5940,0.0,,2011-05-13 09:04:23,9.613024819862677,10.17188/1277195,"@misc{osti_1277195,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeB2Ru3 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277195"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701816'}},0.0,8.28995738,520.0,-50.17902305,-8.363170508333333,{'tags': ['Cerium ruthenium boride (1/3/2)']},-50.17902305,-8.363170508333333,-0.510663564722222,"['xas', 'bandstructure']",True,"[612856, 612852, 44157]",True,2021-05-12 10:57:26.891000,NM,6,8,mp-5940,,CeB2Ru3,"{'functional': 'PBE', 'labels': ['Ce', 'B', 'Ru_pv'], 'pot_type': 'paw'}","{'Ce': 1.0, 'B': 2.0, 'Ru': 3.0}",GGA,mp-5940,"['mp-5940', 'mp-926022', 'mp-910093', 'mp-925579', 'mp-1438082', 'mp-1701816', 'mp-1783867', 'mp-1592972']",0.087026,"{'Ce': 1.0, 'B': 2.0, 'Ru': 3.0}",80.31439972382864,[],NM,False,191,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0010835665870535,0.087026,0,0.087026,MP,data/source/MP/cleaned/cifs/MP-mp-5940.cif,False,,data/final/MP/graphs/B2Ce1Ru3-MP-mp-5940.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
As1Ti1,1,0.0,4.0,False,As4Ti4,As4Ti4,0.0,Other,True,As50Ti50,As-Ti,2,Supercon,As1Ti1,MP-mp-1822,Ti4As4,As-Ti,As50Ti50,P 63/m m c,hexagonal,3.649016000398736,3.64901552,12.118486,data/final/MP/cifs/As1Ti1-MP-mp-1822.cif,data/source/MP/raw/cifs/mp-1822.cif,mp-1822,0.0,,2011-05-13 08:29:09,5.836287538548553,10.17188/1192993,"@misc{osti_1192993,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TiAs (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1192993"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702807'}},0.0,6.60798978,520.0,-57.57944316,-7.197430395,"{'tags': ['Titanium(III) arsenide', 'Titanium arsenide (1/1)']}",-57.57944316,-7.197430395,-0.9201251841666664,"['xas', 'elasticity', 'bandstructure']",True,"[16773, 601817, 44981, 611505]",True,2021-05-12 10:56:14.760000,NM,8,10,mp-1822,,TiAs,"{'functional': 'PBE', 'labels': ['Ti_pv', 'As'], 'pot_type': 'paw'}","{'Ti': 1.0, 'As': 1.0}",GGA,mp-1822,"['mp-925093', 'mp-924395', 'mp-909404', 'mp-1822', 'mp-1080145', 'mp-1087533', 'mp-1414095', 'mp-1702807', 'mp-1882068', 'mp-1588795']",0.001142725,"{'Ti': 4.0, 'As': 4.0}",139.74312669579552,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",3.270930104455381e-05,0.001142725,0,0.0045709,MP,data/source/MP/cleaned/cifs/MP-mp-1822.cif,False,,data/final/MP/graphs/As1Ti1-MP-mp-1822.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ir1Si3,1,0.0,2.0,False,Ir2Si6,Ir2Si6,0.0,Other,True,Ir25Si75,Ir-Si,2,Supercon,Ir1Si3,MP-mp-569802,Si6Ir2,Ir-Si,Ir25Si75,P 63 m c,hexagonal,4.777635996374396,4.777635869999999,6.422826,data/final/MP/cifs/Ir1Si3-MP-mp-569802.cif,data/source/MP/raw/cifs/mp-569802.cif,mp-569802,0.0,,2014-02-16 06:23:10,7.231855059873617,10.17188/1275269,"@misc{osti_1275269,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Si3Ir (SG:186) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1275269"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701423'}},0.5103619500000001,9.05460641,520.0,-49.69974696,-6.21246837,{'tags': ['Iridium silicide (1/3)']},-49.69974696,-6.21246837,0.1193747500000004,"['xas', 'elasticity', 'bandstructure']",True,[26218],True,2021-05-12 10:56:22.739000,NM,8,8,mp-569802,,Si3Ir,"{'functional': 'PBE', 'labels': ['Si', 'Ir'], 'pot_type': 'paw'}","{'Si': 3.0, 'Ir': 1.0}",GGA,mp-569802,"['mp-907160', 'mp-920645', 'mp-921667', 'mp-569802', 'mp-1420503', 'mp-1701423', 'mp-1788843', 'mp-1593892']",0.0165951,"{'Si': 6.0, 'Ir': 2.0}",126.96467056618752,[],NM,False,186,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0002614128784959,0.0165951,0,0.0331902,MP,data/source/MP/cleaned/cifs/MP-mp-569802.cif,False,,data/final/MP/graphs/Ir1Si3-MP-mp-569802.json,0,True,6mm,0,5,0,0,0,0,0,1,0,0,0,1.0,False
Be13Ca1,1,0.0,2.0,False,Be26Ca2,Be26Ca2,0.0,Other,True,Be92.857Ca7.143,Be-Ca,2,Supercon,Be13Ca1,MP-mp-1845,Ca2Be26,Be-Ca,Be92.857Ca7.143,F m -3 c,cubic,7.238260380000001,7.23826038,7.23826038,data/final/MP/cifs/Be13Ca1-MP-mp-1845.cif,data/source/MP/raw/cifs/mp-1845.cif,mp-1845,0.0,,2011-05-15 06:47:13,1.947352099682553,10.17188/1193111,"@misc{osti_1193111,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CaBe13 (SG:226) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1193111"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1673243'}},0.0,3.91706159,520.0,-103.97927193,-3.713545426071428,{'tags': ['Beryllium calcium (13/1)']},-103.97927193,-3.713545426071428,-0.097976345714286,"['xas', 'bandstructure']",True,"[58692, 616189, 616187]",True,2021-05-12 10:56:55.092000,NM,28,7,mp-1845,,CaBe13,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Be_sv'], 'pot_type': 'paw'}","{'Ca': 1.0, 'Be': 13.0}",GGA,mp-1845,"['mp-941397', 'mp-934569', 'mp-941083', 'mp-1845', 'mp-1418665', 'mp-1673243', 'mp-1607097']",0.00012885,"{'Ca': 2.0, 'Be': 26.0}",268.1560550614124,[],NM,False,226,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",9.61007574268581e-07,0.00012885,0,0.0002577,MP,data/source/MP/cleaned/cifs/MP-mp-1845.cif,False,,data/final/MP/graphs/Be13Ca1-MP-mp-1845.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
As1F0.1Fe1Tb1O0.9,2,0.0499999999999999,2.0,False,As2F0.2Fe2Tb2O1.8,As2Fe2Tb2O2,50.5,Ferrite,True,As25F2.5Fe25Tb25O22.5,As-F-Fe-Tb-O,5,Supercon,Tb1Fe1As1F0.1O0.9,MP-mp-1079887,Tb2Fe2As2O2,As-Fe-Tb-O,As25Fe25Tb25O25,P 4/n m m,tetragonal,3.971557,3.971557,9.096524,data/final/MP/cifs/As1F0.1Fe1Tb1O0.9-MP-mp-1079887-synth_doped.cif,data/source/MP/raw/cifs/mp-1079887.cif,mp-1079887,0.0,,2018-04-16 16:53:03,7.075630957925009,,,{'GGA+U': {'task_id': 'mp-1697746'}},0.2848640540625,4.29262424,520.0,-53.1200584,-6.6400073,{'tags': []},-53.1200584,-6.6400073,-1.69789381,['bandstructure'],True,[422004],True,2021-05-12 10:58:16.596000,FM,8,5,mp-1079887,oxide,TbFeAsO,"{'functional': 'PBE', 'labels': ['Tb_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Tb': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-1079887,"['mp-1079887', 'mp-1418181', 'mp-1697746', 'mp-1779163', 'mp-1589035']",3.7855201,"{'Tb': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",143.48188366951112,[],FM,True,129,1,"[0.0, 0.0, 3.6, 3.6, 0.0, 0.0, 0.0, 0.0]",0.0527665235942869,3.7855201,2,7.5710402,MP,data/source/MP/cleaned/cifs/MP-mp-1079887.cif,True,,data/final/MP/graphs/As1F0.1Fe1Tb1O0.9-MP-mp-1079887-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Co1.9Cr0.1Cu1S4,2,0.0285714285714285,2.0,False,Co3.8Cr0.2Cu2S8,Co4Cu2S8,3.0,Other,True,Co27.143Cr1.429Cu14.286S57.143,Co-Cr-Cu-S,4,Supercon,Cu1Co1.9Cr0.1S4,MP-mp-3925,Co4Cu2S8,Co-Cu-S,Co28.571Cu14.286S57.143,F d -3 m,cubic,6.69987918,6.699879179999999,6.699879179999999,data/final/MP/cifs/Co1.9Cr0.1Cu1S4-MP-mp-3925-synth_doped.cif,data/source/MP/raw/cifs/mp-3925.cif,mp-3925,0.0,,2011-05-15 03:07:38,4.836104359598833,10.17188/1207634,"@misc{osti_1207634,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Co2CuS4 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207634"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698326'}},0.0,5.68331854,520.0,-75.59837827,-5.399884162142857,"{'tags': ['Cobalt copper sulfide (2/1/4)', 'Carrollite', 'Dicobalt(III) copper sulfide']}",-75.59837827,-5.399884162142857,-0.7070782010714284,"['xas', 'bandstructure']",True,"[622571, 31107, 52943]",True,2021-05-12 10:57:08.928000,NM,14,8,mp-3925,,Co2CuS4,"{'functional': 'PBE', 'labels': ['Co', 'Cu_pv', 'S'], 'pot_type': 'paw'}","{'Co': 2.0, 'Cu': 1.0, 'S': 4.0}",GGA,mp-3925,"['mp-931396', 'mp-915858', 'mp-932359', 'mp-3925', 'mp-1425952', 'mp-1698326', 'mp-1833413', 'mp-1599756']",0.00593025,"{'Co': 4.0, 'Cu': 2.0, 'S': 8.0}",212.6600516474575,[],NM,False,227,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",5.5772110972972206e-05,0.00593025,0,0.0118605,MP,data/source/MP/cleaned/cifs/MP-mp-3925.cif,True,,data/final/MP/graphs/Co1.9Cr0.1Cu1S4-MP-mp-3925-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
C0.86Nb1,3,0.075268817204301,1.0,True,C0.86Nb1,C1Nb1,0.0,Other,True,C46.237Nb53.763,C-Nb,2,Supercon,Nb1C0.86,MP-mp-910,Nb1C1,C-Nb,C50Nb50,F m -3 m,cubic,3.18634336,3.1863433599999995,3.1863433599999995,data/final/MP/cifs/C0.86Nb1-MP-mp-910-synth_doped.cif,data/source/MP/raw/cifs/mp-910.cif,mp-910,0.0,,2011-05-12 17:28:40,7.616098778357742,10.17188/1282001,"@misc{osti_1282001,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbC (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1282001"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686610'}},0.0408750508333302,7.39992982,520.0,-20.24633413,-10.123167065,"{'tags': ['Niobium carbide (1/1)', 'Niobium carbide (1/1) - RS-type']}",-20.24633413,-10.123167065,-0.4591241950000011,"['xas', 'elasticity', 'bandstructure']",True,"[618465, 77214, 187077, 618456, 181792, 618453, 94449, 618472, 183163, 237582, 618457, 159872, 618480, 618475, 618482, 618469, 155164, 618466, 44355, 618450, 618458, 618449, 44496, 618463, 618462, 618460, 618481, 618471, 618476, 181052, 601142, 618448, 189089, 618478, 26955, 618473, 618484, 618483]",True,2021-05-12 10:56:35.166000,NM,2,25,mp-910,,NbC,"{'functional': 'PBE', 'labels': ['Nb_pv', 'C'], 'pot_type': 'paw'}","{'Nb': 1.0, 'C': 1.0}",GGA,mp-910,"['mp-1000444', 'mp-1001333', 'mp-910', 'mp-1057158', 'mp-1057178', 'mp-1057130', 'mp-1057651', 'mp-1057669', 'mp-1057682', 'mp-1057771', 'mp-1057779', 'mp-1057802', 'mp-1060960', 'mp-1060978', 'mp-1061015', 'mp-1440938', 'mp-1686610', 'mp-1805660', 'mp-1007673', 'mp-1593845', 'mp-1596940', 'mp-1061007', 'mp-1057677', 'mp-1057792', 'mp-1057174']",3.33e-05,"{'Nb': 1.0, 'C': 1.0}",22.87508541625878,[],NM,False,225,0,"[0, 0]",1.4557322691495426e-06,3.33e-05,0,3.33e-05,MP,data/source/MP/cleaned/cifs/MP-mp-910.cif,True,,data/final/MP/graphs/C0.86Nb1-MP-mp-910-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Pd1V3,1,0.0,2.0,False,Pd2V6,Pd2V6,0.081,Other,True,Pd25V75,Pd-V,2,Supercon,Pd1V3,MP-mp-1664,V6Pd2,Pd-V,Pd25V75,P m -3 n,cubic,4.816542,4.816542,4.816542,data/final/MP/cifs/Pd1V3-MP-mp-1664.cif,data/source/MP/raw/cifs/mp-1664.cif,mp-1664,0.0,,2011-05-14 02:39:39,7.705176466473647,10.17188/1192084,"@misc{osti_1192084,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Pd (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1192084"",
    place = ""United States"",
    year = ""2015"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697619'}},0.0,6.1312641,520.0,-65.92518137,-8.24064767125,{'tags': ['Palladium vanadium (1/3)']},-65.92518137,-8.24064767125,-0.1327476662500011,"['bandstructure', 'elasticity']",True,"[649092, 105739]",True,2021-05-12 10:56:14.760000,NM,8,8,mp-1664,,V3Pd,"{'functional': 'PBE', 'labels': ['V_pv', 'Pd'], 'pot_type': 'paw'}","{'V': 3.0, 'Pd': 1.0}",GGA,mp-1664,"['mp-943074', 'mp-932785', 'mp-942058', 'mp-1664', 'mp-1436130', 'mp-1697619', 'mp-1802534', 'mp-1594222']",8.9e-05,"{'V': 6.0, 'Pd': 2.0}",111.7393279503175,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.5929932930968035e-06,8.9e-05,0,0.000178,MP,data/source/MP/cleaned/cifs/MP-mp-1664.cif,False,,data/final/MP/graphs/Pd1V3-MP-mp-1664.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Eu1Ru4Sb12,1,0.0,1.0,True,Eu1Ru4Sb12,Eu1Ru4Sb12,0.0,Other,True,Eu5.882Ru23.529Sb70.588,Eu-Ru-Sb,3,Supercon,Eu1Ru4Sb12,MP-mp-20855,Eu1Sb12Ru4,Eu-Ru-Sb,Eu5.882Ru23.529Sb70.588,I m -3,cubic,8.146718291806,8.14671829,8.14671829,data/final/MP/cifs/Eu1Ru4Sb12-MP-mp-20855.cif,data/source/MP/raw/cifs/mp-20855.cif,mp-20855,0.0,,2014-02-22 19:27:58,8.048355619115487,10.17188/1196051,"@misc{osti_1196051,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Eu(Sb3Ru)4 (SG:204) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196051"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1707667'}},0.0,7.16556123,520.0,-102.2097971,-6.012341005882353,{'tags': ['Europium ruthenium antimonide (1/4/12)']},-102.2097971,-6.012341005882353,-0.4456576544117651,"['xas', 'bandstructure']",True,"[79928, 631585, 55663]",True,2021-05-12 10:56:57.051000,FiM,17,8,mp-20855,,Eu(Sb3Ru)4,"{'functional': 'PBE', 'labels': ['Eu', 'Sb', 'Ru_pv'], 'pot_type': 'paw'}","{'Eu': 1.0, 'Sb': 12.0, 'Ru': 4.0}",GGA,mp-20855,"['mp-991780', 'mp-992261', 'mp-20855', 'mp-1435435', 'mp-1707667', 'mp-1818924', 'mp-993910', 'mp-1609252']",6.3588712,"{'Eu': 1.0, 'Sb': 12.0, 'Ru': 4.0}",416.2231258266141,[],FiM,True,204,2,"[6.8, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.1, -0.1, -0.1, -0.1]",0.0152775538057174,6.3588712,5,6.3588712,MP,data/source/MP/cleaned/cifs/MP-mp-20855.cif,False,,data/final/MP/graphs/Eu1Ru4Sb12-MP-mp-20855.json,0,True,m-3,2,0,0,0,0,0,0,0,0,1,0,1.0,False
Pb0.8Pt0.2,1,0.0,10.0,False,Pb8Pt2,Pb8Pt2,2.8,Other,True,Pb80Pt20,Pb-Pt,2,Supercon,Pb0.8Pt0.2,MP-mp-21296,Pt2Pb8,Pb-Pt,Pb80Pt20,P 4/n b m,tetragonal,6.144727,6.799817,6.799817,data/final/MP/cifs/Pb0.8Pt0.2-MP-mp-21296.cif,data/source/MP/raw/cifs/mp-21296.cif,mp-21296,0.0,,2014-02-22 19:20:36,11.9683093773928,10.17188/1196607,"@misc{osti_1196607,
    author = ""Persson, Kristin"",
    title = ""Materials Data on PtPb4 (SG:125) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196607"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702270'}},0.0,6.79779688,520.0,-43.11113554,-4.311113554,{'tags': ['Lead platinum (4/1)']},-43.11113554,-4.311113554,-0.1268143559999998,"['xas', 'elasticity', 'bandstructure']",True,"[648397, 105604]",True,2021-05-12 10:56:16.728000,NM,10,8,mp-21296,,PtPb4,"{'functional': 'PBE', 'labels': ['Pt', 'Pb_d'], 'pot_type': 'paw'}","{'Pt': 1.0, 'Pb': 4.0}",GGA,mp-21296,"['mp-935240', 'mp-942037', 'mp-943044', 'mp-21296', 'mp-1415838', 'mp-1702270', 'mp-1924726', 'mp-1600780']",0.0014743,"{'Pt': 2.0, 'Pb': 8.0}",284.1168836892232,[],NM,False,125,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.0378123122120683e-05,0.0014743,0,0.0029486,MP,data/source/MP/cleaned/cifs/MP-mp-21296.cif,False,,data/final/MP/graphs/Pb0.8Pt0.2-MP-mp-21296.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Nb3Sb0.3Sn0.7,3,0.15,2.0,False,Nb6Sb0.6Sn1.4,Nb6Sn2,15.8,Other,True,Nb75Sb7.5Sn17.5,Nb-Sb-Sn,3,Supercon,Nb3Sn0.7Sb0.3,MP-mp-1326,Nb6Sn2,Nb-Sn,Nb75Sn25,P m -3 n,cubic,5.334611,5.334611,5.334611,data/final/MP/cifs/Nb3Sb0.3Sn0.7-MP-mp-1326-synth_doped.cif,data/source/MP/raw/cifs/mp-1326.cif,mp-1326,0.0,,2011-05-14 09:51:48,8.694218121896231,10.17188/1189484,"@misc{osti_1189484,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Sn (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189484"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668415'}},0.0,6.59372491,520.0,-69.93787048,-8.74223381,{'tags': ['Niobium tin (3/1)']},-69.93787048,-8.74223381,-0.163862066250001,"['xas', 'elasticity', 'bandstructure']",True,"[105230, 645503, 645489, 105231, 645498, 645485, 645474, 645496, 645480, 645488, 645482, 645487, 645500, 645493, 645477, 645484, 645502, 645483, 150878, 645479, 645481, 645486, 645473]",True,2021-05-12 10:56:12.755000,NM,8,9,mp-1326,,Nb3Sn,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Sn_d'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Sn': 1.0}",GGA,mp-1326,"['mp-930046', 'mp-913770', 'mp-930577', 'mp-1326', 'mp-1440651', 'mp-1668415', 'mp-1880085', 'mp-1594093', 'mp-1594507']",0.62023085,"{'Nb': 6.0, 'Sn': 2.0}",151.81275738025872,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0081709977567491,0.62023085,0,1.2404617,MP,data/source/MP/cleaned/cifs/MP-mp-1326.cif,True,,data/final/MP/graphs/Nb3Sb0.3Sn0.7-MP-mp-1326-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
C4Fe1Lu2,1,0.0,2.0,False,C8Fe2Lu4,C8Fe2Lu4,0.0,Other,True,C57.143Fe14.286Lu28.571,C-Fe-Lu,3,Supercon,Lu2Fe1C4,MP-mp-1104515,Lu4Fe2C8,C-Fe-Lu,C57.143Fe14.286Lu28.571,I b a m,orthorhombic,4.93263,6.44630425,6.44630425,data/final/MP/cifs/C4Fe1Lu2-MP-mp-1104515.cif,data/source/MP/raw/cifs/mp-1104515.cif,mp-1104515,0.0,,2018-07-18 22:15:18,8.834108777448241,,,,0.0,4.96989116,520.0,-113.35931154,-8.097093681428571,"{'tags': ['Lu2FeC4', 'Er2FeC4', 'Lutetium iron carbide (2/1/4)']}",-113.35931154,-8.097093681428571,-0.3229462114285703,[],False,[617765],True,2021-05-12 10:59:31.014000,NM,14,3,mp-1104515,,Lu2FeC4,"{'functional': 'PBE', 'labels': ['Lu_3', 'Fe_pv', 'C'], 'pot_type': 'paw'}","{'Lu': 2.0, 'Fe': 1.0, 'C': 4.0}",GGA,mp-1104515,"['mp-1104515', 'mp-1830515', 'mp-1984469']",0.0041129,"{'Lu': 4.0, 'Fe': 2.0, 'C': 8.0}",170.60890852928986,[],NM,False,72,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.821436389757929e-05,0.0041129,0,0.0082258,MP,data/source/MP/cleaned/cifs/MP-mp-1104515.cif,False,,data/final/MP/graphs/C4Fe1Lu2-MP-mp-1104515.json,0,True,mmm,0,0,0,7,0,0,0,0,0,1,0,1.0,False
B2Mg0.97Na0.03,2,0.02,1.0,True,B2Mg0.97Na0.03,B2Mg1,38.0,Other,True,B66.667Mg32.333Na1,B-Mg-Na,3,Supercon,Mg0.97Na0.03B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B2Mg0.97Na0.03-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B2Mg0.97Na0.03-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Co1Zr2,1,0.0,2.0,False,Co2Zr4,Co2Zr4,5.4114285715,Other,True,Co33.333Zr66.667,Co-Zr,2,Supercon,Zr2Co1,MP-mp-628,Zr4Co2,Co-Zr,Co33.333Zr66.667,I 4/m c m,tetragonal,5.27792884001752,5.27792884,5.277928840000001,data/final/MP/cifs/Co1Zr2-MP-mp-628.cif,data/source/MP/raw/cifs/mp-628.cif,mp-628,0.0,,2011-05-13 12:16:44,7.17077101131263,10.17188/1278899,"@misc{osti_1278899,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Zr2Co (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278899"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677545'}},0.0,4.51380976,520.0,-49.95120762,-8.325201269999999,"{'tags': ['Cobalt zirconium (1/2)', 'Zirconium cobalt (2/1)']}",-49.95120762,-8.325201269999999,-0.2572949183333328,"['xas', 'elasticity', 'bandstructure']",True,"[625671, 191386, 625688, 102740, 625665]",True,2021-05-12 10:56:27.046000,NM,6,20,mp-628,,Zr2Co,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Co'], 'pot_type': 'paw'}","{'Zr': 2.0, 'Co': 1.0}",GGA,mp-628,"['mp-928347', 'mp-912327', 'mp-928866', 'mp-628', 'mp-1071352', 'mp-1071381', 'mp-1071431', 'mp-1071762', 'mp-1071803', 'mp-1071859', 'mp-1071883', 'mp-1071742', 'mp-1071925', 'mp-1441633', 'mp-1677545', 'mp-1802810', 'mp-1591799', 'mp-1071792', 'mp-1071416', 'mp-1071915']",0.0001226,"{'Zr': 4.0, 'Co': 2.0}",111.79353060019714,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0]",2.1933290654975308e-06,0.0001226,0,0.0002452,MP,data/source/MP/cleaned/cifs/MP-mp-628.cif,False,,data/final/MP/graphs/Co1Zr2-MP-mp-628.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Se1Y1,1,0.0,1.0,True,Se1Y1,Se1Y1,3.25,Other,True,Se50Y50,Se-Y,2,Supercon,Se1Y1,MP-mp-2637,Y1Se1,Se-Y,Se50Y50,F m -3 m,cubic,4.08878415,4.08878415,4.08878415,data/final/MP/cifs/Se1Y1-MP-mp-2637.cif,data/source/MP/raw/cifs/mp-2637.cif,mp-2637,0.0,,2011-05-12 18:06:00,5.766919585016414,10.17188/1201161,"@misc{osti_1201161,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YSe (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201161"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686807'}},0.0,5.91631916,520.0,-13.48311056,-6.74155528,"{'tags': ['High pressure experimental phase', 'Yttrium selenide (1/1)', 'Yttrium(II) selenide', 'Yttrium selenide']}",-13.48311056,-6.74155528,-1.996363984505208,"['xas', 'elasticity', 'bandstructure']",True,"[652176, 183015, 183014, 106047, 183016, 44974, 652182]",True,2021-05-12 10:56:18.721000,NM,2,21,mp-2637,,YSe,"{'functional': 'PBE', 'labels': ['Y_sv', 'Se'], 'pot_type': 'paw'}","{'Y': 1.0, 'Se': 1.0}",GGA,mp-2637,"['mp-1000798', 'mp-1007253', 'mp-2637', 'mp-1057856', 'mp-1057862', 'mp-1057958', 'mp-1057879', 'mp-1057950', 'mp-1057977', 'mp-1058800', 'mp-1058811', 'mp-1058830', 'mp-1442051', 'mp-1686807', 'mp-1792108', 'mp-1011994', 'mp-1591774', 'mp-1595527', 'mp-1058836', 'mp-1057883', 'mp-1057982']",0.0011631,"{'Y': 1.0, 'Se': 1.0}",48.3356491734785,[],NM,False,225,0,"[0, 0]",2.406298497875945e-05,0.0011631,0,0.0011631,MP,data/source/MP/cleaned/cifs/MP-mp-2637.cif,False,,data/final/MP/graphs/Se1Y1-MP-mp-2637.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
C1Cu1Na0.3Sr1.7O5,3,0.0666666666666666,2.0,False,C2Cu2Na0.6Sr3.4O10,C2Cu2Sr4O10,0.0,Cuprate,True,C11.111Cu11.111Na3.333Sr18.889O55.55555555555556,C-Cu-Na-Sr-O,5,Supercon,Sr1.7Na0.3Cu1C1O5,MP-mp-1147662,Sr4Cu2C2O10,C-Cu-Sr-O,C11.111Cu11.111Sr22.222O55.55555555555556,I -4 2 m,tetragonal,5.556718,5.556718,8.631809904721473,data/final/MP/cifs/C1Cu1Na0.3Sr1.7O5-MP-mp-1147662-synth_doped.cif,data/source/MP/raw/cifs/mp-1147662.cif,mp-1147662,0.0,,2018-12-27 11:40:38.663000,4.629324765530757,,,,0.0444555886111093,3.36507303,520.0,-118.84575437,-6.602541909444444,{'tags': []},-118.84575437,-6.602541909444444,-2.3792330981481475,[],False,[],True,2021-05-12 10:59:37.456000,AFM,18,2,mp-1147662,oxide,Sr2CuCO5,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Cu_pv', 'C', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Cu': 1.0, 'C': 1.0, 'O': 5.0}",GGA,mp-1147662,"['mp-1147662', 'mp-1881214']",0.0031806,"{'Sr': 4.0, 'Cu': 2.0, 'C': 2.0, 'O': 10.0}",237.3114394242258,[],AFM,True,121,2,"[0.0, 0.0, 0.0, 0.0, 0.3, -0.3, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",2.6805281765741217e-05,0.0031806,2,0.0063612,MP,data/source/MP/cleaned/cifs/MP-mp-1147662.cif,True,,data/final/MP/graphs/C1Cu1Na0.3Sr1.7O5-MP-mp-1147662-synth_doped.json,0,True,-42m,0,0,0,0,6,0,0,0,0,1,0,1.0,False
Fe2K0.8Se2,2,1.1564823173178715e-16,5.0,False,Fe10K4Se10,Fe10K4Se10,31.36428571,Ferrite,True,Fe41.667K16.667Se41.667,Fe-K-Se,3,Supercon,K0.8Fe2Se2,MP-mp-1224406,K4Fe10Se10,Fe-K-Se,Fe41.667K16.667Se41.667,I 4/m,tetragonal,8.310348001718783,8.310348001718785,9.6251784,data/final/MP/cifs/Fe2K0.8Se2-MP-mp-1224406.cif,data/source/MP/raw/cifs/mp-1224406.cif,mp-1224406,0.0,,2019-01-13 00:39:37.975000,4.745143887784882,,,,0.026357554166668,3.12884243,520.0,-135.06081529,-5.627533970416667,{'tags': []},-135.06081529,-5.627533970416667,-0.6533341760598953,[],False,[],True,2021-05-12 11:00:52.054000,FM,24,3,mp-1224406,,K2(FeSe)5,"{'functional': 'PBE', 'labels': ['K_sv', 'Fe_pv', 'Se'], 'pot_type': 'paw'}","{'K': 2.0, 'Fe': 5.0, 'Se': 5.0}",GGA,mp-1224406,"['mp-1224406', 'mp-1342076', 'mp-1872172']",14.09249925,"{'K': 4.0, 'Fe': 10.0, 'Se': 10.0}",526.4722769548964,[],FM,True,87,2,"[0.0, 0.0, 0.0, 0.0, 2.7, 2.7, 2.6, 2.7, 2.7, 2.7, 2.7, 2.7, 2.7, 2.6, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0535355796187814,14.09249925,10,28.1849985,MP,data/source/MP/cleaned/cifs/MP-mp-1224406.cif,False,,data/final/MP/graphs/Fe2K0.8Se2-MP-mp-1224406.json,0,True,4/m,0,0,0,0,3,0,0,0,0,1,0,1.0,False
Cu2Gd0.91Nd0.09Ru1Sr2O8,2,0.0128571428571428,2.0,False,Cu4Gd1.82Nd0.18Ru2Sr4O16,Cu4Gd2Ru2Sr4O16,23.5,Cuprate,True,Cu14.286Gd6.5Nd0.643Ru7.143Sr14.286O57.142857142857146,Cu-Gd-Nd-Ru-Sr-O,6,Supercon,Ru1Sr2Gd0.91Nd0.09Cu2O8,MP-mp-1194240,Sr4Gd2Cu4Ru2O16,Cu-Gd-Ru-Sr-O,Cu14.286Gd7.143Ru7.143Sr14.286O57.142857142857146,P 4/m b m,tetragonal,5.472451,5.472451,11.740702,data/final/MP/cifs/Cu2Gd0.91Nd0.09Ru1Sr2O8-MP-mp-1194240-synth_doped.cif,data/source/MP/raw/cifs/mp-1194240.cif,mp-1194240,0.0,,2019-01-11 23:51:58.932000,6.504561898971391,,,{'GGA': {'task_id': 'mp-1765260'}},0.0213449239285443,3.93502801,520.0,-201.55352223,-7.198340079642857,"{'tags': ['Sr2Cu2GdRuO8 orth', 'Sr2Cu2GdRuO8', 'Ruthenium distrontium gadolinium dicopper octaoxide']}",-201.55352223,-7.198340079642857,-2.268654352380952,['bandstructure'],True,[245741],True,2021-05-12 10:58:35.561000,FiM,28,6,mp-1194240,oxide,Sr2GdCu2RuO8,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Gd', 'Cu_pv', 'Ru_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Gd': 1.0, 'Cu': 2.0, 'Ru': 1.0, 'O': 8.0}",GGA,mp-1194240,"['mp-1194240', 'mp-1396976', 'mp-1659973', 'mp-1765260', 'mp-1841948', 'mp-1638264']",4.23696715,"{'Sr': 4.0, 'Gd': 2.0, 'Cu': 4.0, 'Ru': 2.0, 'O': 16.0}",351.6072554818909,[],FiM,True,127,2,"[-0.0, -0.0, -0.0, -0.0, 6.9, 6.9, 0.0, 0.0, 0.0, 0.0, -1.8, -1.8, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0241005672319991,4.23696715,4,8.4739343,MP,data/source/MP/cleaned/cifs/MP-mp-1194240.cif,True,,data/final/MP/graphs/Cu2Gd0.91Nd0.09Ru1Sr2O8-MP-mp-1194240-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ga0.8Si1.2Sr1,3,0.1333333333333333,1.0,True,Ga0.8Si1.2Sr1,Ga1Si1Sr1,4.24,Other,True,Ga26.667Si40Sr33.333,Ga-Si-Sr,3,Supercon,Sr1Ga0.8Si1.2,MP-mp-1218262,Sr1Ga1Si1,Ga-Si-Sr,Ga33.333Si33.333Sr33.333,P -6 m 2,hexagonal,4.2209479997069455,4.220947830000001,4.723355,data/final/MP/cifs/Ga0.8Si1.2Sr1-MP-mp-1218262-synth_doped.cif,data/source/MP/raw/cifs/mp-1218262.cif,mp-1218262,0.0,,2019-01-12 19:27:35.341000,4.224977327446255,,,{'GGA': {'task_id': 'mp-1767455'}},0.0,4.14906217,520.0,-11.52735393,-3.84245131,{'tags': []},-11.52735393,-3.84245131,-0.4378168113888889,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,3,5,mp-1218262,,SrGaSi,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ga_d', 'Si'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Ga': 1.0, 'Si': 1.0}",GGA,mp-1218262,"['mp-1218262', 'mp-1432931', 'mp-1767455', 'mp-1801429', 'mp-1611910']",0.0052074,"{'Sr': 1.0, 'Ga': 1.0, 'Si': 1.0}",72.87879778923026,[],NM,False,187,0,"[0, 0, 0]",7.14528800963499e-05,0.0052074,0,0.0052074,MP,data/source/MP/cleaned/cifs/MP-mp-1218262.cif,True,,data/final/MP/graphs/Ga0.8Si1.2Sr1-MP-mp-1218262-synth_doped.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Co0.05Nb3Rh0.95,2,0.025,2.0,False,Co0.1Nb6Rh1.9,Nb6Rh2,1.96,Other,True,Co1.25Nb75Rh23.75,Co-Nb-Rh,3,Supercon,Nb3Rh0.95Co0.05,MP-mp-1545,Nb6Rh2,Nb-Rh,Nb75Rh25,P m -3 n,cubic,5.186072,5.186072,5.186072,data/final/MP/cifs/Co0.05Nb3Rh0.95-MP-mp-1545-synth_doped.cif,data/source/MP/raw/cifs/mp-1545.cif,mp-1545,0.0,,2011-05-14 11:20:25,9.086567873234834,10.17188/1191190,"@misc{osti_1191190,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Rh (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191190"",
    place = ""United States"",
    year = ""2015"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700041'}},0.0,5.48706495,520.0,-77.37430008,-9.67178751,{'tags': ['Niobium rhodium (3/1)']},-77.37430008,-9.67178751,-0.2547317625000005,"['xas', 'elasticity', 'bandstructure']",True,"[105216, 645269]",True,2021-05-12 10:56:12.755000,NM,8,8,mp-1545,,Nb3Rh,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Rh_pv'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Rh': 1.0}",GGA,mp-1545,"['mp-942004', 'mp-943019', 'mp-935201', 'mp-1545', 'mp-1433570', 'mp-1700041', 'mp-1786474', 'mp-1591392']",0.00021655,"{'Nb': 6.0, 'Rh': 2.0}",139.48118416938905,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",3.1050783127424102e-06,0.00021655,0,0.0004331,MP,data/source/MP/cleaned/cifs/MP-mp-1545.cif,True,,data/final/MP/graphs/Co0.05Nb3Rh0.95-MP-mp-1545-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba1Ti1O3,1,0.0,1.0,True,Ba1Ti1O3,Ba1Ti1O3,0.0,Oxide,True,Ba20Ti20O60,Ba-Ti-O,3,Supercon,Ba1Ti1O3,MP-mp-5020,Ba1Ti1O3,Ba-Ti-O,Ba20Ti20O60,R 3 m,trigonal,4.08113094,4.08113094,4.08113105,data/final/MP/cifs/Ba1Ti1O3-MP-mp-5020.cif,data/source/MP/raw/cifs/mp-5020.cif,mp-5020,2.6212,,2011-05-12 22:23:25,5.696967707935742,10.17188/1208575,"@misc{osti_1208575,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BaTiO3 (SG:160) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208575"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686852'}},0.0,2.66166275,520.0,-40.05853491,-8.011706982,{'tags': ['Barium titanate']},-40.05853491,-8.011706982,-3.4922378096666664,"['piezo', 'xas', 'bandstructure', 'diel', 'phonons', 'elasticity']",True,"[73631, 73629, 73628, 73634, 186461, 100463, 73636, 73633, 186462, 73632, 186463, 73635, 6102, 100464, 73630]",True,2021-05-12 10:56:20.740000,NM,5,23,mp-5020,oxide,BaTiO3,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ti_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Ti': 1.0, 'O': 3.0}",GGA,mp-5020,"['mp-659003', 'mp-655801', 'mp-654766', 'mp-5020', 'mp-1069345', 'mp-1069380', 'mp-1069329', 'mp-1069662', 'mp-1069671', 'mp-1069910', 'mp-1069684', 'mp-1069886', 'mp-1069881', 'mp-1114764', 'mp-1440648', 'mp-1686852', 'mp-1935554', 'mp-1592290', 'mp-1593444', 'mp-1069678', 'mp-1069906', 'mp-1069374', 'mp-672868']",1.61e-05,"{'Ba': 1.0, 'Ti': 1.0, 'O': 3.0}",67.97032701923261,[],NM,False,160,0,"[0, 0, 0, 0, 0]",2.368680673765835e-07,1.61e-05,0,1.61e-05,MP,data/source/MP/cleaned/cifs/MP-mp-5020.cif,False,,data/final/MP/graphs/Ba1Ti1O3-MP-mp-5020.json,0,True,3m,0,0,0,0,0,0,5,1,0,0,0,1.0,False
B1Li2Pt3,1,0.0,4.0,False,B4Li8Pt12,B4Li8Pt12,2.294,Other,True,B16.667Li33.333Pt50,B-Li-Pt,3,Supercon,Li2Pt3B1,MP-mp-20234,Li8B4Pt12,B-Li-Pt,B16.667Li33.333Pt50,P 43 3 2,cubic,6.84464,6.84464,6.84464,data/final/MP/cifs/B1Li2Pt3-MP-mp-20234.cif,data/source/MP/raw/cifs/mp-20234.cif,mp-20234,0.0,,2014-02-22 21:58:26,12.634205351017416,10.17188/1195368,"@misc{osti_1195368,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Li2BPt3 (SG:212) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195368"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671476'}},0.0,4.76758864,520.0,-128.53533033,-5.35563876375,{'tags': ['Lithium platinum boride (2/3/1)']},-128.53533033,-5.35563876375,-0.5706453247222214,"['xas', 'bandstructure']",True,"[156466, 246448, 84932]",True,2021-05-12 10:56:57.051000,NM,24,8,mp-20234,,Li2BPt3,"{'functional': 'PBE', 'labels': ['Li_sv', 'B', 'Pt'], 'pot_type': 'paw'}","{'Li': 2.0, 'B': 1.0, 'Pt': 3.0}",GGA,mp-20234,"['mp-920353', 'mp-906711', 'mp-921381', 'mp-20234', 'mp-1115994', 'mp-1430060', 'mp-1671476', 'mp-1809887']",0.000293725,"{'Li': 8.0, 'B': 4.0, 'Pt': 12.0}",320.6652014392893,[],NM,False,212,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.6639460556571824e-06,0.000293725,0,0.0011749,MP,data/source/MP/cleaned/cifs/MP-mp-20234.cif,False,,data/final/MP/graphs/B1Li2Pt3-MP-mp-20234.json,0,True,432,4,0,0,0,0,0,0,1,0,0,0,1.0,False
Bi1Pr1,1,0.0,1.0,True,Bi1Pr1,Bi1Pr1,0.0,Heavy_fermion,True,Bi50Pr50,Bi-Pr,2,Supercon,Bi1Pr1,MP-mp-23171,Pr1Bi1,Bi-Pr,Bi50Pr50,F m -3 m,cubic,4.64238088,4.642380879999999,4.642380879999999,data/final/MP/cifs/Bi1Pr1-MP-mp-23171.cif,data/source/MP/raw/cifs/mp-23171.cif,mp-23171,0.0,,2014-02-21 07:23:47,8.212415216537304,10.17188/1199292,"@misc{osti_1199292,
    author = ""Persson, Kristin"",
    title = ""Materials Data on PrBi (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199292"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686466'}},0.0,4.33122811,520.0,-10.57500598,-5.28750299,{'tags': ['Bismuth praseodymium (1/1)']},-10.57500598,-5.28750299,-0.9520362625,"['xas', 'elasticity', 'bandstructure']",True,"[616976, 616968, 58844, 187509]",True,2021-05-12 10:56:16.728000,NM,2,12,mp-23171,,PrBi,"{'functional': 'PBE', 'labels': ['Pr_3', 'Bi'], 'pot_type': 'paw'}","{'Pr': 1.0, 'Bi': 1.0}",GGA,mp-23171,"['mp-928261', 'mp-928746', 'mp-912134', 'mp-23171', 'mp-1061278', 'mp-1061309', 'mp-1061252', 'mp-1440177', 'mp-1686466', 'mp-1801082', 'mp-1588951', 'mp-1061314']",0.0008764,"{'Pr': 1.0, 'Bi': 1.0}",70.74688269432986,[],NM,False,225,0,"[0, 0]",1.2387824970134562e-05,0.0008764,0,0.0008764,MP,data/source/MP/cleaned/cifs/MP-mp-23171.cif,False,,data/final/MP/graphs/Bi1Pr1-MP-mp-23171.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ba2Cu4Pr0.3Y0.7O8,3,0.04,1.0,True,Ba2Cu4Pr0.3Y0.7O8,Ba2Cu4Y1O8,63.66666667,Cuprate,True,Ba13.333Cu26.667Pr2Y4.667O53.333333333333336,Ba-Cu-Pr-Y-O,5,Supercon,Y0.7Pr0.3Ba2Cu4O8,MP-mp-6790,Ba2Y1Cu4O8,Ba-Cu-Y-O,Ba13.333Cu26.667Y6.667O53.333333333333336,C m m m,orthorhombic,3.889922,3.899603999537882,13.88942687,data/final/MP/cifs/Ba2Cu4Pr0.3Y0.7O8-MP-mp-6790-synth_doped.cif,data/source/MP/raw/cifs/mp-6790.cif,mp-6790,0.0,,2011-05-16 03:21:24,5.936250568336678,10.17188/1283441,"@misc{osti_1283441,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Y(CuO2)4 (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1283441"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686864'}},0.0,3.31391536,520.0,-91.58381472,-6.105587648,"{'tags': ['Yttrium barium copper oxide (1/2/4/8)', 'High pressure experimental phase']}",-91.58381472,-6.105587648,-2.0529924817777783,"['xas', 'bandstructure']",True,"[72261, 85273, 74251, 400273, 85277, 85275, 400280, 67632, 85272, 67631, 83920, 66613, 85279, 400277, 75689, 74259, 85278, 85280, 66603, 94265, 400276, 88873, 71417, 75712, 97052, 66605, 72258, 85281, 85274, 400279, 66604, 69698]",True,2021-05-12 10:57:34.594000,NM,15,10,mp-6790,oxide,Ba2Y(CuO2)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-6790,"['mp-1000664', 'mp-6790', 'mp-1007136', 'mp-1237713', 'mp-1440937', 'mp-1686864', 'mp-1834179', 'mp-1011883', 'mp-1590064', 'mp-1590433']",0.0004643,"{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",208.60454115924333,[],NM,False,65,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.225742533790601e-06,0.0004643,0,0.0004643,MP,data/source/MP/cleaned/cifs/MP-mp-6790.cif,True,,data/final/MP/graphs/Ba2Cu4Pr0.3Y0.7O8-MP-mp-6790-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
La2.91Pr0.09Tl1,2,0.0449999999999999,1.0,True,La2.91Pr0.09Tl1,La3Tl1,7.55,Other,True,La72.75Pr2.25Tl25,La-Pr-Tl,3,Supercon,La2.91Pr0.09Tl1,MP-mp-371,La3Tl1,La-Tl,La75Tl25,P m -3 m,cubic,5.080077,5.080077,5.080077,data/final/MP/cifs/La2.91Pr0.09Tl1-MP-mp-371-synth_doped.cif,data/source/MP/raw/cifs/mp-371.cif,mp-371,0.0,,2011-05-13 01:00:39,7.866825897387702,10.17188/1207308,"@misc{osti_1207308,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La3Tl (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207308"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696891'}},0.0,8.20468759,520.0,-18.13168413,-4.5329210325,{'tags': ['Lanthanum thallium (3/1)']},-18.13168413,-4.5329210325,-0.240254917083333,"['xas', 'bandstructure']",True,"[642071, 104732]",True,2021-05-12 10:57:06.958000,NM,4,8,mp-371,,La3Tl,"{'functional': 'PBE', 'labels': ['La', 'Tl_d'], 'pot_type': 'paw'}","{'La': 3.0, 'Tl': 1.0}",GGA,mp-371,"['mp-929022', 'mp-912604', 'mp-929400', 'mp-371', 'mp-1441859', 'mp-1696891', 'mp-1779718', 'mp-1597062']",0.0883015,"{'La': 3.0, 'Tl': 1.0}",131.10247336875844,[],NM,False,221,0,"[0, 0, 0, 0]",0.0006735303898625,0.0883015,0,0.0883015,MP,data/source/MP/cleaned/cifs/MP-mp-371.cif,True,,data/final/MP/graphs/La2.91Pr0.09Tl1-MP-mp-371-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Bi1.85Se3Sr0.15,3,0.0599999999999999,1.0,True,Bi1.85Se3Sr0.15,Bi2Se3,0.0,Other,True,Bi37Se60Sr3,Bi-Se-Sr,3,Supercon,Bi1.85Sr0.15Se3,MP-mp-541837,Bi2Se3,Bi-Se,Bi40Se60,R -3 m,trigonal,4.189766129949006,4.189766129949006,10.42166891,data/final/MP/cifs/Bi1.85Se3Sr0.15-MP-mp-541837-synth_doped.cif,data/source/MP/raw/cifs/mp-541837.cif,mp-541837,0.5434000000000001,,2014-03-04 20:28:07,7.056072307673697,10.17188/1266263,"@misc{osti_1266263,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Bi2Se3 (SG:166) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1266263"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1069458'}},0.0,3.28797875,520.0,-20.19891165,-4.03978233,"{'tags': ['Bismuth selenide', 'Bismuth selenide (2/3)', 'Paraguanajuatite']}",-20.19891165,-4.03978233,-0.6694217194062496,"['diel', 'eos', 'elasticity', 'bandstructure']",True,"[617101, 20385, 617083, 42545, 617072, 165226, 617079]",True,2021-05-12 10:56:22.739000,NM,5,21,mp-541837,,Bi2Se3,"{'functional': 'PBE', 'labels': ['Bi', 'Se'], 'pot_type': 'paw'}","{'Bi': 2.0, 'Se': 3.0}",GGA,mp-541837,"['mp-925855', 'mp-909870', 'mp-924887', 'mp-541837', 'mp-1068960', 'mp-1069018', 'mp-1068982', 'mp-1069440', 'mp-1069448', 'mp-1069458', 'mp-1070734', 'mp-1070756', 'mp-1070785', 'mp-1142301', 'mp-1237221', 'mp-1439862', 'mp-1780759', 'mp-1590342', 'mp-1069459', 'mp-1070776', 'mp-1069013']",0.0031875,"{'Bi': 2.0, 'Se': 3.0}",154.10680097779445,[],NM,False,166,0,"[0, 0, 0, 0, 0]",2.068370753124188e-05,0.0031875,0,0.0031875,MP,data/source/MP/cleaned/cifs/MP-mp-541837.cif,True,,data/final/MP/graphs/Bi1.85Se3Sr0.15-MP-mp-541837-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
B2La1Rh3,3,0.0909090909090909,1.6667222222222222,False,B3.333La1.667Rh5,B4La2Rh5,2.57,Other,True,B33.333La16.667Rh50,B-La-Rh,3,Supercon,La1Rh3B2,MP-mp-14696,La2B4Rh5,B-La-Rh,B36.364La18.182Rh45.455,F m m m,orthorhombic,5.5516199989998425,5.764916459987974,6.329541477851993,data/final/MP/cifs/B2La1Rh3-MP-mp-14696-synth_doped.cif,data/source/MP/raw/cifs/mp-14696.cif,mp-14696,0.0,,2011-06-02 23:45:52,8.695807359690793,10.17188/1190839,"@misc{osti_1190839,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La2B4Rh5 (SG:69) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1190839"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697108'}},0.0,8.38262037,520.0,-80.95305827,-7.359368933636364,{'tags': ['Lanthanum rhodium boride (2/5/4)']},-80.95305827,-7.359368933636364,-0.6856306933333333,"['xas', 'bandstructure']",True,[68539],True,2021-05-12 10:56:53.126000,NM,11,7,mp-14696,,La2B4Rh5,"{'functional': 'PBE', 'labels': ['La', 'B', 'Rh_pv'], 'pot_type': 'paw'}","{'La': 2.0, 'B': 4.0, 'Rh': 5.0}",GGA,mp-14696,"['mp-1007617', 'mp-1001283', 'mp-14696', 'mp-1428265', 'mp-1697108', 'mp-1928471', 'mp-1600597']",0.0012611,"{'La': 2.0, 'B': 4.0, 'Rh': 5.0}",159.56164017808783,[],NM,False,69,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",7.903528683914742e-06,0.0012611,0,0.0012611,MP,data/source/MP/cleaned/cifs/MP-mp-14696.cif,True,,data/final/MP/graphs/B2La1Rh3-MP-mp-14696-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,0,0,1,1.0,False
La2Sb1,1,0.0,2.0,False,La4Sb2,La4Sb2,3.025,Other,True,La66.667Sb33.333,La-Sb,2,Supercon,La2Sb1,MP-mp-759,La4Sb2,La-Sb,La66.667Sb33.333,I 4/m m m,tetragonal,4.647241998343835,4.647241998343835,9.72232581,data/final/MP/cifs/La2Sb1-MP-mp-759.cif,data/source/MP/raw/cifs/mp-759.cif,mp-759,0.0,,2011-05-13 05:50:43,6.715128694992242,10.17188/1291326,"@misc{osti_1291326,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La2Sb (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1291326"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703797'}},0.0,8.1627315,520.0,-33.45254763,-5.575424604999999,"{'tags': ['Dilanthanum antimonide', 'Lanthanum antimonide (2/1)', 'Antimony lanthanum (1:2)']}",-33.45254763,-5.575424604999999,-0.9724194549999996,['bandstructure'],True,"[10442, 641900, 42733, 423290]",True,2021-05-12 10:59:01.620000,NM,6,9,mp-759,,La2Sb,"{'functional': 'PBE', 'labels': ['La', 'Sb'], 'pot_type': 'paw'}","{'La': 2.0, 'Sb': 1.0}",GGA,mp-759,"['mp-922574', 'mp-917382', 'mp-759', 'mp-923364', 'mp-1077037', 'mp-1431869', 'mp-1703797', 'mp-1834957', 'mp-1590296']",0.1891425,"{'La': 4.0, 'Sb': 2.0}",197.614427328217,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",0.0019142580079525,0.1891425,0,0.378285,MP,data/source/MP/cleaned/cifs/MP-mp-759.cif,False,,data/final/MP/graphs/La2Sb1-MP-mp-759.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Fe0.15Hf1V1.85,3,0.0999999999999999,2.0,False,Fe0.3Hf2V3.7,Hf2V4,7.04,Other,True,Fe5Hf33.333V61.667,Fe-Hf-V,3,Supercon,Hf1V1.85Fe0.15,MP-mp-1077017,Hf2V4,Hf-V,Hf33.333V66.667,I 41/a m d,tetragonal,5.147745850539648,5.14774585,5.14774585,data/final/MP/cifs/Fe0.15Hf1V1.85-MP-mp-1077017-synth_doped.cif,data/source/MP/raw/cifs/mp-1077017.cif,mp-1077017,0.0,,2018-04-07 18:44:03,9.47163160017764,,,{'GGA': {'task_id': 'mp-1759109'}},0.0337706083333326,5.06389256,520.0,-56.04737833,-9.341229721666666,{'tags': ['Hafnium vanadium (1/2)']},-56.04737833,-9.341229721666666,0.033770608333332,['bandstructure'],True,[187951],True,2021-05-12 10:58:14.654000,NM,6,5,mp-1077017,,HfV2,"{'functional': 'PBE', 'labels': ['Hf_pv', 'V_pv'], 'pot_type': 'paw'}","{'Hf': 1.0, 'V': 2.0}",GGA,mp-1077017,"['mp-1077017', 'mp-1391381', 'mp-1759109', 'mp-1796366', 'mp-1627385']",0.03458425,"{'Hf': 2.0, 'V': 4.0}",98.30836742237948,[],NM,False,141,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0007035871087434,0.03458425,0,0.0691685,MP,data/source/MP/cleaned/cifs/MP-mp-1077017.cif,True,,data/final/MP/graphs/Fe0.15Hf1V1.85-MP-mp-1077017-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As2Ti1,1,0.0,8.0,False,As16Ti8,As16Ti8,0.0,Other,True,As66.667Ti33.333,As-Ti,2,Supercon,As2Ti1,MP-mp-604647,Ti8As16,As-Ti,As66.667Ti33.333,P n n m,orthorhombic,3.515977,8.977783,13.314097,data/final/MP/cifs/As2Ti1-MP-mp-604647.cif,data/source/MP/raw/cifs/mp-604647.cif,mp-604647,0.0,,2014-02-14 12:48:49,6.249443036076458,10.17188/1277395,"@misc{osti_1277395,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TiAs2 (SG:58) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277395"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1675510'}},0.0,6.86025531,520.0,-152.97337888,-6.373890786666667,{'tags': ['Titanium arsenide (1/2)']},-152.97337888,-6.373890786666667,-0.6359811777777781,['bandstructure'],True,"[611500, 20488]",True,2021-05-12 10:58:51.532000,NM,24,11,mp-604647,,TiAs2,"{'functional': 'PBE', 'labels': ['Ti_pv', 'As'], 'pot_type': 'paw'}","{'Ti': 1.0, 'As': 2.0}",GGA,mp-604647,"['mp-919027', 'mp-920109', 'mp-906202', 'mp-604647', 'mp-1179304', 'mp-1191436', 'mp-1237665', 'mp-1416027', 'mp-1675510', 'mp-1817275', 'mp-1610472']",0.0003538625,"{'Ti': 8.0, 'As': 16.0}",420.2685059389445,[],NM,False,58,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.735931815007965e-06,0.0003538625,0,0.0028309,MP,data/source/MP/cleaned/cifs/MP-mp-604647.cif,False,,data/final/MP/graphs/As2Ti1-MP-mp-604647.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Bi2S2O1,1,0.0,2.0,False,Bi4S4O2,Bi4S4O2,0.0,Oxide,True,Bi40S40O20,Bi-S-O,3,Supercon,Bi2S2O1,MP-mp-1078366,Bi4S4O2,Bi-S-O,Bi40S40O20,P 4/n m m,tetragonal,3.978733,3.978733,14.232676,data/final/MP/cifs/Bi2S2O1-MP-mp-1078366.cif,data/source/MP/raw/cifs/mp-1078366.cif,mp-1078366,1.1660999999999992,,2018-04-11 09:14:16,7.341941760049853,,,{'GGA': {'task_id': 'mp-1696674'}},0.0,4.62383276,700.0,-48.62854824,-4.862854824,{'tags': []},-48.62854824,-4.862854824,-1.0012689522500005,"['diel', 'bandstructure']",True,[196230],True,2021-05-12 10:56:43.348000,NM,10,7,mp-1078366,oxide,Bi2S2O,"{'functional': 'PBE', 'labels': ['Bi', 'S', 'O'], 'pot_type': 'paw'}","{'Bi': 2.0, 'S': 2.0, 'O': 1.0}",GGA,mp-1078366,"['mp-1078366', 'mp-1417642', 'mp-1540066', 'mp-1539562', 'mp-1696674', 'mp-1877541', 'mp-1608391']",9.01e-05,"{'Bi': 4.0, 'S': 4.0, 'O': 2.0}",225.30776266604192,[],NM,False,129,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",7.997949021716485e-07,9.01e-05,0,0.0001802,MP,data/source/MP/cleaned/cifs/MP-mp-1078366.cif,False,,data/final/MP/graphs/Bi2S2O1-MP-mp-1078366.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Nd1Pt2Si2,1,0.0,2.0,False,Nd2Pt4Si4,Nd2Pt4Si4,0.0,Other,True,Nd20Pt40Si40,Nd-Pt-Si,3,Supercon,Nd1Pt2Si2,MP-mp-1084815,Nd2Si4Pt4,Nd-Pt-Si,Nd20Pt40Si40,P 4/n m m,tetragonal,4.268673,4.268673,9.884233,data/final/MP/cifs/Nd1Pt2Si2-MP-mp-1084815.cif,data/source/MP/raw/cifs/mp-1084815.cif,mp-1084815,0.0,,2018-04-25 13:22:47,10.890048534518115,,,{'GGA': {'task_id': 'mp-1696467'}},0.0,7.2827142,520.0,-66.57480494,-6.6574804940000005,{'tags': ['Neodymium platinum silicide (1/2/2)']},-66.57480494,-6.6574804940000005,-1.0769631599999996,['bandstructure'],True,[645746],True,2021-05-12 10:58:18.470000,NM,10,6,mp-1084815,,Nd(SiPt)2,"{'functional': 'PBE', 'labels': ['Nd_3', 'Si', 'Pt'], 'pot_type': 'paw'}","{'Nd': 1.0, 'Si': 2.0, 'Pt': 2.0}",GGA,mp-1084815,"['mp-1084815', 'mp-1264495', 'mp-1414501', 'mp-1696467', 'mp-1831796', 'mp-1601314']",0.0374389,"{'Nd': 2.0, 'Si': 4.0, 'Pt': 4.0}",180.10623540992137,[],NM,False,129,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0004157424079714,0.0374389,0,0.0748778,MP,data/source/MP/cleaned/cifs/MP-mp-1084815.cif,False,,data/final/MP/graphs/Nd1Pt2Si2-MP-mp-1084815.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Al0.9Nb3Sb0.1,2,0.0499999999999999,2.0,False,Al1.8Nb6Sb0.2,Al2Nb6,18.06,Other,True,Al22.5Nb75Sb2.5,Al-Nb-Sb,3,Supercon,Al0.9Nb3Sb0.1,MP-mp-796,Nb6Al2,Al-Nb,Al25Nb75,P m -3 n,cubic,5.215254,5.215254,5.215254,data/final/MP/cifs/Al0.9Nb3Sb0.1-MP-mp-796-synth_doped.cif,data/source/MP/raw/cifs/mp-796.cif,mp-796,0.0,,2011-05-13 16:07:37,7.157298025966356,,,{'GGA': {'task_id': 'mp-1686893'}},0.0460773865000003,5.52947534,520.0,-69.48918494,-8.6861481175,"{'tags': ['Aluminium niobium (1/3)', 'Niobium aluminide (3/1)', 'Aluminum niobium (1/3)']}",-69.48918494,-8.6861481175,-0.1737753800000003,"['bandstructure', 'elasticity']",True,"[608675, 608654, 608688, 608668, 608669, 608685, 608676, 608683, 58014, 608657, 107856, 608655, 608666, 608691, 608656, 608665, 608673, 608653, 608661]",True,2021-05-12 10:56:31.128000,NM,8,10,mp-796,,Nb3Al,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Al': 1.0}",GGA,mp-796,"['mp-911586', 'mp-927906', 'mp-796', 'mp-927472', 'mp-1260512', 'mp-1440919', 'mp-1686893', 'mp-1927652', 'mp-1591599', 'mp-1587739']",0.16323955,"{'Nb': 6.0, 'Al': 2.0}",141.8490379078192,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0023015954483396,0.16323955,0,0.3264791,MP,data/source/MP/cleaned/cifs/MP-mp-796.cif,True,,data/final/MP/graphs/Al0.9Nb3Sb0.1-MP-mp-796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
As1Co0.075Fe0.925Pr1O1,2,0.0374999999999999,2.0,False,As2Co0.15Fe1.85Pr2O2,As2Fe2Pr2O2,15.03333333,Ferrite,True,As25Co1.875Fe23.125Pr25O25,As-Co-Fe-Pr-O,5,Supercon,Pr1Fe0.925Co0.075As1O1,MP-mp-22491,Pr2Fe2As2O2,As-Fe-Pr-O,As25Fe25Pr25O25,P 4/n m m,tetragonal,4.094889,4.094889,9.258722,data/final/MP/cifs/As1Co0.075Fe0.925Pr1O1-MP-mp-22491-synth_doped.cif,data/source/MP/raw/cifs/mp-22491.cif,mp-22491,0.0,,2014-02-25 19:17:30,6.153806906111091,,,{'GGA+U': {'task_id': 'mp-1695715'}},0.3808778432291664,4.12348168,520.0,-51.7633941,-6.4704242625,{'tags': ['Praseodymium iron arsenic oxide (1/1/1/1)']},-51.7633941,-6.4704242625,-1.491677511249999,"['xas', 'bandstructure']",True,"[162830, 162833, 246832, 90316, 422000, 236649, 236648, 602491]",True,2021-05-12 10:57:10.838000,FM,8,8,mp-22491,oxide,PrFeAsO,"{'functional': 'PBE', 'labels': ['Pr_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Pr': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-22491,"['mp-510622', 'mp-1079608', 'mp-1079857', 'mp-22491', 'mp-1476145', 'mp-1695715', 'mp-1778524', 'mp-1596397']",3.7947681,"{'Pr': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",155.25132378854377,[],FM,True,129,1,"[0.0, 0.0, 3.5, 3.5, 0.0, 0.0, 0.0, 0.0]",0.0488854846116297,3.7947681,2,7.5895362,MP,data/source/MP/cleaned/cifs/MP-mp-22491.cif,True,,data/final/MP/graphs/As1Co0.075Fe0.925Pr1O1-MP-mp-22491-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Cu1La1.888Sr0.112O4,2,0.032,1.0,True,Cu1La1.888Sr0.112O4,Cu1La2O4,27.0,Cuprate,True,Cu14.286La26.971Sr1.6O57.142857142857146,Cu-La-Sr-O,4,Supercon,La1.888Sr0.112Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La1.888Sr0.112O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La1.888Sr0.112O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Co0.9Cu0.1La0.95Sr1.05O4,2,0.0428571428571428,1.0,True,Co0.9Cu0.1La0.95Sr1.05O4,Co1La1Sr1O4,0.0,Cuprate,True,Co12.857Cu1.429La13.571Sr15O57.142857142857146,Co-Cu-La-Sr-O,5,Supercon,La0.95Sr1.05Cu0.1Co0.9O4,MP-mp-1274783,Sr2La2Co2O8,Co-La-Sr-O,Co14.286La14.286Sr14.286O57.142857142857146,I 4 m m,tetragonal,3.852036030794024,3.8600340037132814,6.94756368,data/final/MP/cifs/Co0.9Cu0.1La0.95Sr1.05O4-MP-mp-1274783-synth_doped.cif,data/source/MP/raw/cifs/mp-1274783.cif,mp-1274783,1.3403,,2020-04-24 07:30:05.603000,6.106618071253213,,,,0.0,4.72378166,520.0,-97.02944627,-6.930674733571428,{'tags': []},-97.02944627,-6.930674733571428,-2.767865823095238,[],False,[],True,2021-05-12 11:01:17.921000,AFM,14,6,mp-1274783,oxide,SrLaCoO4,"{'functional': 'PBE', 'labels': ['Sr_sv', 'La', 'Co', 'O'], 'pot_type': 'paw'}","{'Sr': 1.0, 'La': 1.0, 'Co': 1.0, 'O': 4.0}",GGA+U,mp-1274783,"['mp-1274783', 'mp-1286058', 'mp-1277199', 'mp-1283017', 'mp-1286562', 'mp-1274449']",3e-07,"{'Sr': 2.0, 'La': 2.0, 'Co': 2.0, 'O': 8.0}",190.05144036510364,[],AFM,True,5,1,"[0.0, 0.0, 0.0, 0.0, -2.9, 2.9, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",3.157040003734532e-09,3e-07,2,6e-07,MP,data/source/MP/cleaned/cifs/MP-mp-1274783.cif,True,,data/final/MP/graphs/Co0.9Cu0.1La0.95Sr1.05O4-MP-mp-1274783-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,0,0,1,0,1.0,False
Fe1Se0.4Te0.4,3,0.111111111111111,2.0,False,Fe2Se0.8Te0.8,Fe2Se1Te1,14.4,Ferrite,True,Fe55.556Se22.222Te22.222,Fe-Se-Te,3,Supercon,Fe1Te0.4Se0.4,MP-mp-1225136,Fe2Te1Se1,Fe-Se-Te,Fe50Se25Te25,P 4 m m,tetragonal,3.755398,3.755398,5.937717,data/final/MP/cifs/Fe1Se0.4Te0.4-MP-mp-1225136-synth_doped.cif,data/source/MP/raw/cifs/mp-1225136.cif,mp-1225136,0.0,,2019-01-13 01:17:25.998000,6.310824077785493,,,{'GGA': {'task_id': 'mp-1764167'}},0.0802741556250001,4.86336573,520.0,-24.0729629,-6.018240725,{'tags': []},-24.0729629,-6.018240725,-0.3469333980859375,['bandstructure'],True,[],True,2021-05-12 10:58:45.495000,FM,4,5,mp-1225136,,Fe2TeSe,"{'functional': 'PBE', 'labels': ['Fe_pv', 'Te', 'Se'], 'pot_type': 'paw'}","{'Fe': 2.0, 'Te': 1.0, 'Se': 1.0}",GGA,mp-1225136,"['mp-1225136', 'mp-1425562', 'mp-1764167', 'mp-1784460', 'mp-1615275']",0.1061773,"{'Fe': 2.0, 'Te': 1.0, 'Se': 1.0}",83.73970680084179,[],FM,True,99,1,"[0.1, 0.1, -0.0, -0.0]",0.0012679444920021,0.1061773,2,0.1061773,MP,data/source/MP/cleaned/cifs/MP-mp-1225136.cif,True,,data/final/MP/graphs/Fe1Se0.4Te0.4-MP-mp-1225136-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
Ni16Si7Ta6,1,0.0,1.0,True,Ni16Si7Ta6,Ni16Si7Ta6,0.0,Other,True,Ni55.172Si24.138Ta20.69,Ni-Si-Ta,3,Supercon,Ta6Ni16Si7,MP-mp-4502,Ta6Si7Ni16,Ni-Si-Ta,Ni55.172Si24.138Ta20.69,F m -3 m,cubic,7.94259248,7.942592479999999,7.942592479999999,data/final/MP/cifs/Ni16Si7Ta6-MP-mp-4502.cif,data/source/MP/raw/cifs/mp-4502.cif,mp-4502,0.0,,2011-05-25 07:04:51,10.41118461885354,10.17188/1208216,"@misc{osti_1208216,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ta6Si7Ni16 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208216"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1767937'}},0.0,8.98408928,520.0,-219.12272387,-7.555955995517241,{'tags': ['Nickel tantalum silicide (16/6/7)']},-219.12272387,-7.555955995517241,-0.6040232093103447,"['xas', 'bandstructure']",True,"[109219, 159265, 646603, 646599]",True,2021-05-12 10:57:08.928000,NM,29,7,mp-4502,,Ta6Si7Ni16,"{'functional': 'PBE', 'labels': ['Ta_pv', 'Si', 'Ni_pv'], 'pot_type': 'paw'}","{'Ta': 6.0, 'Si': 7.0, 'Ni': 16.0}",GGA,mp-4502,"['mp-4502', 'mp-1155991', 'mp-1261876', 'mp-1331856', 'mp-1767937', 'mp-1838349', 'mp-1630419']",0.0633871,"{'Ta': 6.0, 'Si': 7.0, 'Ni': 16.0}",354.30056287553674,[],NM,False,225,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0001789077033509,0.0633871,0,0.0633871,MP,data/source/MP/cleaned/cifs/MP-mp-4502.cif,False,,data/final/MP/graphs/Ni16Si7Ta6-MP-mp-4502.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Os3.8Pr1Ru0.2Sb12,3,0.0235294117647058,1.0,True,Os3.8Pr1Ru0.2Sb12,Os4Pr1Sb12,1.655,Heavy_fermion,True,Os22.353Pr5.882Ru1.176Sb70.588,Os-Pr-Ru-Sb,4,Supercon,Pr1Os3.8Ru0.2Sb12,MP-mp-4251,Pr1Sb12Os4,Os-Pr-Sb,Os23.529Pr5.882Sb70.588,I m -3,cubic,8.16020751180899,8.16020751,8.16020751,data/final/MP/cifs/Os3.8Pr1Ru0.2Sb12-MP-mp-4251-synth_doped.cif,data/source/MP/raw/cifs/mp-4251.cif,mp-4251,0.0,,2011-05-15 09:44:04,9.380402650313032,10.17188/1208003,"@misc{osti_1208003,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Pr(Sb3Os)4 (SG:204) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208003"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700242'}},0.0086126564705901,7.28147826,520.0,-102.089288,-6.005252235294117,{'tags': ['Praseodymium osmium antimonide (1/4/12)']},-102.089288,-6.005252235294117,-0.1677005267647063,"['xas', 'elasticity', 'bandstructure']",True,"[155178, 155187, 165911, 155182, 155185, 155181, 647731, 155183, 155188, 155180, 155179, 165910, 155184, 155186, 183087]",True,2021-05-12 10:56:20.740000,NM,17,9,mp-4251,,Pr(Sb3Os)4,"{'functional': 'PBE', 'labels': ['Pr_3', 'Sb', 'Os_pv'], 'pot_type': 'paw'}","{'Pr': 1.0, 'Sb': 12.0, 'Os': 4.0}",GGA,mp-4251,"['mp-1000443', 'mp-1006919', 'mp-4251', 'mp-1188290', 'mp-1430112', 'mp-1700242', 'mp-1817791', 'mp-1011635', 'mp-1609307']",0.0526026,"{'Pr': 1.0, 'Sb': 12.0, 'Os': 4.0}",418.2940787754696,[],NM,False,204,0,"[-0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.000125755067234,0.0526026,0,0.0526026,MP,data/source/MP/cleaned/cifs/MP-mp-4251.cif,True,,data/final/MP/graphs/Os3.8Pr1Ru0.2Sb12-MP-mp-4251-synth_doped.json,0,True,m-3,2,0,0,0,0,0,0,0,0,1,0,1.0,False
Ba0.95Na0.05Sb2Ti2O1,2,0.0166666666666666,1.0,True,Ba0.95Na0.05Sb2Ti2O1,Ba1Sb2Ti2O1,3.14,Oxide,True,Ba15.833Na0.833Sb33.333Ti33.333O16.666666666666668,Ba-Na-Sb-Ti-O,5,Supercon,Ba0.95Na0.05Ti2Sb2O1,MP-mp-1070806,Ba1Ti2Sb2O1,Ba-Sb-Ti-O,Ba16.667Sb33.333Ti33.333O16.666666666666668,P 4/m m m,tetragonal,4.113474,4.113474,8.312382,data/final/MP/cifs/Ba0.95Na0.05Sb2Ti2O1-MP-mp-1070806-synth_doped.cif,data/source/MP/raw/cifs/mp-1070806.cif,mp-1070806,0.0,,2018-03-22 04:02:04,5.8154485533321445,,,{'GGA': {'task_id': 'mp-1702174'}},0.0,5.89751533,520.0,-39.14932631,-6.524887718333333,{'tags': []},-39.14932631,-6.524887718333333,-1.5507346602777776,['bandstructure'],True,"[430061, 237789, 430060]",True,2021-05-12 10:58:14.654000,NM,6,16,mp-1070806,oxide,BaTi2Sb2O,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ti_pv', 'Sb', 'O'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Ti': 2.0, 'Sb': 2.0, 'O': 1.0}",GGA,mp-1070806,"['mp-1071055', 'mp-1071068', 'mp-1071083', 'mp-1071088', 'mp-1070806', 'mp-1071124', 'mp-1070846', 'mp-1070900', 'mp-1071137', 'mp-1423542', 'mp-1702174', 'mp-1785425', 'mp-1588663', 'mp-1070899', 'mp-1071129', 'mp-1071119']",0.001055,"{'Ba': 1.0, 'Ti': 2.0, 'Sb': 2.0, 'O': 1.0}",140.65105900950408,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0]",7.500832254158225e-06,0.001055,0,0.001055,MP,data/source/MP/cleaned/cifs/MP-mp-1070806.cif,True,,data/final/MP/graphs/Ba0.95Na0.05Sb2Ti2O1-MP-mp-1070806-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Pd2Si2Th1,1,0.0,1.0,True,Pd2Si2Th1,Pd2Si2Th1,1.1,Other,True,Pd40Si40Th20,Pd-Si-Th,3,Supercon,Th1Pd2Si2,MP-mp-5508,Th1Si2Pd2,Pd-Si-Th,Pd40Si40Th20,I 4/m m m,tetragonal,4.221529997696317,4.221529997696318,5.881359219999999,data/final/MP/cifs/Pd2Si2Th1-MP-mp-5508.cif,data/source/MP/raw/cifs/mp-5508.cif,mp-5508,0.0,,2011-05-12 23:42:53,9.212857952036954,10.17188/1267440,"@misc{osti_1267440,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Th(SiPd)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1267440"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698996'}},0.0,7.8237001,520.0,-33.37696216,-6.675392432,{'tags': ['Palladium thorium silicide (2/1/2)']},-33.37696216,-6.675392432,-0.9221424499999984,"['bandstructure', 'elasticity']",True,"[77899, 648876]",True,2021-05-12 10:56:22.739000,NM,5,10,mp-5508,,Th(SiPd)2,"{'functional': 'PBE', 'labels': ['Th', 'Si', 'Pd'], 'pot_type': 'paw'}","{'Th': 1.0, 'Si': 2.0, 'Pd': 2.0}",GGA,mp-5508,"['mp-911239', 'mp-927261', 'mp-927701', 'mp-5508', 'mp-1143659', 'mp-1248645', 'mp-1441051', 'mp-1698996', 'mp-1798231', 'mp-1589589']",2.89e-05,"{'Th': 1.0, 'Si': 2.0, 'Pd': 2.0}",90.30981946587492,[],NM,False,139,0,"[0, 0, 0, 0, 0]",3.2000949809140465e-07,2.89e-05,0,2.89e-05,MP,data/source/MP/cleaned/cifs/MP-mp-5508.cif,False,,data/final/MP/graphs/Pd2Si2Th1-MP-mp-5508.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Sn0.21W1O3,3,0.0540836835373653,6.0,False,Sn1.26W6O18,Sn2W6O18,0.0,Oxide,True,Sn4.988W23.753O71.25890736342043,Sn-W-O,3,Supercon,O3Sn0.21W1,MP-mp-761454,Sn2W6O18,Sn-W-O,Sn7.692W23.077O69.23076923076923,P 1 21/m 1,monoclinic,7.593798,7.719576,7.6054462,data/final/MP/cifs/Sn0.21W1O3-MP-mp-761454-synth_doped.cif,data/source/MP/raw/cifs/mp-761454.cif,mp-761454,0.0,,2014-05-30 01:50:27,6.986162289122346,10.17188/1291980,"@misc{osti_1291980,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sn(WO3)3 (SG:11) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1291980"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-879451'}},0.0539727978402311,3.4765874,520.0,-189.01188875,-7.269688028846153,{'tags': []},-189.01188875,-7.269688028846153,-2.0451803126923074,['bandstructure'],True,[],True,2021-05-12 10:59:03.700000,FM,26,7,mp-761454,oxide,Sn(WO3)3,"{'functional': 'PBE', 'labels': ['Sn_d', 'W_pv', 'O'], 'pot_type': 'paw'}","{'Sn': 1.0, 'W': 3.0, 'O': 9.0}",GGA+U,mp-761454,"['mp-879175', 'mp-761454', 'mp-879451', 'mp-1101370', 'mp-1373037', 'mp-1842147', 'mp-889771']",1.6285168,"{'Sn': 2.0, 'W': 6.0, 'O': 18.0}",387.065659608836,[],FM,True,11,3,"[-0.0, -0.0, 0.2, 0.2, 0.5, 0.5, 1.0, 1.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0084146798331102,1.6285168,6,3.2570336,MP,data/source/MP/cleaned/cifs/MP-mp-761454.cif,True,,data/final/MP/graphs/Sn0.21W1O3-MP-mp-761454-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,1,0,0,0,1.0,False
Ca4Pb19Rh6,1,0.0,1.0,True,Ca4Pb19Rh6,Ca4Pb19Rh6,3.3,Other,True,Ca13.793Pb65.517Rh20.69,Ca-Pb-Rh,3,Supercon,Ca4Rh6Pb19,MP-mp-1214426,Ca4Rh6Pb19,Ca-Pb-Rh,Ca13.793Pb65.517Rh20.69,I 2 3,cubic,10.431463052312491,10.43146305,10.43146305,data/final/MP/cifs/Ca4Pb19Rh6-MP-mp-1214426.cif,data/source/MP/raw/cifs/mp-1214426.cif,mp-1214426,0.0,,2019-01-12 16:16:20.884000,8.959321091104492,,,,0.1938925949529784,5.37434399,520.0,-122.82284883,-4.235270649310345,"{'tags': ['Ca4Rh6Pb19', 'La4Re6O19']}",-122.82284883,-4.235270649310345,-0.0025623365517245,[],False,[],True,2021-05-12 11:00:35.508000,NM,29,3,mp-1214426,,Ca4Rh6Pb19,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Rh_pv', 'Pb_d'], 'pot_type': 'paw'}","{'Ca': 4.0, 'Rh': 6.0, 'Pb': 19.0}",GGA,mp-1214426,"['mp-1214426', 'mp-1362160', 'mp-1919755']",0.0018951,"{'Ca': 4.0, 'Rh': 6.0, 'Pb': 19.0}",873.8035029815622,[],NM,False,197,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.168794235241224e-06,0.0018951,0,0.0018951,MP,data/source/MP/cleaned/cifs/MP-mp-1214426.cif,False,,data/final/MP/graphs/Ca4Pb19Rh6-MP-mp-1214426.json,0,True,23,1,0,0,0,0,0,0,0,0,1,0,1.0,False
C1Mg1Ni2.9Ru0.1,2,0.04,1.0,True,C1Mg1Ni2.9Ru0.1,C1Mg1Ni3,4.72,Other,True,C20Mg20Ni58Ru2,C-Mg-Ni-Ru,4,Supercon,Mg1C1Ni2.9Ru0.1,MP-mp-10700,Mg1Ni3C1,C-Mg-Ni,C20Mg20Ni60,P m -3 m,cubic,3.810209,3.810209,3.810209,data/final/MP/cifs/C1Mg1Ni2.9Ru0.1-MP-mp-10700-synth_doped.cif,data/source/MP/raw/cifs/mp-10700.cif,mp-10700,0.0,,2011-05-28 10:04:44,6.376007671789427,10.17188/1187303,"@misc{osti_1187303,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MgNi3C (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187303"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678621'}},0.0,6.64260176,520.0,-28.85099542,-5.770199084,{'tags': ['Magnesium nickel carbide (1/3/1)']},-28.85099542,-5.770199084,-0.1367049259999994,"['xas', 'elasticity', 'bandstructure']",True,[77152],True,2021-05-12 10:56:10.715000,NM,5,8,mp-10700,,MgNi3C,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Ni_pv', 'C'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",GGA,mp-10700,"['mp-927245', 'mp-927653', 'mp-911184', 'mp-10700', 'mp-1438083', 'mp-1678621', 'mp-1791467', 'mp-1591421']",0.0387875,"{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",55.31544309398296,[],NM,False,221,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",0.0007012056277683,0.0387875,0,0.0387875,MP,data/source/MP/cleaned/cifs/MP-mp-10700.cif,True,,data/final/MP/graphs/C1Mg1Ni2.9Ru0.1-MP-mp-10700-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Al0.95Be0.05Nb3,2,0.025,2.0,False,Al1.9Be0.1Nb6,Al2Nb6,19.700000000000003,Other,True,Al23.75Be1.25Nb75,Al-Be-Nb,3,Supercon,Al0.95Be0.05Nb3,MP-mp-796,Nb6Al2,Al-Nb,Al25Nb75,P m -3 n,cubic,5.215254,5.215254,5.215254,data/final/MP/cifs/Al0.95Be0.05Nb3-MP-mp-796-synth_doped.cif,data/source/MP/raw/cifs/mp-796.cif,mp-796,0.0,,2011-05-13 16:07:37,7.157298025966356,,,{'GGA': {'task_id': 'mp-1686893'}},0.0460773865000003,5.52947534,520.0,-69.48918494,-8.6861481175,"{'tags': ['Aluminium niobium (1/3)', 'Niobium aluminide (3/1)', 'Aluminum niobium (1/3)']}",-69.48918494,-8.6861481175,-0.1737753800000003,"['bandstructure', 'elasticity']",True,"[608675, 608654, 608688, 608668, 608669, 608685, 608676, 608683, 58014, 608657, 107856, 608655, 608666, 608691, 608656, 608665, 608673, 608653, 608661]",True,2021-05-12 10:56:31.128000,NM,8,10,mp-796,,Nb3Al,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Al': 1.0}",GGA,mp-796,"['mp-911586', 'mp-927906', 'mp-796', 'mp-927472', 'mp-1260512', 'mp-1440919', 'mp-1686893', 'mp-1927652', 'mp-1591599', 'mp-1587739']",0.16323955,"{'Nb': 6.0, 'Al': 2.0}",141.8490379078192,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0023015954483396,0.16323955,0,0.3264791,MP,data/source/MP/cleaned/cifs/MP-mp-796.cif,True,,data/final/MP/graphs/Al0.95Be0.05Nb3-MP-mp-796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ce1Cu2Ge0.12Si1.88,2,0.048,1.0,True,Ce1Cu2Ge0.12Si1.88,Ce1Cu2Si2,0.2,Heavy_fermion,True,Ce20Cu40Ge2.4Si37.6,Ce-Cu-Ge-Si,4,Supercon,Ce1Cu2Si1.88Ge0.12,MP-mp-5452,Ce1Cu2Si2,Ce-Cu-Si,Ce20Cu40Si40,I 4/m m m,tetragonal,4.075731996715381,4.075731996715381,5.70132195,data/final/MP/cifs/Ce1Cu2Ge0.12Si1.88-MP-mp-5452-synth_doped.cif,data/source/MP/raw/cifs/mp-5452.cif,mp-5452,0.0,,2011-05-13 06:29:11,6.571257460055593,10.17188/1266988,"@misc{osti_1266988,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ce(SiCu)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1266988"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668622'}},0.0,8.51519913,520.0,-27.86039596,-5.572079192,"{'tags': ['Cerium copper silicon (1/2/2)', 'Cerium copper silicide (1/2/2)']}",-27.86039596,-5.572079192,-0.5472530850000006,"['xas', 'elasticity', 'bandstructure']",True,"[620924, 620948, 102140, 620940, 620921, 620914, 164068, 620946, 620920, 620949, 102141, 620930, 620939, 620931, 620951, 620944, 657643, 657672, 620943, 55797, 52851]",True,2021-05-12 10:56:22.739000,NM,5,9,mp-5452,,Ce(CuSi)2,"{'functional': 'PBE', 'labels': ['Ce', 'Cu_pv', 'Si'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Cu': 2.0, 'Si': 2.0}",GGA,mp-5452,"['mp-5452', 'mp-1097881', 'mp-1156698', 'mp-1248439', 'mp-1440927', 'mp-1668622', 'mp-1798875', 'mp-1594230', 'mp-1595235']",0.01041,"{'Ce': 1.0, 'Cu': 2.0, 'Si': 2.0}",81.71700258012696,[],NM,False,139,0,"[-0.0, 0.0, 0.0, 0.0, 0.0]",0.0001273908693578,0.01041,0,0.01041,MP,data/source/MP/cleaned/cifs/MP-mp-5452.cif,True,,data/final/MP/graphs/Ce1Cu2Ge0.12Si1.88-MP-mp-5452-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B0.05P0.95Ru1Zr1,2,0.0333333333333333,4.0,False,B0.2P3.8Ru4Zr4,P4Ru4Zr4,8.4,Other,True,B1.667P31.667Ru33.333Zr33.333,B-P-Ru-Zr,4,Supercon,Zr1Ru1P0.95B0.05,MP-mp-22268,Zr4P4Ru4,P-Ru-Zr,P33.333Ru33.333Zr33.333,P n m a,orthorhombic,3.896771,6.476559,7.378435,data/final/MP/cifs/B0.05P0.95Ru1Zr1-MP-mp-22268-synth_doped.cif,data/source/MP/raw/cifs/mp-22268.cif,mp-22268,0.0,,2014-02-22 18:40:36,7.963823777103373,10.17188/1197495,"@misc{osti_1197495,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrPRu (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197495"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677547'}},0.0,7.91938263,520.0,-106.40582437,-8.867152030833333,"{'tags': ['Ruthenium zirconium phosphide (1/1/1)', 'Zirconium ruthenium phosphide (1/1/1)']}",-106.40582437,-8.867152030833333,-1.1220211002777785,"['xas', 'elasticity', 'bandstructure']",True,"[648038, 30727]",True,2021-05-12 10:56:16.728000,NM,12,9,mp-22268,,ZrPRu,"{'functional': 'PBE', 'labels': ['Zr_sv', 'P', 'Ru_pv'], 'pot_type': 'paw'}","{'Zr': 1.0, 'P': 1.0, 'Ru': 1.0}",GGA,mp-22268,"['mp-921696', 'mp-907212', 'mp-920689', 'mp-22268', 'mp-1102635', 'mp-1442687', 'mp-1677547', 'mp-1785321', 'mp-1602314']",3.01e-05,"{'Zr': 4.0, 'P': 4.0, 'Ru': 4.0}",186.21448765818843,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.46566233992512e-07,3.01e-05,0,0.0001204,MP,data/source/MP/cleaned/cifs/MP-mp-22268.cif,True,,data/final/MP/graphs/B0.05P0.95Ru1Zr1-MP-mp-22268-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ni1Si1,1,0.0,4.0,False,Ni4Si4,Ni4Si4,0.0,Other,True,Ni50Si50,Ni-Si,2,Supercon,Ni1Si1,MP-mp-351,Si4Ni4,Ni-Si,Ni50Si50,P n m a,orthorhombic,3.350126,5.154628,5.580648,data/final/MP/cifs/Ni1Si1-MP-mp-351.cif,data/source/MP/raw/cifs/mp-351.cif,mp-351,0.0,,2011-05-13 22:49:52,5.981087134916961,10.17188/1206937,"@misc{osti_1206937,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SiNi (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1206937"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686495'}},0.0,9.84323423,520.0,-48.81939111,-6.10242388875,"{'tags': ['Nickel silicide (1/1)', 'Nickel silicide (1/1) - orthorhombic']}",-48.81939111,-6.10242388875,-0.4641985387499998,"['xas', 'elasticity', 'bandstructure']",True,"[164764, 42676, 646558, 95448, 164180, 95449, 164179, 30626, 646577, 646569, 190105]",True,2021-05-12 10:56:20.740000,NM,8,13,mp-351,,SiNi,"{'functional': 'PBE', 'labels': ['Si', 'Ni_pv'], 'pot_type': 'paw'}","{'Si': 1.0, 'Ni': 1.0}",GGA,mp-351,"['mp-917296', 'mp-672387', 'mp-920677', 'mp-921703', 'mp-351', 'mp-1080138', 'mp-1095080', 'mp-1138601', 'mp-1146162', 'mp-1440089', 'mp-1686495', 'mp-1795844', 'mp-1596155']",1.69e-05,"{'Si': 4.0, 'Ni': 4.0}",96.37027540718172,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0]",7.014611062838398e-07,1.69e-05,0,6.76e-05,MP,data/source/MP/cleaned/cifs/MP-mp-351.cif,False,,data/final/MP/graphs/Ni1Si1-MP-mp-351.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
As1Fe0.89Ir0.11Sm1O1,3,0.0549999999999999,2.0,False,As2Fe1.78Ir0.22Sm2O2,As2Fe2Sm2O2,18.3,Ferrite,True,As25Fe22.25Ir2.75Sm25O25,As-Fe-Ir-Sm-O,5,Supercon,Sm1Fe0.89Ir0.11As1O1,MP-mp-20349,Sm2Fe2As2O2,As-Fe-Sm-O,As25Fe25Sm25O25,P 4/n m m,tetragonal,4.026492,4.026492,9.046755,data/final/MP/cifs/As1Fe0.89Ir0.11Sm1O1-MP-mp-20349-synth_doped.cif,data/source/MP/raw/cifs/mp-20349.cif,mp-20349,0.0,,2014-02-19 11:24:42,6.727802583283198,,,{'GGA+U': {'task_id': 'mp-1695938'}},0.3015723809374986,3.77685593,520.0,-52.73407138,-6.5917589225,{'tags': ['Samarium iron arsenic oxide (1/1/1/1)']},-52.73407138,-6.5917589225,-1.6285904237499995,"['xas', 'elasticity', 'bandstructure']",True,"[236652, 236653, 422002, 163457, 163458]",True,2021-05-12 10:56:16.728000,FM,8,10,mp-20349,oxide,SmFeAsO,"{'functional': 'PBE', 'labels': ['Sm_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Sm': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-20349,"['mp-24944', 'mp-1078897', 'mp-1079866', 'mp-1173321', 'mp-20349', 'mp-1425472', 'mp-1695938', 'mp-1772503', 'mp-1789694', 'mp-1588381']",3.75729895,"{'Sm': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",146.67176231613362,[],FM,True,129,1,"[0.0, 0.0, 3.5, 3.5, -0.0, -0.0, -0.0, -0.0]",0.0512341147425717,3.75729895,2,7.5145979,MP,data/source/MP/cleaned/cifs/MP-mp-20349.cif,True,,data/final/MP/graphs/As1Fe0.89Ir0.11Sm1O1-MP-mp-20349-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Cu1La2O4.33,2,0.0385889690118885,0.9239291762894536,True,Cu0.924La1.848O4,Cu1La2O4,0.0,Cuprate,True,Cu13.643La27.285O59.072305593451574,Cu-La-O,3,Supercon,La2Cu1O4.33,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La2O4.33-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La2O4.33-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Hg1K1,1,0.0,4.0,False,Hg4K4,Hg4K4,0.0,Other,True,Hg50K50,Hg-K,2,Supercon,Hg1K1,MP-mp-11462,K4Hg4,Hg-K,Hg50K50,P -1,triclinic,6.729686,7.11472273,7.24289677,data/final/MP/cifs/Hg1K1-MP-mp-11462.cif,data/source/MP/raw/cifs/mp-11462.cif,mp-11462,0.0,,2011-05-30 04:01:10,4.967016325346754,10.17188/1187853,"@misc{osti_1187853,
    author = ""Persson, Kristin"",
    title = ""Materials Data on KHg (SG:2) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187853"",
    place = ""United States"",
    year = ""2015"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704075'}},0.0,1.0252635,520.0,-7.64023635,-0.95502954375,{'tags': ['Mercury potassium (1/1)']},-7.64023635,-0.95502954375,-0.24798988775,['bandstructure'],True,[104302],True,2021-05-12 10:58:22.271000,NM,8,8,mp-11462,,KHg,"{'functional': 'PBE', 'labels': ['K_sv', 'Hg'], 'pot_type': 'paw'}","{'K': 1.0, 'Hg': 1.0}",GGA,mp-11462,"['mp-941847', 'mp-934976', 'mp-941689', 'mp-11462', 'mp-1422240', 'mp-1704075', 'mp-1807389', 'mp-1601879']",2.9625e-05,"{'K': 4.0, 'Hg': 4.0}",320.5238395741773,[],NM,False,2,0,"[0, 0, 0, 0, 0, 0, 0, 0]",3.697072896587965e-07,2.9625e-05,0,0.0001185,MP,data/source/MP/cleaned/cifs/MP-mp-11462.cif,False,,data/final/MP/graphs/Hg1K1-MP-mp-11462.json,0,True,-1,0,0,0,0,0,2,0,1,0,0,0,1.0,False
Ga0.32Si0.68V3,3,0.09,2.0,False,Ga0.64Si1.36V6,Ga1Si1V6,9.4,Other,True,Ga8Si17V75,Ga-Si-V,3,Supercon,V3Si0.68Ga0.32,MP-mp-1216440,V6Ga1Si1,Ga-Si-V,Ga12.5Si12.5V75,P m -3,cubic,4.747019,4.747019,4.747019,data/final/MP/cifs/Ga0.32Si0.68V3-MP-mp-1216440-synth_doped.cif,data/source/MP/raw/cifs/mp-1216440.cif,mp-1216440,0.0,,2019-01-12 17:56:57.356000,6.263022625398905,,,{'GGA': {'task_id': 'mp-1752355'}},0.0012115512499999,6.46444818,520.0,-65.49539593,-8.18692449125,{'tags': []},-65.49539593,-8.18692449125,-0.3084436834374999,['bandstructure'],True,[],True,2021-05-12 10:58:39.488000,FM,8,5,mp-1216440,,V6GaSi,"{'functional': 'PBE', 'labels': ['V_pv', 'Ga_d', 'Si'], 'pot_type': 'paw'}","{'V': 6.0, 'Ga': 1.0, 'Si': 1.0}",GGA,mp-1216440,"['mp-1216440', 'mp-1444194', 'mp-1752355', 'mp-1875781', 'mp-1620045']",2.0268443,"{'V': 6.0, 'Ga': 1.0, 'Si': 1.0}",106.970225166654,[],FM,True,47,1,"[0.2, 0.3, 0.3, 0.2, 0.3, 0.3, 0.0, 0.0]",0.0189477426717788,2.0268443,6,2.0268443,MP,data/source/MP/cleaned/cifs/MP-mp-1216440.cif,True,,data/final/MP/graphs/Ga0.32Si0.68V3-MP-mp-1216440-synth_doped.json,0,True,m-3,2,0,0,0,0,0,0,1,0,0,0,1.0,False
In0.87Te1,3,0.0695187165775401,1.0,True,In0.87Te1,In1Te1,1.55,Other,True,In46.524Te53.476,In-Te,2,Supercon,In0.87Te1,MP-mp-2597,In1Te1,In-Te,In50Te50,F m -3 m,cubic,4.44363296,4.44363296,4.44363296,data/final/MP/cifs/In0.87Te1-MP-mp-2597-synth_doped.cif,data/source/MP/raw/cifs/mp-2597.cif,mp-2597,0.0,,2011-05-12 18:35:42,6.488053472608879,10.17188/1201088,"@misc{osti_1201088,
    author = ""Persson, Kristin"",
    title = ""Materials Data on InTe (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201088"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668520'}},0.0,6.3140604,520.0,-6.47268679,-3.236343395,"{'tags': ['Indium telluride (1/1)', 'Indium tellurium (1/1) - HP, HT', 'High pressure experimental phase', 'Indium telluride  - II']}",-6.47268679,-3.236343395,-0.4998510649999996,"['xas', 'elasticity', 'bandstructure']",True,"[169425, 44653, 169422, 59547, 169428, 640620, 640614, 169431, 169419, 640622]",True,2021-05-12 10:56:18.721000,NM,2,9,mp-2597,,InTe,"{'functional': 'PBE', 'labels': ['In_d', 'Te'], 'pot_type': 'paw'}","{'In': 1.0, 'Te': 1.0}",GGA,mp-2597,"['mp-1000805', 'mp-1007252', 'mp-2597', 'mp-1440879', 'mp-1668520', 'mp-1793575', 'mp-1011993', 'mp-1588148', 'mp-1589064']",0.0001824,"{'In': 1.0, 'Te': 1.0}",62.04396451824765,[],NM,False,225,0,"[0, 0]",2.939850820563773e-06,0.0001824,0,0.0001824,MP,data/source/MP/cleaned/cifs/MP-mp-2597.cif,True,,data/final/MP/graphs/In0.87Te1-MP-mp-2597-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ge0.5La1Ni2P1.5,1,0.0,2.0,False,Ge1La2Ni4P3,Ge1La2Ni4P3,0.0,Ferrite,True,Ge10La20Ni40P30,Ge-La-Ni-P,4,Supercon,La1Ni2Ge0.5P1.5,MP-mp-1223427,La2Ni4Ge1P3,Ge-La-Ni-P,Ge10La20Ni40P30,P 4 m m,tetragonal,4.026953,4.026953,9.824927,data/final/MP/cifs/Ge0.5La1Ni2P1.5-MP-mp-1223427.cif,data/source/MP/raw/cifs/mp-1223427.cif,mp-1223427,0.0,,2019-01-12 23:49:24.399000,7.067889264062854,,,{'GGA': {'task_id': 'mp-1751167'}},0.0061645285000047,9.37836305,520.0,-63.05289217,-6.305289217,{'tags': []},-63.05289217,-6.305289217,-0.9197395864999998,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,10,5,mp-1223427,,La2Ni4GeP3,"{'functional': 'PBE', 'labels': ['La', 'Ni_pv', 'Ge_d', 'P'], 'pot_type': 'paw'}","{'La': 2.0, 'Ni': 4.0, 'Ge': 1.0, 'P': 3.0}",GGA,mp-1223427,"['mp-1223427', 'mp-1390480', 'mp-1751167', 'mp-1932386', 'mp-1623686']",0.0241477,"{'La': 2.0, 'Ni': 4.0, 'Ge': 1.0, 'P': 3.0}",159.3244595172695,[],NM,False,99,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001515630435726,0.0241477,0,0.0241477,MP,data/source/MP/cleaned/cifs/MP-mp-1223427.cif,False,,data/final/MP/graphs/Ge0.5La1Ni2P1.5-MP-mp-1223427.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
Be13Th0.06U0.94,2,0.0085714285714285,2.0,False,Be26Th0.12U1.88,Be26U2,0.344,Heavy_fermion,True,Be92.857Th0.429U6.714,Be-Th-U,3,Supercon,U0.9397Th0.0603Be13,MP-mp-1163,U2Be26,Be-U,Be92.857U7.143,F m -3 c,cubic,7.174675929999999,7.174675929999999,7.174675929999999,data/final/MP/cifs/Be13Th0.06U0.94-MP-mp-1163-synth_doped.cif,data/source/MP/raw/cifs/mp-1163.cif,mp-1163,0.0,,2011-05-15 13:39:09,4.516943134220159,10.17188/1188115,"@misc{osti_1188115,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UBe13 (SG:226) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188115"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1676276'}},0.0,5.60901004,520.0,-121.44122023,-4.337186436785714,"{'tags': ['Uranium beryllium (1/13)', 'Beryllium uranium (13/1)']}",-121.44122023,-4.337186436785714,-0.0583452042857146,"['xas', 'bandstructure']",True,"[616470, 58748, 616481, 58747, 58749, 659562, 107528, 600563, 58750, 616488, 58751]",True,2021-05-12 10:56:51.169000,NM,28,8,mp-1163,,UBe13,"{'functional': 'PBE', 'labels': ['U', 'Be_sv'], 'pot_type': 'paw'}","{'U': 1.0, 'Be': 13.0}",GGA,mp-1163,"['mp-1163', 'mp-906858', 'mp-920459', 'mp-921486', 'mp-1381018', 'mp-1676276', 'mp-1775695', 'mp-1603627']",0.0460573,"{'U': 2.0, 'Be': 26.0}",261.15110606061,[],NM,False,226,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0003527252914587,0.0460573,0,0.0921146,MP,data/source/MP/cleaned/cifs/MP-mp-1163.cif,True,,data/final/MP/graphs/Be13Th0.06U0.94-MP-mp-1163-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
In1Mg2,1,0.0,3.0,False,In3Mg6,In3Mg6,3.2,Other,True,In33.333Mg66.667,In-Mg,2,Supercon,In1Mg2,MP-mp-31326,Mg6In3,In-Mg,In33.333Mg66.667,P -6 2 m,hexagonal,3.431591,8.410084003729887,8.41008453,data/final/MP/cifs/In1Mg2-MP-mp-31326.cif,data/source/MP/raw/cifs/mp-31326.cif,mp-31326,0.0,,2014-02-19 21:35:28,3.87320035431762,10.17188/1205592,"@misc{osti_1205592,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Mg2In (SG:189) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1205592"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698639'}},0.0131871788888884,5.20754213,520.0,-18.516418,-2.057379777777778,{'tags': ['Indium magnesium (1/2)']},-18.516418,-2.057379777777778,-0.0732985011111111,"['xas', 'elasticity', 'bandstructure']",True,[51974],True,2021-05-12 10:56:20.740000,NM,9,9,mp-31326,,Mg2In,"{'functional': 'PBE', 'labels': ['Mg_pv', 'In_d'], 'pot_type': 'paw'}","{'Mg': 2.0, 'In': 1.0}",GGA,mp-31326,"['mp-510431', 'mp-31326', 'mp-1002015', 'mp-1008388', 'mp-1116239', 'mp-1428250', 'mp-1698639', 'mp-1788530', 'mp-1012676']",0.0004036,"{'Mg': 6.0, 'In': 3.0}",210.1971654581108,[],NM,False,189,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0]",5.760306031535399e-06,0.0004036,0,0.0012108,MP,data/source/MP/cleaned/cifs/MP-mp-31326.cif,False,,data/final/MP/graphs/In1Mg2-MP-mp-31326.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Cr0.48V0.52,2,0.04,2.0,False,Cr0.96V1.04,Cr1V1,0.1,Other,True,Cr48V52,Cr-V,2,Supercon,Cr0.48V0.52,MP-mp-1216394,V1Cr1,Cr-V,Cr50V50,C m m m,orthorhombic,2.53305848,2.53305848,4.086256,data/final/MP/cifs/Cr0.48V0.52-MP-mp-1216394-synth_doped.cif,data/source/MP/raw/cifs/mp-1216394.cif,mp-1216394,0.0,,2019-01-12 17:54:40.271000,6.919500540989708,,,{'GGA': {'task_id': 'mp-1675045'}},0.0,6.32681961,520.0,-18.82007283,-9.410036415,{'tags': []},-18.82007283,-9.410036415,-0.0415596449999995,['bandstructure'],True,[],True,2021-05-12 10:58:39.488000,NM,2,5,mp-1216394,,VCr,"{'functional': 'PBE', 'labels': ['V_pv', 'Cr_pv'], 'pot_type': 'paw'}","{'V': 1.0, 'Cr': 1.0}",GGA,mp-1216394,"['mp-1216394', 'mp-1429912', 'mp-1675045', 'mp-1794502', 'mp-1609669']",0.0010145,"{'V': 1.0, 'Cr': 1.0}",24.702925479877987,[],NM,False,65,0,"[0, 0]",4.106801037902863e-05,0.0010145,0,0.0010145,MP,data/source/MP/cleaned/cifs/MP-mp-1216394.cif,True,,data/final/MP/graphs/Cr0.48V0.52-MP-mp-1216394-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ba1Bi0.15Pb0.85O3,3,0.06,2.0,False,Ba2Bi0.3Pb1.7O6,Ba2Pb2O6,8.7,Oxide,True,Ba20Bi3Pb17O60,Ba-Bi-Pb-O,4,Supercon,Ba1Pb0.85Bi0.15O3,MP-mp-22230,Ba2Pb2O6,Ba-Pb-O,Ba20Pb20O60,I m m a,orthorhombic,6.133862002250079,6.155866510000001,6.155866509646406,data/final/MP/cifs/Ba1Bi0.15Pb0.85O3-MP-mp-22230-synth_doped.cif,data/source/MP/raw/cifs/mp-22230.cif,mp-22230,0.2093999999999996,,2014-02-21 02:34:22,7.878976238337828,10.17188/1197446,"@misc{osti_1197446,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BaPbO3 (SG:74) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197446"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677620'}},0.0,2.99294363,520.0,-57.91751158,-5.791751158,"{'tags': ['Barium plumbate(IV)', 'Barium lead oxide', 'Barium plumbate', 'Barium lead(IV) oxide']}",-57.91751158,-5.791751158,-2.1088509750000006,"['xas', 'bandstructure']",True,"[252031, 94313, 154038, 245600, 51657, 94312, 245601, 78681, 154039, 15933, 67811, 245602]",True,2021-05-12 10:56:59.077000,NM,10,7,mp-22230,oxide,BaPbO3,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Pb_d', 'O'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Pb': 1.0, 'O': 3.0}",GGA,mp-22230,"['mp-547522', 'mp-22230', 'mp-1078282', 'mp-1437547', 'mp-1677620', 'mp-1828697', 'mp-1589590']",5.66e-05,"{'Ba': 2.0, 'Pb': 2.0, 'O': 6.0}",165.45383803885784,[],NM,False,74,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.841787494431788e-07,5.66e-05,0,0.0001132,MP,data/source/MP/cleaned/cifs/MP-mp-22230.cif,True,,data/final/MP/graphs/Ba1Bi0.15Pb0.85O3-MP-mp-22230-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,0,1,0,0.5,False
Ir4Si10Y5,1,0.0,2.0,False,Ir8Si20Y10,Ir8Si20Y10,2.906666667,Other,True,Ir21.053Si52.632Y26.316,Ir-Si-Y,3,Supercon,Y5Ir4Si10,MP-mp-1202645,Y10Si20Ir8,Ir-Si-Y,Ir21.053Si52.632Y26.316,P 4/m b m,tetragonal,4.285216,12.661642,12.661642,data/final/MP/cifs/Ir4Si10Y5-MP-mp-1202645.cif,data/source/MP/raw/cifs/mp-1202645.cif,mp-1202645,0.0,,2019-01-12 06:38:53.994000,7.223542525878478,,,,0.017025400263158,7.08968887,520.0,-277.9653872,-7.314878610526316,"{'tags': ['Yttrium iridium silicide (5/4/10)', 'Y5Ir4Si10 lt', 'Sc5Co4Si10']}",-277.9653872,-7.314878610526316,-0.8596566396491222,[],False,[641033],True,2021-05-12 11:00:12.709000,NM,38,2,mp-1202645,,Y5(Si5Ir2)2,"{'functional': 'PBE', 'labels': ['Y_sv', 'Si', 'Ir'], 'pot_type': 'paw'}","{'Y': 5.0, 'Si': 10.0, 'Ir': 4.0}",GGA,mp-1202645,"['mp-1202645', 'mp-1372060']",0.00023165,"{'Y': 10.0, 'Si': 20.0, 'Ir': 8.0}",686.9937368239403,[],NM,False,127,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.743875164596042e-07,0.00023165,0,0.0004633,MP,data/source/MP/cleaned/cifs/MP-mp-1202645.cif,False,,data/final/MP/graphs/Ir4Si10Y5-MP-mp-1202645.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
La2Ni1O4,1,0.0,4.0,False,La8Ni4O16,La8Ni4O16,0.0,Oxide,True,La28.571Ni14.286O57.142857142857146,La-Ni-O,3,Supercon,La2Ni1O4,MP-mp-21874,La8Ni4O16,La-Ni-O,La28.571Ni14.286O57.142857142857146,P 42/n c m,tetragonal,5.607892,5.607892,12.423229,data/final/MP/cifs/La2Ni1O4-MP-mp-21874.cif,data/source/MP/raw/cifs/mp-21874.cif,mp-21874,0.0346000000000001,,2013-06-09 07:15:40,6.808946783295827,,,{'GGA+U': {'task_id': 'mp-1767279'}},0.0468913437499995,7.93744356,520.0,-206.53456634,-7.376234512142857,"{'tags': ['Dilanthanum niccolate', 'Dilanthanum niccolate - LT']}",-206.53456634,-7.376234512142857,-3.0683780964285714,"['xas', 'bandstructure']",True,"[63396, 65920, 69753, 56319]",True,2021-05-12 10:57:01.079000,AFM,28,17,mp-21874,oxide,La2NiO4,"{'functional': 'PBE', 'labels': ['La', 'Ni_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Ni': 1.0, 'O': 4.0}",GGA+U,mp-21874,"['mp-795798', 'mp-819481', 'mp-616538', 'mp-25711', 'mp-21874', 'mp-1272397', 'mp-1287242', 'mp-1273910', 'mp-1289543', 'mp-1295462', 'mp-1287775', 'mp-1281171', 'mp-1283506', 'mp-1422956', 'mp-1767279', 'mp-820353', 'mp-1629609']",2.9e-06,"{'La': 8.0, 'Ni': 4.0, 'O': 16.0}",390.6913293848223,[],AFM,True,14,1,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -1.7, -1.7, 1.7, 1.7, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",2.9690958379509523e-08,2.9e-06,4,1.16e-05,MP,data/source/MP/cleaned/cifs/MP-mp-21874.cif,False,,data/final/MP/graphs/La2Ni1O4-MP-mp-21874.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Fe1.83K0.83Se2,3,0.0583690987124463,1.0,True,Fe1.83K0.83Se2,Fe2K1Se2,32.5,Ferrite,True,Fe39.27K17.811Se42.918,Fe-K-Se,3,Supercon,K0.83Fe1.83Se2,MP-mp-1070735,K1Fe2Se2,Fe-K-Se,Fe40K20Se40,I 4/m m m,tetragonal,3.783558000712664,3.783558000712664,7.91886339,data/final/MP/cifs/Fe1.83K0.83Se2-MP-mp-1070735-synth_doped.cif,data/source/MP/raw/cifs/mp-1070735.cif,mp-1070735,0.0,,2018-03-22 03:52:22,4.804538531009527,,,{'GGA': {'task_id': 'mp-1761650'}},0.0327827750000011,3.42423866,520.0,-27.50456218,-5.500912436,{'tags': ['Potassium iron selenide (1/2/2)']},-27.50456218,-5.500912436,-0.6812646755374999,['bandstructure'],True,[186573],True,2021-05-12 10:58:14.654000,FM,5,8,mp-1070735,,K(FeSe)2,"{'functional': 'PBE', 'labels': ['K_sv', 'Fe_pv', 'Se'], 'pot_type': 'paw'}","{'K': 1.0, 'Fe': 2.0, 'Se': 2.0}",GGA,mp-1070735,"['mp-1070735', 'mp-1070765', 'mp-1070841', 'mp-1416829', 'mp-1761650', 'mp-1797161', 'mp-1585994', 'mp-1070830']",6.0503851,"{'K': 1.0, 'Fe': 2.0, 'Se': 2.0}",106.69540665041993,[],FM,True,139,1,"[0.0, 2.8, 2.8, 0.0, 0.0]",0.0567070813069176,6.0503851,2,6.0503851,MP,data/source/MP/cleaned/cifs/MP-mp-1070735.cif,True,,data/final/MP/graphs/Fe1.83K0.83Se2-MP-mp-1070735-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
C2Ho1,3,0.1333333333333334,6.0,False,C12Ho6,C12Ho8,0.0,Carbon,True,C66.667Ho33.333,C-Ho,2,Supercon,C2Ho1,MP-mp-2332,Ho8C12,C-Ho,C60Ho40,I -4 3 d,cubic,7.092197261572228,7.09219726,7.09219726,data/final/MP/cifs/C2Ho1-MP-mp-2332-synth_doped.cif,data/source/MP/raw/cifs/mp-2332.cif,mp-2332,0.0,,2011-05-15 04:18:43,8.849981273893482,10.17188/1199427,"@misc{osti_1199427,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ho2C3 (SG:220) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199427"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672315'}},0.0488674197600005,5.17874028,520.0,-152.73207243,-7.636603621499999,"{'tags': ['Holmium carbide (2/3)', 'Holmium carbide (2/3) - alpha']}",-152.73207243,-7.636603621499999,-0.2675716534999978,"['xas', 'bandstructure']",True,"[618085, 42497, 618076]",True,2021-05-12 10:56:59.077000,NM,20,7,mp-2332,,Ho2C3,"{'functional': 'PBE', 'labels': ['Ho_3', 'C'], 'pot_type': 'paw'}","{'Ho': 2.0, 'C': 3.0}",GGA,mp-2332,"['mp-924874', 'mp-925458', 'mp-909853', 'mp-2332', 'mp-1420387', 'mp-1672315', 'mp-1603751']",0.0039248,"{'Ho': 8.0, 'C': 12.0}",274.61264386970464,[],NM,False,220,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.716852574147604e-05,0.0039248,0,0.0156992,MP,data/source/MP/cleaned/cifs/MP-mp-2332.cif,True,,data/final/MP/graphs/C2Ho1-MP-mp-2332-synth_doped.json,0,True,-43m,5,0,0,0,0,0,0,0,0,1,0,1.0,False
Gd0.06La0.94Ru2,2,0.04,2.0,False,Gd0.12La1.88Ru4,La2Ru4,0.0,Other,True,Gd2La31.333Ru66.667,Gd-La-Ru,3,Supercon,La0.94Gd0.06Ru2,MP-mp-2019,La2Ru4,La-Ru,La33.333Ru66.667,F d -3 m,cubic,5.46409128,5.464091279999999,5.464091279999999,data/final/MP/cifs/Gd0.06La0.94Ru2-MP-mp-2019-synth_doped.cif,data/source/MP/raw/cifs/mp-2019.cif,mp-2019,0.0,,2011-05-13 21:42:56,9.818667150990734,10.17188/1195329,"@misc{osti_1195329,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaRu2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195329"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686817'}},0.0017745359523804,8.6251779,520.0,-47.76122776,-7.960204626666666,"{'tags': ['Lanthanum ruthenium hydride (1/2/4)', 'Lanthanum ruthenium (1/2)']}",-47.76122776,-7.960204626666666,-0.1319424883333321,"['xas', 'elasticity', 'bandstructure']",True,"[104712, 641760, 641778, 638256, 641771, 641766, 641774, 638255, 641762, 104713, 641761, 641775, 641777]",True,2021-05-12 10:56:14.760000,NM,6,14,mp-2019,,LaRu2,"{'functional': 'PBE', 'labels': ['La', 'Ru_pv'], 'pot_type': 'paw'}","{'La': 1.0, 'Ru': 2.0}",GGA,mp-2019,"['mp-935098', 'mp-941760', 'mp-941909', 'mp-2019', 'mp-1072861', 'mp-1072969', 'mp-1072939', 'mp-1077306', 'mp-1442150', 'mp-1686817', 'mp-1803378', 'mp-1590466', 'mp-1596026', 'mp-1072974']",0.000191,"{'La': 2.0, 'Ru': 4.0}",115.35564200581236,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",3.311498192526659e-06,0.000191,0,0.000382,MP,data/source/MP/cleaned/cifs/MP-mp-2019.cif,True,,data/final/MP/graphs/Gd0.06La0.94Ru2-MP-mp-2019-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Fe1S0.4Se0.6,3,0.0999999999999999,2.0,False,Fe2S0.8Se1.2,Fe2S1Se1,3.73,Ferrite,True,Fe50S20Se30,Fe-S-Se,3,Supercon,Fe1Se0.6S0.4,MP-mp-1225163,Fe2Se1S1,Fe-S-Se,Fe50S25Se25,P -6 m 2,hexagonal,3.415354002894329,3.41535372,5.658565,data/final/MP/cifs/Fe1S0.4Se0.6-MP-mp-1225163-synth_doped.cif,data/source/MP/raw/cifs/mp-1225163.cif,mp-1225163,0.0,,2019-01-13 01:18:49.100000,6.469790579478093,,,{'GGA': {'task_id': 'mp-1763783'}},0.2831379099999997,6.79096851,520.0,-24.99649553,-6.2491238825,{'tags': []},-24.99649553,-6.2491238825,-0.3497793213671878,['bandstructure'],True,[],True,2021-05-12 10:58:45.495000,FM,4,5,mp-1225163,,Fe2SeS,"{'functional': 'PBE', 'labels': ['Fe_pv', 'Se', 'S'], 'pot_type': 'paw'}","{'Fe': 2.0, 'Se': 1.0, 'S': 1.0}",GGA,mp-1225163,"['mp-1225163', 'mp-1432807', 'mp-1763783', 'mp-1782446', 'mp-1584901']",3.9408212,"{'Fe': 2.0, 'Se': 1.0, 'S': 1.0}",57.162121968969856,[],FM,True,187,1,"[1.9, 1.9, 0.0, 0.0]",0.0689411285700564,3.9408212,2,3.9408212,MP,data/source/MP/cleaned/cifs/MP-mp-1225163.cif,True,,data/final/MP/graphs/Fe1S0.4Se0.6-MP-mp-1225163-synth_doped.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
B2C1Fe0.08Ni1.92Tm1,2,0.0266666666666666,1.0,True,B2C1Fe0.08Ni1.92Tm1,B2C1Ni2Tm1,7.39,Other,True,B33.333C16.667Fe1.333Ni32Tm16.667,B-C-Fe-Ni-Tm,5,Supercon,Tm1Ni1.92Fe0.08B2C1,MP-mp-6754,Tm1Ni2B2C1,B-C-Ni-Tm,B33.333C16.667Ni33.333Tm16.667,I 4/m m m,tetragonal,3.4928639994202824,3.492863999420283,5.7937603300000005,data/final/MP/cifs/B2C1Fe0.08Ni1.92Tm1-MP-mp-6754-synth_doped.cif,data/source/MP/raw/cifs/mp-6754.cif,mp-6754,0.0,,2011-05-13 04:35:22,8.309262229712736,10.17188/1282688,"@misc{osti_1282688,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TmNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1282688"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696752'}},0.0,6.71149537,520.0,-41.76249282,-6.96041547,{'tags': []},-41.76249282,-6.96041547,-0.5234699658333332,"['xas', 'elasticity', 'bandstructure']",True,"[79577, 56652, 164574]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-6754,,TmNi2B2C,"{'functional': 'PBE', 'labels': ['Tm_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Tm': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6754,"['mp-6754', 'mp-1000684', 'mp-1007145', 'mp-1412917', 'mp-1696752', 'mp-1790753', 'mp-1011888', 'mp-1590290']",0.0028138,"{'Tm': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",63.94016944835002,[],NM,False,139,0,"[0.0, -0.0, -0.0, 0.0, 0.0, 0.0]",4.40067648283752e-05,0.0028138,0,0.0028138,MP,data/source/MP/cleaned/cifs/MP-mp-6754.cif,True,,data/final/MP/graphs/B2C1Fe0.08Ni1.92Tm1-MP-mp-6754-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B2C1Ce0.25Ni2Y0.75,3,0.0833333333333333,1.0,True,B2C1Ce0.25Ni2Y0.75,B2C1Ni2Y1,0.0,Other,True,B33.333C16.667Ce4.167Ni33.333Y12.5,B-C-Ce-Ni-Y,5,Supercon,Y0.75Ce0.25Ni2B2C1,MP-mp-6576,Y1Ni2B2C1,B-C-Ni-Y,B33.333C16.667Ni33.333Y16.667,I 4/m m m,tetragonal,3.548790000501972,3.548790000501972,5.76144136,data/final/MP/cifs/B2C1Ce0.25Ni2Y0.75-MP-mp-6576-synth_doped.cif,data/source/MP/raw/cifs/mp-6576.cif,mp-6576,0.0,,2011-05-13 05:21:43,6.099730998852292,10.17188/1281366,"@misc{osti_1281366,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281366"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688230'}},0.0,6.81083016,520.0,-43.677878,-7.279646333333333,{'tags': []},-43.677878,-7.279646333333333,-0.5109282141666659,"['xas', 'bandstructure']",True,"[75816, 89142, 83231, 79574, 41549]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6576,,YNi2B2C,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6576,"['mp-6576', 'mp-1007054', 'mp-1000583', 'mp-1439516', 'mp-1688230', 'mp-1794280', 'mp-1011792', 'mp-1597064']",0.0006603,"{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.3152437079014,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",1.010943177297096e-05,0.0006603,0,0.0006603,MP,data/source/MP/cleaned/cifs/MP-mp-6576.cif,True,,data/final/MP/graphs/B2C1Ce0.25Ni2Y0.75-MP-mp-6576-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B2C1Ni2Tb0.45Y0.55,2,0.0166666666666666,2.0,False,B4C2Ni4Tb0.9Y1.1,B4C2Ni4Tb1Y1,0.0,Other,True,B33.333C16.667Ni33.333Tb7.5Y9.167,B-C-Ni-Tb-Y,5,Supercon,Y0.55Tb0.45Ni2B2C1,MP-mp-1217431,Tb1Y1Ni4B4C2,B-C-Ni-Tb-Y,B33.333C16.667Ni33.333Tb8.333Y8.333,P 4/m m m,tetragonal,3.539436,3.539436,10.45541,data/final/MP/cifs/B2C1Ni2Tb0.45Y0.55-MP-mp-1217431-synth_doped.cif,data/source/MP/raw/cifs/mp-1217431.cif,mp-1217431,0.0,,2019-01-12 18:46:06.865000,6.97108030500507,,,,0.0041270833333326,6.7890327,520.0,-85.48190522,-7.123492101666667,{'tags': []},-85.48190522,-7.123492101666667,-0.5074494002777771,[],False,[],True,2021-05-12 11:00:40.103000,NM,12,2,mp-1217431,,TbYNi4(B2C)2,"{'functional': 'PBE', 'labels': ['Tb_3', 'Y_sv', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Tb': 1.0, 'Y': 1.0, 'Ni': 4.0, 'B': 4.0, 'C': 2.0}",GGA,mp-1217431,"['mp-1217431', 'mp-1878575']",0.0057348,"{'Tb': 1.0, 'Y': 1.0, 'Ni': 4.0, 'B': 4.0, 'C': 2.0}",130.98126957504488,[],NM,False,123,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",4.37833593963928e-05,0.0057348,0,0.0057348,MP,data/source/MP/cleaned/cifs/MP-mp-1217431.cif,True,,data/final/MP/graphs/B2C1Ni2Tb0.45Y0.55-MP-mp-1217431-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Co1Ge0.94Si0.06U1,2,0.04,4.0,False,Co4Ge3.76Si0.24U4,Co4Ge4U4,0.423,Heavy_fermion,True,Co33.333Ge31.333Si2U33.333,Co-Ge-Si-U,4,Supercon,U1Co1Ge0.94Si0.06,MP-mp-20671,U4Co4Ge4,Co-Ge-U,Co33.333Ge33.333U33.333,P n m a,orthorhombic,4.28722,6.693007,7.099451,data/final/MP/cifs/Co1Ge0.94Si0.06U1-MP-mp-20671-synth_doped.cif,data/source/MP/raw/cifs/mp-20671.cif,mp-20671,0.0,,2014-02-22 17:09:25,12.050961791187769,10.17188/1195831,"@misc{osti_1195831,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UCoGe (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195831"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696056'}},0.0092126219444441,8.81618313,520.0,-96.12146646,-8.010122205,"{'tags': ['Uranium nickel germanium (1/1/1)', 'Uranium cobalt germanium (1/1/1)', 'Uranium cobalt germanide (1/1/1)', 'Uranium cobalt germanium hydride (1/1/1/0.1)']}",-96.12146646,-8.010122205,-0.3358703183333335,"['xas', 'bandstructure']",True,"[55538, 184392, 184389, 184388]",True,2021-05-12 10:56:57.051000,NM,12,11,mp-20671,,UCoGe,"{'functional': 'PBE', 'labels': ['U', 'Co', 'Ge_d'], 'pot_type': 'paw'}","{'U': 1.0, 'Co': 1.0, 'Ge': 1.0}",GGA,mp-20671,"['mp-921572', 'mp-906970', 'mp-920534', 'mp-20671', 'mp-1102081', 'mp-1102694', 'mp-1103716', 'mp-1433082', 'mp-1696056', 'mp-1832133', 'mp-1602688']",0.006528975,"{'U': 4.0, 'Co': 4.0, 'Ge': 4.0}",203.71444041881864,[],NM,False,62,0,"[0.0, 0.0, 0.0, 0.0, -0.0, -0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0]",0.0001281985702452,0.006528975,0,0.0261159,MP,data/source/MP/cleaned/cifs/MP-mp-20671.cif,True,,data/final/MP/graphs/Co1Ge0.94Si0.06U1-MP-mp-20671-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Eu1P2Pd2,1,0.0,1.0,True,Eu1P2Pd2,Eu1P2Pd2,0.0,Other,True,Eu20P40Pd40,Eu-P-Pd,3,Supercon,Eu1Pd2P2,MP-mp-581754,Eu1P2Pd2,Eu-P-Pd,Eu20P40Pd40,I 4/m m m,tetragonal,4.194497998937115,4.1944979989371145,5.77176478,data/final/MP/cifs/Eu1P2Pd2-MP-mp-581754.cif,data/source/MP/raw/cifs/mp-581754.cif,mp-581754,0.0,,2014-02-25 11:25:04,8.134599628654897,10.17188/1276889,"@misc{osti_1276889,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Eu(PPd)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1276889"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696078'}},0.0,6.31652772,520.0,-35.9333227,-7.18666454,{'tags': ['Europium palladium phosphide (1/2/2)']},-35.9333227,-7.18666454,-0.8909821183333321,"['xas', 'elasticity', 'bandstructure']",True,[631486],True,2021-05-12 10:56:27.046000,FM,5,8,mp-581754,,Eu(PPd)2,"{'functional': 'PBE', 'labels': ['Eu', 'P', 'Pd'], 'pot_type': 'paw'}","{'Eu': 1.0, 'P': 2.0, 'Pd': 2.0}",GGA,mp-581754,"['mp-1001921', 'mp-1008270', 'mp-581754', 'mp-1433120', 'mp-1696078', 'mp-1801058', 'mp-1012567', 'mp-1588040']",6.7076567,"{'Eu': 1.0, 'P': 2.0, 'Pd': 2.0}",87.11400802528061,[],FM,True,139,1,"[6.7, 0.0, 0.0, 0.0, 0.0]",0.076998600478277,6.7076567,1,6.7076567,MP,data/source/MP/cleaned/cifs/MP-mp-581754.cif,False,,data/final/MP/graphs/Eu1P2Pd2-MP-mp-581754.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As2Ba0.2Fe2K0.8,3,0.0799999999999999,1.0,True,As2Ba0.2Fe2K0.8,As2Fe2K1,12.8,Ferrite,True,As40Ba4Fe40K16,As-Ba-Fe-K,4,Supercon,Ba0.2K0.8Fe2As2,MP-mp-35276,K1Fe2As2,As-Fe-K,As40Fe40K20,I 4/m m m,tetragonal,3.773663997645024,3.773663997645024,7.55368275,data/final/MP/cifs/As2Ba0.2Fe2K0.8-MP-mp-35276-synth_doped.cif,data/source/MP/raw/cifs/mp-35276.cif,mp-35276,0.0,,2013-11-11 09:13:53,4.960691158678031,,,{'GGA': {'task_id': 'mp-1695961'}},0.0,3.49619278,520.0,-28.80228941,-5.760457882,"{'tags': ['Potassium iron arsenide (1/2/2)', 'Potassium iron iron(III) arsenide']}",-28.80228941,-5.760457882,-0.2867273506000004,"['xas', 'elasticity', 'bandstructure']",True,"[189036, 31473]",True,2021-05-12 10:56:27.046000,FM,5,13,mp-35276,,K(FeAs)2,"{'functional': 'PBE', 'labels': ['K_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'K': 1.0, 'Fe': 2.0, 'As': 2.0}",GGA,mp-35276,"['mp-675576', 'mp-936897', 'mp-947308', 'mp-947894', 'mp-1068571', 'mp-1068449', 'mp-1068488', 'mp-35276', 'mp-1441920', 'mp-1695961', 'mp-1796098', 'mp-1593314', 'mp-1068554']",1.3381583,"{'K': 1.0, 'Fe': 2.0, 'As': 2.0}",100.63322517614498,[],FM,True,139,1,"[0.0, 0.8, 0.8, 0.0, 0.0]",0.0132973806380321,1.3381583,2,1.3381583,MP,data/source/MP/cleaned/cifs/MP-mp-35276.cif,True,,data/final/MP/graphs/As2Ba0.2Fe2K0.8-MP-mp-35276-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As2Eu1Ni2,1,0.0,1.0,True,As2Eu1Ni2,As2Eu1Ni2,0.0,Ferrite,True,As40Eu20Ni40,As-Eu-Ni,3,Supercon,Eu1Ni2As2,MP-mp-6992,Eu1Ni2As2,As-Eu-Ni,As40Eu20Ni40,I 4/m m m,tetragonal,4.106996002737414,4.106996002737414,5.853939240000001,data/final/MP/cifs/As2Eu1Ni2-MP-mp-6992.cif,data/source/MP/raw/cifs/mp-6992.cif,mp-6992,0.0,,2011-05-28 09:50:39,8.11918117543639,10.17188/1285460,"@misc{osti_1285460,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Eu(NiAs)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1285460"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702134'}},0.0,6.33177423,520.0,-34.84373383,-6.968746766,{'tags': ['Europium nickel arsenide (1/2/2)']},-34.84373383,-6.968746766,-0.7346360369999999,['bandstructure'],True,[610437],True,2021-05-12 10:58:53.520000,FM,5,8,mp-6992,,Eu(NiAs)2,"{'functional': 'PBE', 'labels': ['Eu', 'Ni_pv', 'As'], 'pot_type': 'paw'}","{'Eu': 1.0, 'Ni': 2.0, 'As': 2.0}",GGA,mp-6992,"['mp-6992', 'mp-1001888', 'mp-1008260', 'mp-1441933', 'mp-1702134', 'mp-1798489', 'mp-1012579', 'mp-1591300']",6.7751918,"{'Eu': 1.0, 'Ni': 2.0, 'As': 2.0}",85.73377024646909,[],FM,True,139,1,"[6.7, -0.0, -0.0, 0.0, 0.0]",0.0790259401927915,6.7751918,1,6.7751918,MP,data/source/MP/cleaned/cifs/MP-mp-6992.cif,False,,data/final/MP/graphs/As2Eu1Ni2-MP-mp-6992.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B2C0.99Er1Fe0.04Ni1.96,2,0.015025041736227,1.0,True,B2C0.99Er1Fe0.04Ni1.96,B2C1Er1Ni2,7.35,Other,True,B33.389C16.528Er16.694Fe0.668Ni32.721,B-C-Er-Fe-Ni,5,Supercon,Er1Ni1.96Fe0.04B2C0.99,MP-mp-6098,Er1Ni2B2C1,B-C-Er-Ni,B33.333C16.667Er16.667Ni33.333,I 4/m m m,tetragonal,3.5122880026935177,3.5122880026935173,5.77805085,data/final/MP/cifs/B2C0.99Er1Fe0.04Ni1.96-MP-mp-6098-synth_doped.cif,data/source/MP/raw/cifs/mp-6098.cif,mp-6098,0.0,,2011-05-13 04:24:02,8.212015229638553,10.17188/1277667,"@misc{osti_1277667,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ErNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277667"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700042'}},0.0,6.72687579,520.0,-41.84324782,-6.973874636666667,{'tags': []},-41.84324782,-6.973874636666667,-0.5216152347222227,"['xas', 'elasticity', 'bandstructure']",True,"[246431, 79576, 56651]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-6098,,ErNi2B2C,"{'functional': 'PBE', 'labels': ['Er_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Er': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6098,"['mp-1006980', 'mp-1000513', 'mp-6098', 'mp-1441533', 'mp-1700042', 'mp-1793903', 'mp-1011723', 'mp-1589040']",0.0020747,"{'Er': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",64.35860973581151,[],NM,False,139,0,"[0.0, -0.0, -0.0, 0.0, 0.0, 0.0]",3.2236557136900987e-05,0.0020747,0,0.0020747,MP,data/source/MP/cleaned/cifs/MP-mp-6098.cif,True,,data/final/MP/graphs/B2C0.99Er1Fe0.04Ni1.96-MP-mp-6098-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Li0.3W1O3,2,0.0318936877076412,8.0,False,Li2.4W8O24,Li3W8O24,2.2,Oxide,True,Li6.977W23.256O69.76744186046513,Li-W-O,3,Supercon,Li0.3O3W1,MP-mp-675212,Li3W8O24,Li-W-O,Li8.571W22.857O68.57142857142857,P m -3,cubic,7.592952,7.592952,7.592952,data/final/MP/cifs/Li0.3W1O3-MP-mp-675212-synth_doped.cif,data/source/MP/raw/cifs/mp-675212.cif,mp-675212,0.0,,2013-11-26 20:56:10,7.114441707152343,,,{'GGA+U': {'task_id': 'mp-947151'}},0.0226897219714494,3.3008785,520.0,-252.95113636,-7.227175324571428,{'tags': []},-252.95113636,-7.227175324571428,-2.194294053714285,['bandstructure'],True,[],True,2021-05-12 10:58:51.532000,FM,35,7,mp-675212,oxide,Li3(WO3)8,"{'functional': 'PBE', 'labels': ['Li_sv', 'W_pv', 'O'], 'pot_type': 'paw'}","{'Li': 3.0, 'W': 8.0, 'O': 24.0}",GGA+U,mp-675212,"['mp-699331', 'mp-936667', 'mp-947151', 'mp-947761', 'mp-675212', 'mp-1359828', 'mp-1817352']",3.0298985,"{'Li': 3.0, 'W': 8.0, 'O': 24.0}",437.7558547840268,[],FM,True,200,1,"[0.0, 0.0, 0.0, 0.5, 0.5, 0.5, 0.5, 0.5, 0.5, 0.5, 0.5, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0069214345551011,3.0298985,8,3.0298985,MP,data/source/MP/cleaned/cifs/MP-mp-675212.cif,True,,data/final/MP/graphs/Li0.3W1O3-MP-mp-675212-synth_doped.json,0,True,m-3,2,0,0,0,0,0,0,1,0,0,0,1.0,False
B2C1Dy0.95Ni2Tb0.05,2,0.0166666666666666,1.0,True,B2C1Dy0.95Ni2Tb0.05,B2C1Dy1Ni2,5.61,Other,True,B33.333C16.667Dy15.833Ni33.333Tb0.833,B-C-Dy-Ni-Tb,5,Supercon,Dy0.95Tb0.05Ni2B2C1,MP-mp-6223,Dy1Ni2B2C1,B-C-Dy-Ni,B33.333C16.667Dy16.667Ni33.333,I 4/m m m,tetragonal,3.5485979995620824,3.548597999562083,5.74460959,data/final/MP/cifs/B2C1Dy0.95Ni2Tb0.05-MP-mp-6223-synth_doped.cif,data/source/MP/raw/cifs/mp-6223.cif,mp-6223,0.0,,2011-05-13 04:15:09,8.00036369104547,10.17188/1278123,"@misc{osti_1278123,
    author = ""Persson, Kristin"",
    title = ""Materials Data on DyNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278123"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687390'}},0.0,6.75219219,520.0,-41.84976027,-6.974960045,{'tags': []},-41.84976027,-6.974960045,-0.5161893047222215,"['xas', 'elasticity', 'bandstructure']",True,"[56596, 56593, 56595, 79573, 56649, 56594]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-6223,,DyNi2B2C,"{'functional': 'PBE', 'labels': ['Dy_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Dy': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6223,"['mp-1007344', 'mp-1000899', 'mp-6223', 'mp-1439353', 'mp-1687390', 'mp-1795426', 'mp-1012086', 'mp-1593735']",0.004911,"{'Dy': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.07346390684725,[],NM,False,139,0,"[0.0, -0.0, -0.0, 0.0, 0.0, 0.0]",7.546855054512086e-05,0.004911,0,0.004911,MP,data/source/MP/cleaned/cifs/MP-mp-6223.cif,True,,data/final/MP/graphs/B2C1Dy0.95Ni2Tb0.05-MP-mp-6223-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As1F0.1Fe1La0.7Y0.3O0.9,3,0.15,2.0,False,As2F0.2Fe2La1.4Y0.6O1.8,As2Fe2La1Y1O2,34.8,Ferrite,True,As25F2.5Fe25La17.5Y7.5O22.500000000000004,As-F-Fe-La-Y-O,6,Supercon,La0.7Y0.3Fe1As1F0.1O0.9,MP-mp-1222786,La1Y1Fe2As2O2,As-Fe-La-Y-O,As25Fe25La12.5Y12.5O25,P 4 m m,tetragonal,4.113923,4.113923,8.980687,data/final/MP/cifs/As1F0.1Fe1La0.7Y0.3O0.9-MP-mp-1222786-synth_doped.cif,data/source/MP/raw/cifs/mp-1222786.cif,mp-1222786,0.0,,2019-01-12 23:16:19.599000,5.695751494849528,,,{'GGA+U': {'task_id': 'mp-1754089'}},0.2822735440104154,5.1653492,520.0,-55.19504052,-6.899380065,{'tags': []},-55.19504052,-6.899380065,-1.6905483227083336,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,FM,8,5,mp-1222786,oxide,LaYFe2(AsO)2,"{'functional': 'PBE', 'labels': ['La', 'Y_sv', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'La': 1.0, 'Y': 1.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",GGA+U,mp-1222786,"['mp-1222786', 'mp-1398732', 'mp-1754089', 'mp-1779506', 'mp-1619122']",7.653468,"{'La': 1.0, 'Y': 1.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",151.99240183736552,[],FM,True,99,1,"[0.0, 0.0, 3.6, 3.6, 0.0, 0.0, 0.0, 0.0]",0.0503542802632288,7.653468,2,7.653468,MP,data/source/MP/cleaned/cifs/MP-mp-1222786.cif,True,,data/final/MP/graphs/As1F0.1Fe1La0.7Y0.3O0.9-MP-mp-1222786-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
Ca0.01Nd0.99Ni1O3,2,0.004,4.0,False,Ca0.04Nd3.96Ni4O12,Nd4Ni4O12,0.0,Oxide,True,Ca0.2Nd19.8Ni20O60,Ca-Nd-Ni-O,4,Supercon,Nd0.99Ca0.01Ni1O3,MP-mp-22106,Nd4Ni4O12,Nd-Ni-O,Nd20Ni20O60,P n m a,orthorhombic,5.431762,5.495849,7.709429,data/final/MP/cifs/Ca0.01Nd0.99Ni1O3-MP-mp-22106-synth_doped.cif,data/source/MP/raw/cifs/mp-22106.cif,mp-22106,0.0,,2014-02-19 13:18:08,7.242194237367626,,,{'GGA+U': {'task_id': 'mp-1701351'}},0.0,3.99854667,520.0,-131.66600273,-6.5833001365,"{'tags': ['Neodymium nickel(III) oxide', 'Dineodymium niccolate', 'Neodymium niccolate', 'Neodymium nickel oxide', 'Neodymium niccolate(III)']}",-131.66600273,-6.5833001365,-2.425267555500001,"['xas', 'bandstructure']",True,"[155746, 67725, 164825, 67724, 416213, 78319, 164562, 155747, 67723, 69788, 155748, 67722, 24875, 416212]",True,2021-05-12 10:57:01.079000,FM,20,11,mp-22106,oxide,NdNiO3,"{'functional': 'PBE', 'labels': ['Nd_3', 'Ni_pv', 'O'], 'pot_type': 'paw'}","{'Nd': 1.0, 'Ni': 1.0, 'O': 3.0}",GGA+U,mp-22106,"['mp-919926', 'mp-918860', 'mp-905914', 'mp-602303', 'mp-25591', 'mp-1189695', 'mp-22106', 'mp-1416651', 'mp-1701351', 'mp-1930748', 'mp-1599871']",1.00005245,"{'Nd': 4.0, 'Ni': 4.0, 'O': 12.0}",230.14298278419733,[],FM,True,62,1,"[0.0, 0.0, 0.0, 0.0, 1.4, 1.4, 1.4, 1.4, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0173814111193255,1.00005245,4,4.0002098,MP,data/source/MP/cleaned/cifs/MP-mp-22106.cif,True,,data/final/MP/graphs/Ca0.01Nd0.99Ni1O3-MP-mp-22106-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Na0.28W1O3,2,0.0230050323508266,3.0,False,Na0.84W3O9,Na1W3O9,0.56,Oxide,True,Na6.542W23.364O70.09345794392523,Na-W-O,3,Supercon,Na0.28O3W1,MP-mp-1221403,Na1W3O9,Na-W-O,Na7.692W23.077O69.23076923076923,P -3 m 1,trigonal,5.507389995326316,5.5073903,6.742919,data/final/MP/cifs/Na0.28W1O3-MP-mp-1221403-synth_doped.cif,data/source/MP/raw/cifs/mp-1221403.cif,mp-1221403,0.0,,2019-01-12 22:06:05.901000,6.736095585172406,,,{'GGA+U': {'task_id': 'mp-1743310'}},0.0076796096029791,2.826287,520.0,-93.73276137,-7.210212413076923,{'tags': []},-93.73276137,-7.210212413076923,-2.192400586273211,[],False,[],True,2021-05-12 11:00:47.244000,FM,13,4,mp-1221403,oxide,Na(WO3)3,"{'functional': 'PBE', 'labels': ['Na_pv', 'W_pv', 'O'], 'pot_type': 'paw'}","{'Na': 1.0, 'W': 3.0, 'O': 9.0}",GGA+U,mp-1221403,"['mp-1221403', 'mp-1390704', 'mp-1743310', 'mp-1828967']",0.9993041,"{'Na': 1.0, 'W': 3.0, 'O': 9.0}",177.12108737567684,[],FM,True,164,2,"[0.0, 0.5, 0.4, 0.4, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0056419261805933,0.9993041,3,0.9993041,MP,data/source/MP/cleaned/cifs/MP-mp-1221403.cif,True,,data/final/MP/graphs/Na0.28W1O3-MP-mp-1221403-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ca1Ga2,1,0.0,2.0,False,Ca2Ga4,Ca2Ga4,0.0,Other,True,Ca33.333Ga66.667,Ca-Ga,2,Supercon,Ca1Ga2,MP-mp-11284,Ca2Ga4,Ca-Ga,Ca33.333Ga66.667,P 63/m m c,hexagonal,4.5059080022413065,4.50590818,7.388222,data/final/MP/cifs/Ca1Ga2-MP-mp-11284.cif,data/source/MP/raw/cifs/mp-11284.cif,mp-11284,0.0,,2011-05-29 03:04:25,4.589510606919424,10.17188/1187707,"@misc{osti_1187707,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CaGa2 (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187707"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698546'}},0.0,3.64097271,520.0,-19.23766585,-3.2062776416666665,"{'tags': ['Calcium digallium', 'Calcium gallium (1/2)']}",-19.23766585,-3.2062776416666665,-0.519013666666666,"['xas', 'elasticity', 'bandstructure']",True,"[58891, 619278, 260645, 417217]",True,2021-05-12 10:56:10.715000,NM,6,12,mp-11284,,CaGa2,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Ga_d'], 'pot_type': 'paw'}","{'Ca': 1.0, 'Ga': 2.0}",GGA,mp-11284,"['mp-930813', 'mp-11284', 'mp-1071256', 'mp-1071285', 'mp-1071316', 'mp-914115', 'mp-990763', 'mp-1441185', 'mp-1698546', 'mp-1923591', 'mp-1595819', 'mp-1071324']",0.0028535,"{'Ca': 2.0, 'Ga': 4.0}",129.90780103780773,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0]",4.393115697754797e-05,0.0028535,0,0.005707,MP,data/source/MP/cleaned/cifs/MP-mp-11284.cif,False,,data/final/MP/graphs/Ca1Ga2-MP-mp-11284.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Os0.55V0.45,3,0.1,2.0,False,Os1.1V0.9,Os1V1,5.04,Other,True,Os55V45,Os-V,2,Supercon,Os0.55V0.45,MP-mp-12778,V1Os1,Os-V,Os50V50,P m -3 m,cubic,3.023683,3.023683,3.023683,data/final/MP/cifs/Os0.55V0.45-MP-mp-12778-synth_doped.cif,data/source/MP/raw/cifs/mp-12778.cif,mp-12778,0.0,,2011-05-27 18:31:43,14.486594620813907,10.17188/1189185,"@misc{osti_1189185,
    author = ""Persson, Kristin"",
    title = ""Materials Data on VOs (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189185"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687501'}},0.003738096666666,7.97879298,520.0,-20.77794633,-10.388973165,{'tags': ['Vanadium osmium (1/1)']},-20.77794633,-10.388973165,-0.2333370025000007,"['xas', 'elasticity', 'bandstructure']",True,[150935],True,2021-05-12 10:56:12.755000,FM,2,8,mp-12778,,VOs,"{'functional': 'PBE', 'labels': ['V_pv', 'Os_pv'], 'pot_type': 'paw'}","{'V': 1.0, 'Os': 1.0}",GGA,mp-12778,"['mp-991013', 'mp-993012', 'mp-12778', 'mp-1438991', 'mp-1687501', 'mp-1791455', 'mp-994350', 'mp-1592601']",0.2202574,"{'V': 1.0, 'Os': 1.0}",27.64450224382836,[],FM,True,221,1,"[0.2, -0.0]",0.0079674937916153,0.2202574,1,0.2202574,MP,data/source/MP/cleaned/cifs/MP-mp-12778.cif,True,,data/final/MP/graphs/Os0.55V0.45-MP-mp-12778-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Bi1Lu1Pt1,1,0.0,1.0,True,Bi1Lu1Pt1,Bi1Lu1Pt1,1.0,Other,True,Bi33.333Lu33.333Pt33.333,Bi-Lu-Pt,3,Supercon,Lu1Pt1Bi1,MP-mp-1206992,Lu1Bi1Pt1,Bi-Lu-Pt,Bi33.333Lu33.333Pt33.333,F -4 3 m,cubic,4.714429399999999,4.714429399999999,4.714429399999999,data/final/MP/cifs/Bi1Lu1Pt1-MP-mp-1206992.cif,data/source/MP/raw/cifs/mp-1206992.cif,mp-1206992,0.0,,2019-01-12 10:11:28.941000,12.977134348641853,,,{'GGA': {'task_id': 'mp-1764697'}},0.0,5.82236287,520.0,-17.48593455,-5.82864485,"{'tags': ['LuPtBi', 'MgAgAs']}",-17.48593455,-5.82864485,-1.0013473366666663,['bandstructure'],True,[],True,2021-05-12 10:58:39.488000,NM,3,5,mp-1206992,,LuBiPt,"{'functional': 'PBE', 'labels': ['Lu_3', 'Bi', 'Pt'], 'pot_type': 'paw'}","{'Lu': 1.0, 'Bi': 1.0, 'Pt': 1.0}",GGA,mp-1206992,"['mp-1206992', 'mp-1421945', 'mp-1764697', 'mp-1799368', 'mp-1609511']",0.0007082,"{'Lu': 1.0, 'Bi': 1.0, 'Pt': 1.0}",74.09218666128083,[],NM,False,216,0,"[0, 0, 0]",9.558362789825608e-06,0.0007082,0,0.0007082,MP,data/source/MP/cleaned/cifs/MP-mp-1206992.cif,False,,data/final/MP/graphs/Bi1Lu1Pt1-MP-mp-1206992.json,0,True,-43m,5,0,0,0,0,0,0,0,0,0,1,1.0,False
Lu1Pd2Si2,1,0.0,1.0,True,Lu1Pd2Si2,Lu1Pd2Si2,0.67,Other,True,Lu20Pd40Si40,Lu-Pd-Si,3,Supercon,Lu1Pd2Si2,MP-mp-3507,Lu1Si2Pd2,Lu-Pd-Si,Lu20Pd40Si40,I 4/m m m,tetragonal,4.119730001064145,4.119730001064145,5.77055956,data/final/MP/cifs/Lu1Pd2Si2-MP-mp-3507.cif,data/source/MP/raw/cifs/mp-3507.cif,mp-3507,0.0,,2011-05-12 22:39:58,8.72029223560403,10.17188/1206932,"@misc{osti_1206932,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Lu(SiPd)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1206932"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703006'}},0.0,6.37306126,520.0,-30.23120511,-6.046241022,{'tags': ['Lutetium palladium silicide (1/2/2)']},-30.23120511,-6.046241022,-0.8999725860000005,"['xas', 'elasticity', 'bandstructure']",True,"[642509, 603882, 642507]",True,2021-05-12 10:56:20.740000,NM,5,10,mp-3507,,Lu(SiPd)2,"{'functional': 'PBE', 'labels': ['Lu_3', 'Si', 'Pd'], 'pot_type': 'paw'}","{'Lu': 1.0, 'Si': 2.0, 'Pd': 2.0}",GGA,mp-3507,"['mp-1007499', 'mp-1001131', 'mp-3507', 'mp-1156272', 'mp-1248571', 'mp-1438682', 'mp-1703006', 'mp-1781893', 'mp-1012261', 'mp-1594757']",0.0028506,"{'Lu': 1.0, 'Si': 2.0, 'Pd': 2.0}",84.54336090949458,[],NM,False,139,0,"[0, 0, 0, 0, 0]",3.371760915740772e-05,0.0028506,0,0.0028506,MP,data/source/MP/cleaned/cifs/MP-mp-3507.cif,False,,data/final/MP/graphs/Lu1Pd2Si2-MP-mp-3507.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ag2Se1,1,0.0,4.0,False,Ag8Se4,Ag8Se4,0.0,Other,True,Ag66.667Se33.333,Ag-Se,2,Supercon,Ag2Se1,MP-mp-568936,Ag8Se4,Ag-Se,Ag66.667Se33.333,P 21 21 21,orthorhombic,4.497481,7.113255,7.670682,data/final/MP/cifs/Ag2Se1-MP-mp-568936.cif,data/source/MP/raw/cifs/mp-568936.cif,mp-568936,0.0,,2014-12-22 15:55:57,7.976497353968593,10.17188/1274817,"@misc{osti_1274817,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ag2Se (SG:19) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1274817"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1676678'}},0.0,3.06035635,520.0,-37.45035712,-3.120863093333333,"{'tags': ['Disilver selenide - LT', 'Naumannite', 'Silver selenide - LT']}",-37.45035712,-3.120863093333333,-0.2245219318923605,"['xas', 'elasticity', 'bandstructure']",True,"[261822, 260148, 15213]",True,2021-05-12 10:56:22.739000,NM,12,9,mp-568936,,Ag2Se,"{'functional': 'PBE', 'labels': ['Ag', 'Se'], 'pot_type': 'paw'}","{'Ag': 2.0, 'Se': 1.0}",GGA,mp-568936,"['mp-920604', 'mp-907087', 'mp-568936', 'mp-1237265', 'mp-1382732', 'mp-1676678', 'mp-1775954', 'mp-921620', 'mp-1599114']",0.000189425,"{'Ag': 8.0, 'Se': 4.0}",245.39838140504548,[],NM,False,19,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.0876324271649066e-06,0.000189425,0,0.0007577,MP,data/source/MP/cleaned/cifs/MP-mp-568936.cif,False,,data/final/MP/graphs/Ag2Se1-MP-mp-568936.json,0,True,222,0,0,0,4,0,0,0,1,0,0,0,1.0,False
Ti0.66Zr0.33,1,0.0,3.0303030303030303,False,Ti2Zr1,Ti2Zr1,1.36,Other,True,Ti66.667Zr33.333,Ti-Zr,2,Supercon,Ti0.66Zr0.33,MP-mp-1008568,Zr1Ti2,Ti-Zr,Ti66.667Zr33.333,P 6/m m m,hexagonal,3.004109,4.731527996907044,4.731527609999999,data/final/MP/cifs/Ti0.66Zr0.33-MP-mp-1008568.cif,data/source/MP/raw/cifs/mp-1008568.cif,mp-1008568,0.0,,2016-09-18 00:34:34,5.330206704969721,10.17188/1325079,"@misc{osti_1325079,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrTi2 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1325079"",
    place = ""United States"",
    year = ""2016"",
    month = ""9"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1764265'}},0.0325921277777769,5.19791961,520.0,-24.24090828,-8.08030276,{'tags': ['Titanium zirconium (2/1)']},-24.24090828,-8.08030276,0.0325921277777775,"['xas', 'elasticity', 'bandstructure']",True,[247962],True,2021-05-12 10:56:08.727000,NM,3,12,mp-1008568,,ZrTi2,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Ti_pv'], 'pot_type': 'paw'}","{'Zr': 1.0, 'Ti': 2.0}",GGA,mp-1008568,"['mp-1008568', 'mp-1008612', 'mp-1008596', 'mp-1062308', 'mp-1062344', 'mp-1062253', 'mp-1431100', 'mp-1764265', 'mp-1790630', 'mp-1008619', 'mp-1611871', 'mp-1062333']",0.0006816,"{'Zr': 1.0, 'Ti': 2.0}",58.24371923962119,[],NM,False,191,0,"[0, 0, 0]",1.1702549371818466e-05,0.0006816,0,0.0006816,MP,data/source/MP/cleaned/cifs/MP-mp-1008568.cif,False,,data/final/MP/graphs/Ti0.66Zr0.33-MP-mp-1008568.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Co1Sc2,1,0.0,2.0,False,Co2Sc4,Co2Sc4,0.0,Other,True,Co33.333Sc66.667,Co-Sc,2,Supercon,Co1Sc2,MP-mp-30562,Sc4Co2,Co-Sc,Co33.333Sc66.667,I 4/m c m,tetragonal,5.272609899873553,5.2726099,5.2726099,data/final/MP/cifs/Co1Sc2-MP-mp-30562.cif,data/source/MP/raw/cifs/mp-30562.cif,mp-30562,0.0,,2014-02-24 01:16:57,4.415786223151739,10.17188/1204954,"@misc{osti_1204954,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sc2Co (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1204954"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695556'}},0.0109378991666675,4.44988416,520.0,-41.11138879,-6.851898131666666,{'tags': ['Cobalt scandium (1/2)']},-41.11138879,-6.851898131666666,-0.2608127966666664,"['xas', 'elasticity', 'bandstructure']",True,"[102643, 624942, 624931]",True,2021-05-12 10:56:18.721000,NM,6,12,mp-30562,,Sc2Co,"{'functional': 'PBE', 'labels': ['Sc_sv', 'Co'], 'pot_type': 'paw'}","{'Sc': 2.0, 'Co': 1.0}",GGA,mp-30562,"['mp-928342', 'mp-928888', 'mp-912320', 'mp-30562', 'mp-1072941', 'mp-1072964', 'mp-1076942', 'mp-1077806', 'mp-1434420', 'mp-1695556', 'mp-1802541', 'mp-1592259']",0.0069484,"{'Sc': 4.0, 'Co': 2.0}",111.94516963817522,[],NM,False,140,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001241393446891,0.0069484,0,0.0138968,MP,data/source/MP/cleaned/cifs/MP-mp-30562.cif,False,,data/final/MP/graphs/Co1Sc2-MP-mp-30562.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ca0.2Cu2Pr0.8Sr2Tl1O7,3,0.0307692307692307,1.0,True,Ca0.2Cu2Pr0.8Sr2Tl1O7,Cu2Pr1Sr2Tl1O7,38.0,Cuprate,True,Ca1.538Cu15.385Pr6.154Sr15.385Tl7.692O53.84615384615385,Ca-Cu-Pr-Sr-Tl-O,6,Supercon,Tl1Sr2Ca0.2Pr0.8Cu2O7,MP-mp-1208792,Sr2Pr1Tl1Cu2O7,Cu-Pr-Sr-Tl-O,Cu15.385Pr7.692Sr15.385Tl7.692O53.84615384615385,P 4/m m m,tetragonal,3.867038,3.867038,12.338726,data/final/MP/cifs/Ca0.2Cu2Pr0.8Sr2Tl1O7-MP-mp-1208792-synth_doped.cif,data/source/MP/raw/cifs/mp-1208792.cif,mp-1208792,0.0,,2019-01-12 11:38:31.205000,6.836244293637033,,,{'GGA': {'task_id': 'mp-1744368'}},0.0111373455254151,3.98498299,520.0,-77.21545324,-5.93965024923077,"{'tags': ['Sr2Cu2TlPrO7 rt', 'high-Tc cuprate family', 'Ba2CaCu2TlO6.5']}",-77.21545324,-5.93965024923077,-2.205214128205128,[],False,[],True,2021-05-12 11:00:21.818000,NM,13,5,mp-1208792,oxide,Sr2PrTlCu2O7,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Pr_3', 'Tl_d', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Pr': 1.0, 'Tl': 1.0, 'Cu': 2.0, 'O': 7.0}",GGA,mp-1208792,"['mp-1208792', 'mp-1238184', 'mp-1445274', 'mp-1744368', 'mp-1827972']",0.0021767,"{'Sr': 2.0, 'Pr': 1.0, 'Tl': 1.0, 'Cu': 2.0, 'O': 7.0}",184.5130975308927,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.1796994517614442e-05,0.0021767,0,0.0021767,MP,data/source/MP/cleaned/cifs/MP-mp-1208792.cif,True,,data/final/MP/graphs/Ca0.2Cu2Pr0.8Sr2Tl1O7-MP-mp-1208792-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Mo1Re3,1,0.0,1.0,True,Mo1Re3,Mo1Re3,9.89,Other,True,Mo25Re75,Mo-Re,2,Supercon,Mo1Re3,MP-mp-1219135,Re3Mo1,Mo-Re,Mo25Re75,P -6 m 2,hexagonal,2.7840939971605465,2.7840947500000004,9.130566,data/final/MP/cifs/Mo1Re3-MP-mp-1219135.cif,data/source/MP/raw/cifs/mp-1219135.cif,mp-1219135,0.0,,2019-01-12 20:11:21.516000,17.733846539347173,,,{'GGA': {'task_id': 'mp-1764653'}},0.1297208931249986,7.3736329,520.0,-47.71046775,-11.9276169375,{'tags': []},-47.71046775,-11.9276169375,0.1171892087500001,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,4,5,mp-1219135,,Re3Mo,"{'functional': 'PBE', 'labels': ['Re_pv', 'Mo_pv'], 'pot_type': 'paw'}","{'Re': 3.0, 'Mo': 1.0}",GGA,mp-1219135,"['mp-1219135', 'mp-1432897', 'mp-1764653', 'mp-1938705', 'mp-1613174']",0.0029915,"{'Re': 3.0, 'Mo': 1.0}",61.290939309818505,[],NM,False,187,0,"[0.0, 0.0, 0.0, 0.0]",4.880819308182435e-05,0.0029915,0,0.0029915,MP,data/source/MP/cleaned/cifs/MP-mp-1219135.cif,False,,data/final/MP/graphs/Mo1Re3-MP-mp-1219135.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Al1Cu1Zr1,1,0.0,2.0,False,Al2Cu2Zr2,Al2Cu2Zr2,0.0,Other,True,Al33.333Cu33.333Zr33.333,Al-Cu-Zr,3,Supercon,Al1Cu1Zr1,MP-mp-1215318,Zr2Al2Cu2,Al-Cu-Zr,Al33.333Cu33.333Zr33.333,I m m a,orthorhombic,5.165116004784308,5.17484418,5.17484418043923,data/final/MP/cifs/Al1Cu1Zr1-MP-mp-1215318.cif,data/source/MP/raw/cifs/mp-1215318.cif,mp-1215318,0.0,,2019-01-12 17:01:39.939000,6.109133829156733,,,{'GGA': {'task_id': 'mp-1760291'}},0.0,6.14808525,520.0,-35.20244665,-5.8670744416666665,{'tags': []},-35.20244665,-5.8670744416666665,-0.4029133983333335,['bandstructure'],True,[],True,2021-05-12 10:58:39.488000,FM,6,5,mp-1215318,,ZrAlCu,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Al', 'Cu_pv'], 'pot_type': 'paw'}","{'Zr': 1.0, 'Al': 1.0, 'Cu': 1.0}",GGA,mp-1215318,"['mp-1215318', 'mp-1396241', 'mp-1760291', 'mp-1873078', 'mp-1625480']",0.8087509,"{'Zr': 2.0, 'Al': 2.0, 'Cu': 2.0}",98.80468776753486,[],FM,True,74,1,"[0.5, 0.5, 0.0, 0.0, 0.0, 0.0]",0.0163706989672961,0.8087509,2,1.6175018,MP,data/source/MP/cleaned/cifs/MP-mp-1215318.cif,False,,data/final/MP/graphs/Al1Cu1Zr1-MP-mp-1215318.json,0,True,mmm,0,0,0,7,0,0,0,0,0,1,0,1.0,False
As1Co0.3Fe0.7Sm1O1,3,0.15,2.0,False,As2Co0.6Fe1.4Sm2O2,As2Fe2Sm2O2,0.0,Ferrite,True,As25Co7.5Fe17.5Sm25O25,As-Co-Fe-Sm-O,5,Supercon,Sm1Fe0.7Co0.3As1O1,MP-mp-20349,Sm2Fe2As2O2,As-Fe-Sm-O,As25Fe25Sm25O25,P 4/n m m,tetragonal,4.026492,4.026492,9.046755,data/final/MP/cifs/As1Co0.3Fe0.7Sm1O1-MP-mp-20349-synth_doped.cif,data/source/MP/raw/cifs/mp-20349.cif,mp-20349,0.0,,2014-02-19 11:24:42,6.727802583283198,,,{'GGA+U': {'task_id': 'mp-1695938'}},0.3015723809374986,3.77685593,520.0,-52.73407138,-6.5917589225,{'tags': ['Samarium iron arsenic oxide (1/1/1/1)']},-52.73407138,-6.5917589225,-1.6285904237499995,"['xas', 'elasticity', 'bandstructure']",True,"[236652, 236653, 422002, 163457, 163458]",True,2021-05-12 10:56:16.728000,FM,8,10,mp-20349,oxide,SmFeAsO,"{'functional': 'PBE', 'labels': ['Sm_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Sm': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-20349,"['mp-24944', 'mp-1078897', 'mp-1079866', 'mp-1173321', 'mp-20349', 'mp-1425472', 'mp-1695938', 'mp-1772503', 'mp-1789694', 'mp-1588381']",3.75729895,"{'Sm': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",146.67176231613362,[],FM,True,129,1,"[0.0, 0.0, 3.5, 3.5, -0.0, -0.0, -0.0, -0.0]",0.0512341147425717,3.75729895,2,7.5145979,MP,data/source/MP/cleaned/cifs/MP-mp-20349.cif,True,,data/final/MP/graphs/As1Co0.3Fe0.7Sm1O1-MP-mp-20349-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B2Mo0.96Zr0.04,2,0.0266666666666666,2.0,False,B4Mo1.92Zr0.08,B4Mo2,5.74,Other,True,B66.667Mo32Zr1.333,B-Mo-Zr,3,Supercon,Mo0.96Zr0.04B2,MP-mp-2331,B4Mo2,B-Mo,B66.667Mo33.333,R -3 m,trigonal,3.027958847262584,3.027958847262584,7.20393392,data/final/MP/cifs/B2Mo0.96Zr0.04-MP-mp-2331-synth_doped.cif,data/source/MP/raw/cifs/mp-2331.cif,mp-2331,0.0,,2011-05-12 22:01:57,7.035996278697895,10.17188/1199416,"@misc{osti_1199416,
    author = ""Persson, Kristin"",
    title = ""Materials Data on B2Mo (SG:166) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199416"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686405'}},0.0,8.84858745,520.0,-50.99919303,-8.499865505,"{'tags': ['Molybdenum boride (1/2)', 'Molybdenum diboride', 'Molybdenum boride (2/4)', 'Molybdenum boride (1/2) - beta', 'Molybdenum boride', 'Dimolybdenium tetraboride']}",-50.99919303,-8.499865505,-0.4317233144444448,"['xas', 'elasticity', 'bandstructure']",True,"[252125, 40907, 418397, 418398, 39554, 167732, 44451, 191908]",True,2021-05-12 10:56:16.728000,NM,6,13,mp-2331,,B2Mo,"{'functional': 'PBE', 'labels': ['B', 'Mo_pv'], 'pot_type': 'paw'}","{'B': 2.0, 'Mo': 1.0}",GGA,mp-2331,"['mp-920254', 'mp-921267', 'mp-906549', 'mp-2331', 'mp-1070862', 'mp-1070903', 'mp-1070939', 'mp-1077759', 'mp-1440002', 'mp-1686405', 'mp-1793532', 'mp-1588848', 'mp-1070920']",0.00061575,"{'B': 4.0, 'Mo': 2.0}",55.49073251748694,[],NM,False,166,0,"[0, 0, 0, 0, 0, 0]",2.2192894995788967e-05,0.00061575,0,0.0012315,MP,data/source/MP/cleaned/cifs/MP-mp-2331.cif,True,,data/final/MP/graphs/B2Mo0.96Zr0.04-MP-mp-2331-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Nb1Te4,1,0.0,24.0,False,Nb24Te96,Nb24Te96,0.0,Other,True,Nb20Te80,Nb-Te,2,Supercon,Nb1Te4,MP-mp-568220,Nb24Te96,Nb-Te,Nb20Te80,P 4/n c c,tetragonal,13.251043,13.251043,20.98175,data/final/MP/cifs/Nb1Te4-MP-mp-568220.cif,data/source/MP/raw/cifs/mp-568220.cif,mp-568220,0.0,,2014-02-23 13:50:55,6.526140548132295,10.17188/1274298,"@misc{osti_1274298,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbTe4 (SG:130) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1274298"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-924034'}},0.0,5.9124881,520.0,-584.34888789,-4.86957406575,{'tags': []},-584.34888789,-4.86957406575,-0.6722723137499997,['xas'],False,[],True,2021-05-12 10:57:23.123000,NM,120,5,mp-568220,,NbTe4,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Te'], 'pot_type': 'paw'}","{'Nb': 1.0, 'Te': 4.0}",GGA,mp-568220,"['mp-908783', 'mp-924034', 'mp-568220', 'mp-1180049', 'mp-1331881']",0.006174125,"{'Nb': 24.0, 'Te': 96.0}",3684.188432279101,[],NM,False,130,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.022025548468865e-05,0.006174125,0,0.148179,MP,data/source/MP/cleaned/cifs/MP-mp-568220.cif,False,,data/final/MP/graphs/Nb1Te4-MP-mp-568220.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Au1Be5,1,0.0,1.0,True,Au1Be5,Au1Be5,0.0,Other,True,Au16.667Be83.333,Au-Be,2,Supercon,Au1Be5,MP-mp-1220,Be5Au1,Au-Be,Au16.667Be83.333,F -4 3 m,cubic,4.32714278,4.32714278,4.32714278,data/final/MP/cifs/Au1Be5-MP-mp-1220.cif,data/source/MP/raw/cifs/mp-1220.cif,mp-1220,0.0,,2011-05-12 20:26:00,7.014958351829136,10.17188/1188650,"@misc{osti_1188650,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Be5Au (SG:216) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188650"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1674223'}},0.0,5.95794999,520.0,-22.48305926,-3.7471765433333335,"{'tags': ['Beryllium auride (5/1)', 'Gold beryllium (1/5)']}",-22.48305926,-3.7471765433333335,-0.0853522325,"['xas', 'elasticity', 'bandstructure']",True,"[611645, 58397, 150580, 611643]",True,2021-05-12 10:56:12.755000,NM,6,10,mp-1220,,Be5Au,"{'functional': 'PBE', 'labels': ['Be_sv', 'Au'], 'pot_type': 'paw'}","{'Be': 5.0, 'Au': 1.0}",GGA,mp-1220,"['mp-990149', 'mp-990127', 'mp-1220', 'mp-1140407', 'mp-1115291', 'mp-1437767', 'mp-1674223', 'mp-1795500', 'mp-990169', 'mp-1589847']",0.0029452,"{'Be': 5.0, 'Au': 1.0}",57.29130009238293,[],NM,False,216,0,"[0, 0, 0, 0, 0, 0]",5.14074561975523e-05,0.0029452,0,0.0029452,MP,data/source/MP/cleaned/cifs/MP-mp-1220.cif,False,,data/final/MP/graphs/Au1Be5-MP-mp-1220.json,0,True,-43m,5,0,0,0,0,0,0,0,0,0,1,1.0,False
As1Fe0.99Ni0.01Sm1O1,2,0.005,2.0,False,As2Fe1.98Ni0.02Sm2O2,As2Fe2Sm2O2,0.0,Ferrite,True,As25Fe24.75Ni0.25Sm25O25,As-Fe-Ni-Sm-O,5,Supercon,Sm1Fe0.99Ni0.01As1O1,MP-mp-20349,Sm2Fe2As2O2,As-Fe-Sm-O,As25Fe25Sm25O25,P 4/n m m,tetragonal,4.026492,4.026492,9.046755,data/final/MP/cifs/As1Fe0.99Ni0.01Sm1O1-MP-mp-20349-synth_doped.cif,data/source/MP/raw/cifs/mp-20349.cif,mp-20349,0.0,,2014-02-19 11:24:42,6.727802583283198,,,{'GGA+U': {'task_id': 'mp-1695938'}},0.3015723809374986,3.77685593,520.0,-52.73407138,-6.5917589225,{'tags': ['Samarium iron arsenic oxide (1/1/1/1)']},-52.73407138,-6.5917589225,-1.6285904237499995,"['xas', 'elasticity', 'bandstructure']",True,"[236652, 236653, 422002, 163457, 163458]",True,2021-05-12 10:56:16.728000,FM,8,10,mp-20349,oxide,SmFeAsO,"{'functional': 'PBE', 'labels': ['Sm_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Sm': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-20349,"['mp-24944', 'mp-1078897', 'mp-1079866', 'mp-1173321', 'mp-20349', 'mp-1425472', 'mp-1695938', 'mp-1772503', 'mp-1789694', 'mp-1588381']",3.75729895,"{'Sm': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",146.67176231613362,[],FM,True,129,1,"[0.0, 0.0, 3.5, 3.5, -0.0, -0.0, -0.0, -0.0]",0.0512341147425717,3.75729895,2,7.5145979,MP,data/source/MP/cleaned/cifs/MP-mp-20349.cif,True,,data/final/MP/graphs/As1Fe0.99Ni0.01Sm1O1-MP-mp-20349-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ga1N1,1,0.0,2.0,False,Ga2N2,Ga2N2,2.925,Other,True,Ga50N50,Ga-N,2,Supercon,Ga1N1,MP-mp-804,Ga2N2,Ga-N,Ga50N50,P 63 m c,hexagonal,3.2162899967970686,3.21629013,5.239962,data/final/MP/cifs/Ga1N1-MP-mp-804.cif,data/source/MP/raw/cifs/mp-804.cif,mp-804,1.7375999999999996,,2011-05-12 21:26:16,5.923650599411056,,,{'GGA': {'task_id': 'mp-1686783'}},0.0,3.45090106,520.0,-24.63444937,-6.1586123425,"{'tags': ['Gallium nitride - nanocrystalline', 'Gallium nitride - thick layer', 'Gallium nitride - wurtzite type', 'Gallium nitride - wurtzite-type', 'Gallium nitride']}",-24.63444937,-6.1586123425,-0.65681686875,"['piezo', 'eos', 'bandstructure', 'diel', 'phonons', 'elasticity']",True,"[153890, 54698, 153891, 191773, 153889, 67769, 157512, 25676, 190424, 87830, 634715, 181358, 41481, 157398, 42000, 153887, 41543, 184926, 153888, 34476, 41483, 156259]",True,2021-05-12 10:56:31.128000,NM,4,23,mp-804,,GaN,"{'functional': 'PBE', 'labels': ['Ga_d', 'N'], 'pot_type': 'paw'}","{'Ga': 1.0, 'N': 1.0}",GGA,mp-804,"['mp-655362', 'mp-656961', 'mp-655359', 'mp-805', 'mp-804', 'mp-1064643', 'mp-1064657', 'mp-1064635', 'mp-1065525', 'mp-1065533', 'mp-1065541', 'mp-1067212', 'mp-1067223', 'mp-1067234', 'mp-1114825', 'mp-1440660', 'mp-1686783', 'mp-1793241', 'mp-1590611', 'mp-1596697', 'mp-1067240', 'mp-1064655', 'mp-1065539']",0.0,"{'Ga': 2.0, 'N': 2.0}",46.9428220153705,[],NM,False,186,0,"[0, 0, 0, 0]",0.0,0.0,0,0.0,MP,data/source/MP/cleaned/cifs/MP-mp-804.cif,False,,data/final/MP/graphs/Ga1N1-MP-mp-804.json,0,True,6mm,0,5,0,0,0,0,0,1,0,0,0,1.0,False
Ge10Ir4Y5,1,0.0,2.0,False,Ge20Ir8Y10,Ge20Ir8Y10,2.76,Other,True,Ge52.632Ir21.053Y26.316,Ge-Ir-Y,3,Supercon,Y5Ir4Ge10,MP-mp-1196414,Y10Ge20Ir8,Ge-Ir-Y,Ge52.632Ir21.053Y26.316,P 4/m b m,tetragonal,4.359025,13.039416,13.039416,data/final/MP/cifs/Ge10Ir4Y5-MP-mp-1196414.cif,data/source/MP/raw/cifs/mp-1196414.cif,mp-1196414,0.0,,2019-01-12 01:35:24.218000,8.692201605288716,,,{'GGA': {'task_id': 'mp-1680198'}},0.0,6.36784331,520.0,-257.63781597,-6.779942525526316,"{'tags': ['Yttrium iridium germanide (5/4/10)', 'Sc5Co4Si10', 'Y5Ir4Ge10']}",-257.63781597,-6.779942525526316,-0.7843448520175444,[],False,"[636767, 636760]",True,2021-05-12 10:59:59.077000,NM,38,4,mp-1196414,,Y5(Ge5Ir2)2,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ge_d', 'Ir'], 'pot_type': 'paw'}","{'Y': 5.0, 'Ge': 10.0, 'Ir': 4.0}",GGA,mp-1196414,"['mp-1196414', 'mp-1202874', 'mp-1369705', 'mp-1680198']",0.00026025,"{'Y': 10.0, 'Ge': 20.0, 'Ir': 8.0}",741.1491958374235,[],NM,False,127,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",7.022877484362481e-07,0.00026025,0,0.0005205,MP,data/source/MP/cleaned/cifs/MP-mp-1196414.cif,False,,data/final/MP/graphs/Ge10Ir4Y5-MP-mp-1196414.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ba1.78Cu4La0.22Y1O8,3,0.0293333333333333,1.0,True,Ba1.78Cu4La0.22Y1O8,Ba2Cu4Y1O8,37.9,Cuprate,True,Ba11.867Cu26.667La1.467Y6.667O53.333333333333336,Ba-Cu-La-Y-O,5,Supercon,Y1Ba1.78La0.22Cu4O8,MP-mp-6790,Ba2Y1Cu4O8,Ba-Cu-Y-O,Ba13.333Cu26.667Y6.667O53.333333333333336,C m m m,orthorhombic,3.889922,3.899603999537882,13.88942687,data/final/MP/cifs/Ba1.78Cu4La0.22Y1O8-MP-mp-6790-synth_doped.cif,data/source/MP/raw/cifs/mp-6790.cif,mp-6790,0.0,,2011-05-16 03:21:24,5.936250568336678,10.17188/1283441,"@misc{osti_1283441,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Y(CuO2)4 (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1283441"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686864'}},0.0,3.31391536,520.0,-91.58381472,-6.105587648,"{'tags': ['Yttrium barium copper oxide (1/2/4/8)', 'High pressure experimental phase']}",-91.58381472,-6.105587648,-2.0529924817777783,"['xas', 'bandstructure']",True,"[72261, 85273, 74251, 400273, 85277, 85275, 400280, 67632, 85272, 67631, 83920, 66613, 85279, 400277, 75689, 74259, 85278, 85280, 66603, 94265, 400276, 88873, 71417, 75712, 97052, 66605, 72258, 85281, 85274, 400279, 66604, 69698]",True,2021-05-12 10:57:34.594000,NM,15,10,mp-6790,oxide,Ba2Y(CuO2)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-6790,"['mp-1000664', 'mp-6790', 'mp-1007136', 'mp-1237713', 'mp-1440937', 'mp-1686864', 'mp-1834179', 'mp-1011883', 'mp-1590064', 'mp-1590433']",0.0004643,"{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",208.60454115924333,[],NM,False,65,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.225742533790601e-06,0.0004643,0,0.0004643,MP,data/source/MP/cleaned/cifs/MP-mp-6790.cif,True,,data/final/MP/graphs/Ba1.78Cu4La0.22Y1O8-MP-mp-6790-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Al1Pd2Y0.1Zr0.9,2,0.0499999999999999,1.0,True,Al1Pd2Y0.1Zr0.9,Al1Pd2Zr1,0.0,Other,True,Al25Pd50Y2.5Zr22.5,Al-Pd-Y-Zr,4,Supercon,Pd2Zr0.9Y0.1Al1,MP-mp-541047,Zr1Al1Pd2,Al-Pd-Zr,Al25Pd50Zr25,F m -3 m,cubic,4.57033518,4.570335179999999,4.57033518,data/final/MP/cifs/Al1Pd2Y0.1Zr0.9-MP-mp-541047-synth_doped.cif,data/source/MP/raw/cifs/mp-541047.cif,mp-541047,0.0,,2014-03-04 22:37:49,8.143435841764896,10.17188/1264928,"@misc{osti_1264928,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrAlPd2 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1264928"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700196'}},0.0,6.07479302,520.0,-25.86549847,-6.4663746175,{'tags': ['Aluminium palladium zirconium (1/2/1)']},-25.86549847,-6.4663746175,-0.8031145974999996,"['xas', 'elasticity', 'bandstructure']",True,[58122],True,2021-05-12 10:56:22.739000,NM,4,9,mp-541047,,ZrAlPd2,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Al', 'Pd'], 'pot_type': 'paw'}","{'Zr': 1.0, 'Al': 1.0, 'Pd': 2.0}",GGA,mp-541047,"['mp-993682', 'mp-541047', 'mp-991962', 'mp-1256586', 'mp-1413021', 'mp-1700196', 'mp-1781993', 'mp-994976', 'mp-1592388']",0.0003981,"{'Zr': 1.0, 'Al': 1.0, 'Pd': 2.0}",67.5039455520289,[],NM,False,225,0,"[0, 0, 0, 0]",5.897433057348671e-06,0.0003981,0,0.0003981,MP,data/source/MP/cleaned/cifs/MP-mp-541047.cif,True,,data/final/MP/graphs/Al1Pd2Y0.1Zr0.9-MP-mp-541047-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ge2Pd1.8Rh0.2Sr1,3,0.0799999999999999,1.0,True,Ge2Pd1.8Rh0.2Sr1,Ge2Pd2Sr1,2.92,Other,True,Ge40Pd36Rh4Sr20,Ge-Pd-Rh-Sr,4,Supercon,Sr1Pd1.8Rh0.2Ge2,MP-mp-978986,Sr1Ge2Pd2,Ge-Pd-Sr,Ge40Pd40Sr20,I 4/m m m,tetragonal,4.438671999438209,4.438671999438209,6.03054834,data/final/MP/cifs/Ge2Pd1.8Rh0.2Sr1-MP-mp-978986-synth_doped.cif,data/source/MP/raw/cifs/mp-978986.cif,mp-978986,0.0,,2015-10-09 03:56:43,7.295677176868866,10.17188/1316057,"@misc{osti_1316057,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr(GePd)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1316057"",
    place = ""United States"",
    year = ""2016"",
    month = ""9"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688092'}},0.0,4.0155429,520.0,-24.8627221,-4.97254442,"{'tags': ['Strontium palladium germanide (1/2/2)', 'Strontium palladium germanium (1/2/2)', 'High pressure experimental phase']}",-24.8627221,-4.97254442,-0.7134818633333324,"['xas', 'elasticity', 'bandstructure']",True,"[165985, 181157, 181155, 181156, 168133]",True,2021-05-12 10:56:37.246000,NM,5,9,mp-978986,,Sr(GePd)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ge_d', 'Pd'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Ge': 2.0, 'Pd': 2.0}",GGA,mp-978986,"['mp-1005776', 'mp-978986', 'mp-1005866', 'mp-979737', 'mp-1438850', 'mp-1688092', 'mp-1782349', 'mp-1011093', 'mp-1589601']",0.0012593,"{'Sr': 1.0, 'Ge': 2.0, 'Pd': 2.0}",101.45304755163892,[],NM,False,139,0,"[0, 0, 0, 0, 0]",1.2412638460752248e-05,0.0012593,0,0.0012593,MP,data/source/MP/cleaned/cifs/MP-mp-978986.cif,True,,data/final/MP/graphs/Ge2Pd1.8Rh0.2Sr1-MP-mp-978986-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Cu0.1Se2Zn0.9,3,0.0666666666666666,4.0,False,Cu0.4Se8Zn3.6,Se8Zn4,0.0,Other,True,Cu3.333Se66.667Zn30,Cu-Se-Zn,3,Supercon,Cu0.1Se2Zn0.9,MP-mp-1102515,Zn4Se8,Se-Zn,Se66.667Zn33.333,P a -3,cubic,6.374129,6.374129,6.374129,data/final/MP/cifs/Cu0.1Se2Zn0.9-MP-mp-1102515-synth_doped.cif,data/source/MP/raw/cifs/mp-1102515.cif,mp-1102515,1.1764,,2018-07-18 14:36:27,5.727850373967437,,,{'GGA': {'task_id': 'mp-1701009'}},0.0,3.11327551,520.0,-36.96020633,-3.0800171941666665,"{'tags': ['ZnSe2 hp', 'FeS2', 'Zinc perselenide', 'pyrite-marcasite family']}",-36.96020633,-3.0800171941666665,-0.6441616723958337,['bandstructure'],True,[652213],True,2021-05-12 10:58:20.361000,NM,12,5,mp-1102515,,ZnSe2,"{'functional': 'PBE', 'labels': ['Zn', 'Se'], 'pot_type': 'paw'}","{'Zn': 1.0, 'Se': 2.0}",GGA,mp-1102515,"['mp-1102515', 'mp-1422492', 'mp-1701009', 'mp-1882114', 'mp-1600322']",0.0,"{'Zn': 4.0, 'Se': 8.0}",258.97780493022333,[],NM,False,205,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0,0.0,0,0.0,MP,data/source/MP/cleaned/cifs/MP-mp-1102515.cif,True,,data/final/MP/graphs/Cu0.1Se2Zn0.9-MP-mp-1102515-synth_doped.json,0,True,m-3,2,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba1Ga1Si1,1,0.0,1.0,True,Ba1Ga1Si1,Ba1Ga1Si1,4.05,Other,True,Ba33.333Ga33.333Si33.333,Ba-Ga-Si,3,Supercon,Ba1Ga1Si1,MP-mp-1227940,Ba1Ga1Si1,Ba-Ga-Si,Ba33.333Ga33.333Si33.333,P -6 m 2,hexagonal,4.272082000941928,4.2720824,5.13248,data/final/MP/cifs/Ba1Ga1Si1-MP-mp-1227940.cif,data/source/MP/raw/cifs/mp-1227940.cif,mp-1227940,0.0,,2019-01-13 03:42:50.271000,4.81315877375094,,,{'GGA': {'task_id': 'mp-1732125'}},0.0,3.79403141,520.0,-11.72891623,-3.909638743333333,{'tags': []},-11.72891623,-3.909638743333333,-0.4285117858333335,['bandstructure'],True,[],True,2021-05-12 10:58:49.477000,NM,3,5,mp-1227940,,BaGaSi,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ga_d', 'Si'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Ga': 1.0, 'Si': 1.0}",GGA,mp-1227940,"['mp-1227940', 'mp-1435807', 'mp-1732125', 'mp-1799653', 'mp-1613506']",0.0015669,"{'Ba': 1.0, 'Ga': 1.0, 'Si': 1.0}",81.12171279781855,[],NM,False,187,0,"[0, 0, 0]",1.9315420569400697e-05,0.0015669,0,0.0015669,MP,data/source/MP/cleaned/cifs/MP-mp-1227940.cif,False,,data/final/MP/graphs/Ba1Ga1Si1-MP-mp-1227940.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
B4Ru4Sc1,1,0.0,4.0,False,B16Ru16Sc4,B16Ru16Sc4,7.27,Other,True,B44.444Ru44.444Sc11.111,B-Ru-Sc,3,Supercon,Sc1Ru4B4,MP-mp-1200617,Sc4B16Ru16,B-Ru-Sc,B44.444Ru44.444Sc11.111,I 41/a c d,tetragonal,7.389877997512626,7.389877997512625,9.13631293,data/final/MP/cifs/B4Ru4Sc1-MP-mp-1200617.cif,data/source/MP/raw/cifs/mp-1200617.cif,mp-1200617,0.0,,2019-01-12 04:59:27.749000,7.992491894244692,,,{'GGA': {'task_id': 'mp-1752937'}},0.0376312728703798,7.15824369,520.0,-297.4963582,-8.263787727777776,{'tags': ['Scandium ruthenium boride (1/4/4)']},-297.4963582,-8.263787727777776,-0.4696105268518507,['bandstructure'],True,[615364],True,2021-05-12 10:58:37.524000,NM,36,5,mp-1200617,,Sc(BRu)4,"{'functional': 'PBE', 'labels': ['Sc_sv', 'B', 'Ru_pv'], 'pot_type': 'paw'}","{'Sc': 1.0, 'B': 4.0, 'Ru': 4.0}",GGA,mp-1200617,"['mp-1200617', 'mp-1409256', 'mp-1752937', 'mp-1819001', 'mp-1623338']",0.003524725,"{'Sc': 4.0, 'B': 16.0, 'Ru': 16.0}",409.27517685972566,[],NM,False,15,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, 0.0, -0.0, -0.0, -0.0, 0.0, -0.0, -0.0, -0.0, 0.0, 0.0, 0.0, -0.0, 0.0, 0.0, 0.0]",3.444846107740425e-05,0.003524725,0,0.0140989,MP,data/source/MP/cleaned/cifs/MP-mp-1200617.cif,False,,data/final/MP/graphs/B4Ru4Sc1-MP-mp-1200617.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ce1Co0.77In5Rh0.23,3,0.0657142857142857,1.0,True,Ce1Co0.77In5Rh0.23,Ce1Co1In5,1.38,Heavy_fermion,True,Ce14.286Co11In71.429Rh3.286,Ce-Co-In-Rh,4,Supercon,Ce1Rh0.23Co0.77In5,MP-mp-19961,Ce1In5Co1,Ce-Co-In,Ce14.286Co14.286In71.429,P 4/m m m,tetragonal,4.635989,4.635989,7.564124,data/final/MP/cifs/Ce1Co0.77In5Rh0.23-MP-mp-19961-synth_doped.cif,data/source/MP/raw/cifs/mp-19961.cif,mp-19961,0.0,,2014-02-21 14:08:25,7.897022127398995,10.17188/1195145,"@misc{osti_1195145,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeIn5Co (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195145"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701944'}},0.0,7.80626318,520.0,-28.52795357,-4.075421938571429,{'tags': ['Cerium cobalt indium (1/1/5)']},-28.52795357,-4.075421938571429,-0.2468754242857146,"['xas', 'bandstructure']",True,[102108],True,2021-05-12 10:56:57.051000,FM,7,8,mp-19961,,CeIn5Co,"{'functional': 'PBE', 'labels': ['Ce', 'In_d', 'Co'], 'pot_type': 'paw'}","{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",GGA,mp-19961,"['mp-928775', 'mp-912209', 'mp-928270', 'mp-19961', 'mp-1504062', 'mp-1701944', 'mp-1785253', 'mp-1593180']",0.9310323,"{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",162.57113333428427,[],FM,True,123,1,"[0.7, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0057269226147644,0.9310323,1,0.9310323,MP,data/source/MP/cleaned/cifs/MP-mp-19961.cif,True,,data/final/MP/graphs/Ce1Co0.77In5Rh0.23-MP-mp-19961-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ce1Rh1Si3,1,0.0,1.0,True,Ce1Rh1Si3,Ce1Rh1Si3,0.914,Heavy_fermion,True,Ce20Rh20Si60,Ce-Rh-Si,3,Supercon,Ce1Rh1Si3,MP-mp-1070394,Ce1Si3Rh1,Ce-Rh-Si,Ce20Rh20Si60,I 4 m m,tetragonal,4.231833998968089,4.231833998968089,5.73625687,data/final/MP/cifs/Ce1Rh1Si3-MP-mp-1070394.cif,data/source/MP/raw/cifs/mp-1070394.cif,mp-1070394,0.0,,2018-03-22 03:11:24,6.200860692935676,,,{'GGA': {'task_id': 'mp-1701281'}},0.0,8.80245884,520.0,-33.66855475,-6.73371095,"{'tags': ['Cerium rhodium silicide (1/1/3)', 'BaNiSn3', 'CeRhSi3']}",-33.66855475,-6.73371095,-0.8190431329999995,['bandstructure'],True,[621955],True,2021-05-12 10:58:14.654000,FM,5,8,mp-1070394,,CeSi3Rh,"{'functional': 'PBE', 'labels': ['Ce', 'Si', 'Rh_pv'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Si': 3.0, 'Rh': 1.0}",GGA,mp-1070394,"['mp-1070435', 'mp-1070538', 'mp-1070394', 'mp-1435529', 'mp-1701281', 'mp-1799574', 'mp-1589077', 'mp-1070517']",0.3096295,"{'Ce': 1.0, 'Si': 3.0, 'Rh': 1.0}",87.64233411304477,[],FM,True,107,1,"[0.3, 0.0, 0.0, 0.0, 0.0]",0.0035328760140119,0.3096295,1,0.3096295,MP,data/source/MP/cleaned/cifs/MP-mp-1070394.cif,False,,data/final/MP/graphs/Ce1Rh1Si3-MP-mp-1070394.json,0,True,4mm,0,0,0,0,5,0,0,0,0,1,0,1.0,False
In1Rh1,1,0.0,1.0,True,In1Rh1,In1Rh1,0.0,Other,True,In50Rh50,In-Rh,2,Supercon,In1Rh1,MP-mp-899,In1Rh1,In-Rh,In50Rh50,P m -3 m,cubic,3.24363,3.24363,3.24363,data/final/MP/cifs/In1Rh1-MP-mp-899.cif,data/source/MP/raw/cifs/mp-899.cif,mp-899,0.0,,2011-05-12 19:58:18,10.594012453164604,10.17188/1312887,"@misc{osti_1312887,
    author = ""Persson, Kristin"",
    title = ""Materials Data on InRh (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1312887"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668109'}},0.0,9.11422412,520.0,-10.94364468,-5.47182234,{'tags': ['Indium rhodium (1/1)']},-10.94364468,-5.47182234,-0.4138265399999996,"['xas', 'elasticity', 'bandstructure']",True,"[640334, 59516, 59515]",True,2021-05-12 10:56:33.121000,NM,2,9,mp-899,,InRh,"{'functional': 'PBE', 'labels': ['In_d', 'Rh_pv'], 'pot_type': 'paw'}","{'In': 1.0, 'Rh': 1.0}",GGA,mp-899,"['mp-930623', 'mp-913898', 'mp-899', 'mp-1140961', 'mp-1439987', 'mp-1668109', 'mp-1791013', 'mp-977664', 'mp-1590018']",2.58e-05,"{'In': 1.0, 'Rh': 1.0}",34.12667099130015,[],NM,False,221,0,"[0, 0]",7.560069368200943e-07,2.58e-05,0,2.58e-05,MP,data/source/MP/cleaned/cifs/MP-mp-899.cif,False,,data/final/MP/graphs/In1Rh1-MP-mp-899.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Nb1S0.899,3,0.05318588730911,2.0,False,Nb2S1.798,Nb2S2,3.83,Other,True,Nb52.659S47.341,Nb-S,2,Supercon,Nb1S0.899,MP-mp-647,Nb2S2,Nb-S,Nb50S50,P 63/m m c,hexagonal,3.310030002498044,3.31003081,6.669122,data/final/MP/cifs/Nb1S0.899-MP-mp-647-synth_doped.cif,data/source/MP/raw/cifs/mp-647.cif,mp-647,0.0,,2011-05-12 21:02:34,6.558829836098991,10.17188/1280662,"@misc{osti_1280662,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbS (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1280662"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678635'}},0.0657296840548777,8.21815925,520.0,-32.08134983,-8.0203374575,"{'tags': ['Niobium sulfide (1/1)', 'Niobium(II) sulfide']}",-32.08134983,-8.0203374575,-1.1529600040625,"['xas', 'elasticity', 'bandstructure']",True,"[44992, 645304]",True,2021-05-12 10:56:27.046000,NM,4,8,mp-647,,NbS,"{'functional': 'PBE', 'labels': ['Nb_pv', 'S'], 'pot_type': 'paw'}","{'Nb': 1.0, 'S': 1.0}",GGA,mp-647,"['mp-647', 'mp-910183', 'mp-926092', 'mp-925613', 'mp-1437777', 'mp-1678635', 'mp-1783821', 'mp-1593108']",1.855e-05,"{'Nb': 2.0, 'S': 2.0}",63.27953732074284,[],NM,False,194,0,"[0, 0, 0, 0]",5.862874725513951e-07,1.855e-05,0,3.71e-05,MP,data/source/MP/cleaned/cifs/MP-mp-647.cif,True,,data/final/MP/graphs/Nb1S0.899-MP-mp-647-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ir0.55Re0.15,3,0.0714285714285714,5.453939393939393,False,Ir3Re0.818,Ir3Re1,0.61,Other,True,Ir78.571Re21.429,Ir-Re,2,Supercon,Ir0.55Re0.15,MP-mp-1219535,Re1Ir3,Ir-Re,Ir75Re25,R -3 m,trigonal,2.743540225373989,2.743540225373989,9.13682315,data/final/MP/cifs/Ir0.55Re0.15-MP-mp-1219535-synth_doped.cif,data/source/MP/raw/cifs/mp-1219535.cif,mp-1219535,0.0,,2019-01-12 20:31:29.551000,21.595867988779684,,,{'GGA': {'task_id': 'mp-1763612'}},0.0517661737499963,9.26008305,520.0,-39.36185263,-9.8404631575,{'tags': []},-39.36185263,-9.8404631575,-0.1005085462500012,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,4,5,mp-1219535,,ReIr3,"{'functional': 'PBE', 'labels': ['Re_pv', 'Ir'], 'pot_type': 'paw'}","{'Re': 1.0, 'Ir': 3.0}",GGA,mp-1219535,"['mp-1219535', 'mp-1427538', 'mp-1763612', 'mp-1793205', 'mp-1638327']",0.0002378,"{'Re': 1.0, 'Ir': 3.0}",58.65730944116237,[],NM,False,166,0,"[0, 0, 0, 0]",4.054055705342759e-06,0.0002378,0,0.0002378,MP,data/source/MP/cleaned/cifs/MP-mp-1219535.cif,True,,data/final/MP/graphs/Ir0.55Re0.15-MP-mp-1219535-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
P1Re2,1,0.0,4.0,False,P4Re8,P4Re8,0.0,Other,True,P33.333Re66.667,P-Re,2,Supercon,P1Re2,MP-mp-1637,Re8P4,P-Re,P33.333Re66.667,P n m a,orthorhombic,2.966088,5.577823,10.112956,data/final/MP/cifs/P1Re2-MP-mp-1637.cif,data/source/MP/raw/cifs/mp-1637.cif,mp-1637,0.0,,2011-05-15 08:38:30,16.014188231668147,10.17188/1191840,"@misc{osti_1191840,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Re2P (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191840"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701961'}},0.0,9.09222083,520.0,-124.70530117,-10.392108430833334,"{'tags': ['Rhenium phosphide (2/1)', 'High pressure experimental phase']}",-124.70530117,-10.392108430833334,-0.2913228052777772,"['xas', 'bandstructure']",True,"[186202, 186201, 186203, 43564, 186200, 48123]",True,2021-05-12 10:56:53.126000,NM,12,12,mp-1637,,Re2P,"{'functional': 'PBE', 'labels': ['Re_pv', 'P'], 'pot_type': 'paw'}","{'Re': 2.0, 'P': 1.0}",GGA,mp-1637,"['mp-922229', 'mp-907624', 'mp-922042', 'mp-1637', 'mp-1095463', 'mp-1095475', 'mp-1095613', 'mp-1102617', 'mp-1417134', 'mp-1701961', 'mp-1778287', 'mp-1592658']",0.0003074,"{'Re': 8.0, 'P': 4.0}",167.3119181813358,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",7.349147707859857e-06,0.0003074,0,0.0012296,MP,data/source/MP/cleaned/cifs/MP-mp-1637.cif,False,,data/final/MP/graphs/P1Re2-MP-mp-1637.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Cu40Zr60,3,0.1333333333333333,0.025,False,Cu1Zr1.5,Cu1Zr2,1.173333333,Other,True,Cu40Zr60,Cu-Zr,2,Supercon,Cu40Zr60,MP-mp-193,Zr2Cu1,Cu-Zr,Cu33.333Zr66.667,I 4/m m m,tetragonal,3.2319760000702007,3.2319760000702007,6.05923844,data/final/MP/cifs/Cu40Zr60-MP-mp-193-synth_doped.cif,data/source/MP/raw/cifs/mp-193.cif,mp-193,0.0,,2011-05-12 23:27:41,6.968518148194282,10.17188/1194188,"@misc{osti_1194188,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Zr2Cu (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1194188"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1673144'}},0.0,4.86768268,520.0,-21.59176061,-7.197253536666668,"{'tags': ['Copper zirconium(1/2)', 'Zirconium copper (2/1)', 'Zirconium copper (2/1) - tetragonal part', 'Copper zirconium (1/2)']}",-21.59176061,-7.197253536666668,-0.1323842266666671,"['xas', 'elasticity', 'bandstructure']",True,"[191182, 290921, 151846, 103164, 290922, 191407]",True,2021-05-12 10:56:14.760000,NM,3,24,mp-193,,Zr2Cu,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Cu_pv'], 'pot_type': 'paw'}","{'Zr': 2.0, 'Cu': 1.0}",GGA,mp-193,"['mp-992216', 'mp-990544', 'mp-193', 'mp-1062037', 'mp-1062102', 'mp-1062145', 'mp-1062444', 'mp-1062493', 'mp-1062538', 'mp-1063243', 'mp-1063305', 'mp-1063370', 'mp-1063461', 'mp-1063309', 'mp-1063384', 'mp-1442085', 'mp-1673144', 'mp-1794972', 'mp-993858', 'mp-1592030', 'mp-1063351', 'mp-1062122', 'mp-1062519', 'mp-1063421']",0.0006595,"{'Zr': 2.0, 'Cu': 1.0}",58.61829422874481,[],NM,False,139,0,"[0, 0, 0]",1.1250753858965062e-05,0.0006595,0,0.0006595,MP,data/source/MP/cleaned/cifs/MP-mp-193.cif,True,,data/final/MP/graphs/Cu40Zr60-MP-mp-193-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
La2O4,3,0.1333333333333334,0.75,False,La1.5O3,La2O3,0.0,Oxide,True,La33.333O66.66666666666667,La-O,2,Supercon,La2O4,MP-mp-1968,La2O3,La-O,La40O60,P -3 m 1,trigonal,3.938341997217276,3.93834094,6.180293,data/final/MP/cifs/La2O4-MP-mp-1968-synth_doped.cif,data/source/MP/raw/cifs/mp-1968.cif,mp-1968,3.8768,,2011-05-12 22:48:04,6.516973662885817,10.17188/1194889,"@misc{osti_1194889,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La2O3 (SG:164) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1194889"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686619'}},0.0243990772499991,5.80692445,520.0,-41.90361732,-8.380723464,"{'tags': ['Lanthanum oxide - A-form, HT', 'Lanthanum oxide (2/3)', 'Lanthanum oxide', 'Lanthanum oxide - A-form', 'Lanthanum(III) oxide', 'Dilanthanum trioxide']}",-41.90361732,-8.380723464,-3.849744019000001,"['xas', 'elasticity', 'bandstructure', 'phonons']",True,"[641603, 56166, 151763, 100204, 641599, 160205, 192270, 184524, 24693, 96196, 100205, 154586, 56771]",True,2021-05-12 10:56:14.760000,NM,5,25,mp-1968,oxide,La2O3,"{'functional': 'PBE', 'labels': ['La', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'O': 3.0}",GGA,mp-1968,"['mp-656176', 'mp-664767', 'mp-659353', 'mp-1968', 'mp-1068298', 'mp-1068330', 'mp-1068313', 'mp-1069012', 'mp-1068974', 'mp-1068988', 'mp-1069525', 'mp-1069535', 'mp-1069551', 'mp-1069903', 'mp-1069888', 'mp-1069916', 'mp-1440680', 'mp-1686619', 'mp-1782430', 'mp-1588396', 'mp-1594717', 'mp-1069549', 'mp-1069912', 'mp-1068327', 'mp-1069005']",0.0,"{'La': 2.0, 'O': 3.0}",83.01687765081088,[],NM,False,164,0,"[0, 0, 0, 0, 0]",0.0,0.0,0,0.0,MP,data/source/MP/cleaned/cifs/MP-mp-1968.cif,True,,data/final/MP/graphs/La2O4-MP-mp-1968-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Co0.15Ti0.85,3,0.0999999999999999,10.0,False,Co1.5Ti8.5,Co2Ti8,3.8,Other,True,Co15Ti85,Co-Ti,2,Supercon,Co0.15Ti0.85,MP-mp-1208254,Ti8Co2,Co-Ti,Co20Ti80,F d -3 m,cubic,6.31529653,6.31529653,6.31529653,data/final/MP/cifs/Co0.15Ti0.85-MP-mp-1208254-synth_doped.cif,data/source/MP/raw/cifs/mp-1208254.cif,mp-1208254,0.0,,2019-01-12 11:12:23.393000,4.669272783048418,,,,0.663550245166669,4.96942328,520.0,-72.45449192,-7.245449192,"{'tags': ['MgCu2', 'Friauf-Laves phase, Frank-Kasper phase', 'TiCo2']}",-72.45449192,-7.245449192,0.4926079803333337,[],False,[],True,2021-05-12 11:00:21.818000,NM,10,2,mp-1208254,,Ti4Co,"{'functional': 'PBE', 'labels': ['Ti_pv', 'Co'], 'pot_type': 'paw'}","{'Ti': 4.0, 'Co': 1.0}",GGA,mp-1208254,"['mp-1208254', 'mp-1831260']",0.0002122,"{'Ti': 8.0, 'Co': 2.0}",178.10095316357223,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.3829181846669893e-06,0.0002122,0,0.0004244,MP,data/source/MP/cleaned/cifs/MP-mp-1208254.cif,True,,data/final/MP/graphs/Co0.15Ti0.85-MP-mp-1208254-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ce0.98Co1In5La0.02,2,0.0057142857142857,1.0,True,Ce0.98Co1In5La0.02,Ce1Co1In5,2.0,Heavy_fermion,True,Ce14Co14.286In71.429La0.286,Ce-Co-In-La,4,Supercon,Ce0.98La0.02Co1In5,MP-mp-19961,Ce1In5Co1,Ce-Co-In,Ce14.286Co14.286In71.429,P 4/m m m,tetragonal,4.635989,4.635989,7.564124,data/final/MP/cifs/Ce0.98Co1In5La0.02-MP-mp-19961-synth_doped.cif,data/source/MP/raw/cifs/mp-19961.cif,mp-19961,0.0,,2014-02-21 14:08:25,7.897022127398995,10.17188/1195145,"@misc{osti_1195145,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeIn5Co (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195145"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701944'}},0.0,7.80626318,520.0,-28.52795357,-4.075421938571429,{'tags': ['Cerium cobalt indium (1/1/5)']},-28.52795357,-4.075421938571429,-0.2468754242857146,"['xas', 'bandstructure']",True,[102108],True,2021-05-12 10:56:57.051000,FM,7,8,mp-19961,,CeIn5Co,"{'functional': 'PBE', 'labels': ['Ce', 'In_d', 'Co'], 'pot_type': 'paw'}","{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",GGA,mp-19961,"['mp-928775', 'mp-912209', 'mp-928270', 'mp-19961', 'mp-1504062', 'mp-1701944', 'mp-1785253', 'mp-1593180']",0.9310323,"{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",162.57113333428427,[],FM,True,123,1,"[0.7, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0057269226147644,0.9310323,1,0.9310323,MP,data/source/MP/cleaned/cifs/MP-mp-19961.cif,True,,data/final/MP/graphs/Ce0.98Co1In5La0.02-MP-mp-19961-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Al0.24Si0.76V3,3,0.12,2.0,False,Al0.48Si1.52V6,Si2V6,11.2,Other,True,Al6Si19V75,Al-Si-V,3,Supercon,V3Si0.76Al0.24,MP-mp-2567,V6Si2,Si-V,Si25V75,P m -3 n,cubic,4.702381,4.702381,4.702381,data/final/MP/cifs/Al0.24Si0.76V3-MP-mp-2567-synth_doped.cif,data/source/MP/raw/cifs/mp-2567.cif,mp-2567,0.0,,2011-05-13 19:15:43,5.778142190030859,10.17188/1200874,"@misc{osti_1200874,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Si (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1200874"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668672'}},0.0,7.30599425,520.0,-69.05773321,-8.63221665125,{'tags': ['Vanadium silicide (3/1)']},-69.05773321,-8.63221665125,-0.4452085937499994,"['xas', 'elasticity', 'bandstructure']",True,"[652491, 87328, 652522, 652502, 652510, 652520, 600518, 186003, 652507, 652513, 652497, 601150, 652514, 652487, 22412, 652509, 652529, 652532, 652499, 652539, 652537, 652533, 652512, 652538, 652490, 652493, 652494, 652511, 652519, 87329, 652526, 652500]",True,2021-05-12 10:56:18.721000,FM,8,13,mp-2567,,V3Si,"{'functional': 'PBE', 'labels': ['V_pv', 'Si'], 'pot_type': 'paw'}","{'V': 3.0, 'Si': 1.0}",GGA,mp-2567,"['mp-920081', 'mp-906309', 'mp-919083', 'mp-2567', 'mp-1078474', 'mp-1078852', 'mp-1138781', 'mp-1145907', 'mp-1440678', 'mp-1668672', 'mp-1795955', 'mp-1593554', 'mp-1596575']",0.8382519,"{'V': 6.0, 'Si': 2.0}",103.98086881866836,[],FM,True,131,1,"[0.2, 0.3, 0.3, 0.2, 0.3, 0.3, 0.0, 0.0]",0.0161231947669493,0.8382519,6,1.6765038,MP,data/source/MP/cleaned/cifs/MP-mp-2567.cif,True,,data/final/MP/graphs/Al0.24Si0.76V3-MP-mp-2567-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Nb2.75Sn1Ta0.25,3,0.125,2.0,False,Nb5.5Sn2Ta0.5,Nb6Sn2,17.8,Other,True,Nb68.75Sn25Ta6.25,Nb-Sn-Ta,3,Supercon,Nb2.75Ta0.25Sn1,MP-mp-1326,Nb6Sn2,Nb-Sn,Nb75Sn25,P m -3 n,cubic,5.334611,5.334611,5.334611,data/final/MP/cifs/Nb2.75Sn1Ta0.25-MP-mp-1326-synth_doped.cif,data/source/MP/raw/cifs/mp-1326.cif,mp-1326,0.0,,2011-05-14 09:51:48,8.694218121896231,10.17188/1189484,"@misc{osti_1189484,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Sn (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189484"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668415'}},0.0,6.59372491,520.0,-69.93787048,-8.74223381,{'tags': ['Niobium tin (3/1)']},-69.93787048,-8.74223381,-0.163862066250001,"['xas', 'elasticity', 'bandstructure']",True,"[105230, 645503, 645489, 105231, 645498, 645485, 645474, 645496, 645480, 645488, 645482, 645487, 645500, 645493, 645477, 645484, 645502, 645483, 150878, 645479, 645481, 645486, 645473]",True,2021-05-12 10:56:12.755000,NM,8,9,mp-1326,,Nb3Sn,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Sn_d'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Sn': 1.0}",GGA,mp-1326,"['mp-930046', 'mp-913770', 'mp-930577', 'mp-1326', 'mp-1440651', 'mp-1668415', 'mp-1880085', 'mp-1594093', 'mp-1594507']",0.62023085,"{'Nb': 6.0, 'Sn': 2.0}",151.81275738025872,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0081709977567491,0.62023085,0,1.2404617,MP,data/source/MP/cleaned/cifs/MP-mp-1326.cif,True,,data/final/MP/graphs/Nb2.75Sn1Ta0.25-MP-mp-1326-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ga0.28Si0.72V3,3,0.14,2.0,False,Ga0.56Si1.44V6,Si2V6,10.5,Other,True,Ga7Si18V75,Ga-Si-V,3,Supercon,V3Si0.72Ga0.28,MP-mp-2567,V6Si2,Si-V,Si25V75,P m -3 n,cubic,4.702381,4.702381,4.702381,data/final/MP/cifs/Ga0.28Si0.72V3-MP-mp-2567-synth_doped.cif,data/source/MP/raw/cifs/mp-2567.cif,mp-2567,0.0,,2011-05-13 19:15:43,5.778142190030859,10.17188/1200874,"@misc{osti_1200874,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Si (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1200874"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668672'}},0.0,7.30599425,520.0,-69.05773321,-8.63221665125,{'tags': ['Vanadium silicide (3/1)']},-69.05773321,-8.63221665125,-0.4452085937499994,"['xas', 'elasticity', 'bandstructure']",True,"[652491, 87328, 652522, 652502, 652510, 652520, 600518, 186003, 652507, 652513, 652497, 601150, 652514, 652487, 22412, 652509, 652529, 652532, 652499, 652539, 652537, 652533, 652512, 652538, 652490, 652493, 652494, 652511, 652519, 87329, 652526, 652500]",True,2021-05-12 10:56:18.721000,FM,8,13,mp-2567,,V3Si,"{'functional': 'PBE', 'labels': ['V_pv', 'Si'], 'pot_type': 'paw'}","{'V': 3.0, 'Si': 1.0}",GGA,mp-2567,"['mp-920081', 'mp-906309', 'mp-919083', 'mp-2567', 'mp-1078474', 'mp-1078852', 'mp-1138781', 'mp-1145907', 'mp-1440678', 'mp-1668672', 'mp-1795955', 'mp-1593554', 'mp-1596575']",0.8382519,"{'V': 6.0, 'Si': 2.0}",103.98086881866836,[],FM,True,131,1,"[0.2, 0.3, 0.3, 0.2, 0.3, 0.3, 0.0, 0.0]",0.0161231947669493,0.8382519,6,1.6765038,MP,data/source/MP/cleaned/cifs/MP-mp-2567.cif,True,,data/final/MP/graphs/Ga0.28Si0.72V3-MP-mp-2567-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ti0.516V0.484,2,0.032,2.0,False,Ti1.032V0.968,Ti1V1,7.2,Other,True,Ti51.6V48.4,Ti-V,2,Supercon,Ti0.516V0.484,MP-mp-1216646,Ti1V1,Ti-V,Ti50V50,C m m m,orthorhombic,2.70340358,2.70340358,4.412961,data/final/MP/cifs/Ti0.516V0.484-MP-mp-1216646-synth_doped.cif,data/source/MP/raw/cifs/mp-1216646.cif,mp-1216646,0.0,,2019-01-12 18:07:09.791000,5.387500532093173,,,{'GGA': {'task_id': 'mp-1675595'}},0.1186071833333333,5.82161176,520.0,-16.74218372,-8.37109186,{'tags': []},-16.74218372,-8.37109186,0.1186071833333333,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,2,5,mp-1216646,,TiV,"{'functional': 'PBE', 'labels': ['Ti_pv', 'V_pv'], 'pot_type': 'paw'}","{'Ti': 1.0, 'V': 1.0}",GGA,mp-1216646,"['mp-1216646', 'mp-1428659', 'mp-1675595', 'mp-1792191', 'mp-1610121']",0.0553406,"{'Ti': 1.0, 'V': 1.0}",30.4548228598316,[],NM,False,65,0,"[0.0, 0.0]",0.0018171374778538,0.0553406,0,0.0553406,MP,data/source/MP/cleaned/cifs/MP-mp-1216646.cif,True,,data/final/MP/graphs/Ti0.516V0.484-MP-mp-1216646-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Lu1Ru2Si2,1,0.0,1.0,True,Lu1Ru2Si2,Lu1Ru2Si2,2.4,Other,True,Lu20Ru40Si40,Lu-Ru-Si,3,Supercon,Lu1Ru2Si2,MP-mp-10453,Lu1Si2Ru2,Lu-Ru-Si,Lu20Ru40Si40,I 4/m m m,tetragonal,4.171314003185432,4.171314003185432,5.55823354,data/final/MP/cifs/Lu1Ru2Si2-MP-mp-10453.cif,data/source/MP/raw/cifs/mp-10453.cif,mp-10453,0.0,,2011-05-28 02:40:15,8.777116988666759,10.17188/1187131,"@misc{osti_1187131,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Lu(SiRu)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187131"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697817'}},0.0,6.90551653,520.0,-38.39898679,-7.679797358,{'tags': ['Lutetium ruthenium silicide (1/2/2)']},-38.39898679,-7.679797358,-0.867325783999999,"['xas', 'elasticity', 'bandstructure']",True,"[90197, 642559]",True,2021-05-12 10:56:10.715000,NM,5,10,mp-10453,,Lu(SiRu)2,"{'functional': 'PBE', 'labels': ['Lu_3', 'Si', 'Ru_pv'], 'pot_type': 'paw'}","{'Lu': 1.0, 'Si': 2.0, 'Ru': 2.0}",GGA,mp-10453,"['mp-990864', 'mp-992867', 'mp-10453', 'mp-568941', 'mp-1144315', 'mp-1438102', 'mp-1697817', 'mp-1783355', 'mp-994174', 'mp-1597094']",0.0018534,"{'Lu': 1.0, 'Si': 2.0, 'Ru': 2.0}",81.97168234482001,[],NM,False,139,0,"[0, 0, 0, 0, 0]",2.2610247185162484e-05,0.0018534,0,0.0018534,MP,data/source/MP/cleaned/cifs/MP-mp-10453.cif,False,,data/final/MP/graphs/Lu1Ru2Si2-MP-mp-10453.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Pd7Se4,1,0.0,2.0,False,Pd14Se8,Pd14Se8,0.0,Other,True,Pd63.636Se36.364,Pd-Se,2,Supercon,Pd7Se4,MP-mp-2503,Pd14Se8,Pd-Se,Pd63.636Se36.364,P 21 21 2,orthorhombic,5.435028,7.024266,10.321027,data/final/MP/cifs/Pd7Se4-MP-mp-2503.cif,data/source/MP/raw/cifs/mp-2503.cif,mp-2503,0.0,,2011-05-18 01:54:34,8.940849132610548,10.17188/1200430,"@misc{osti_1200430,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Pd7Se4 (SG:18) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1200430"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672510'}},0.0,4.7463235,520.0,-106.27083916,-4.830492689090909,{'tags': ['Palladium selenide (7/4)']},-106.27083916,-4.830492689090909,-0.4346000908522718,"['xas', 'bandstructure']",True,"[648822, 77897, 90788]",True,2021-05-12 10:57:01.079000,NM,22,9,mp-2503,,Pd7Se4,"{'functional': 'PBE', 'labels': ['Pd', 'Se'], 'pot_type': 'paw'}","{'Pd': 7.0, 'Se': 4.0}",GGA,mp-2503,"['mp-927772', 'mp-911244', 'mp-927284', 'mp-2503', 'mp-1190595', 'mp-1429755', 'mp-1672510', 'mp-1841496', 'mp-1605622']",0.0075811,"{'Pd': 14.0, 'Se': 8.0}",394.0266981227173,[],NM,False,18,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.848013363621828e-05,0.0075811,0,0.0151622,MP,data/source/MP/cleaned/cifs/MP-mp-2503.cif,False,,data/final/MP/graphs/Pd7Se4-MP-mp-2503.json,0,True,222,0,0,0,4,0,0,0,1,0,0,0,1.0,False
B1Ta2,3,0.1333333333333334,3.0,False,B3Ta6,B4Ta6,1.56,Other,True,B33.333Ta66.667,B-Ta,2,Supercon,B1Ta2,MP-mp-13415,Ta6B4,B-Ta,B40Ta60,P 4/m b m,tetragonal,3.301425,6.214345,6.214345,data/final/MP/cifs/B1Ta2-MP-mp-13415-synth_doped.cif,data/source/MP/raw/cifs/mp-13415.cif,mp-13415,0.0,,2011-05-29 09:51:47,14.70362601339527,10.17188/1189574,"@misc{osti_1189574,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ta3B2 (SG:127) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189574"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700384'}},0.0,6.54255549,520.0,-104.58887113,-10.458887113,{'tags': ['Tantalum boride (3/2)']},-104.58887113,-10.458887113,-0.6724638266666674,"['xas', 'bandstructure']",True,"[615504, 107320, 615517]",True,2021-05-12 10:56:53.126000,NM,10,8,mp-13415,,Ta3B2,"{'functional': 'PBE', 'labels': ['Ta_pv', 'B'], 'pot_type': 'paw'}","{'Ta': 3.0, 'B': 2.0}",GGA,mp-13415,"['mp-920406', 'mp-921424', 'mp-906787', 'mp-13415', 'mp-1420211', 'mp-1700384', 'mp-1802628', 'mp-1593305']",0.0005042,"{'Ta': 6.0, 'B': 4.0}",127.4947072401676,[],NM,False,127,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",7.90934793944372e-06,0.0005042,0,0.0010084,MP,data/source/MP/cleaned/cifs/MP-mp-13415.cif,True,,data/final/MP/graphs/B1Ta2-MP-mp-13415-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ba2Cu3Er0.1Pr0.9O7,2,0.0153846153846153,1.0,True,Ba2Cu3Er0.1Pr0.9O7,Ba2Cu3Pr1O7,0.0,Cuprate,True,Ba15.385Cu23.077Er0.769Pr6.923O53.84615384615385,Ba-Cu-Er-Pr-O,5,Supercon,Er0.1Pr0.9Ba2Cu3O7,MP-mp-20936,Ba2Pr1Cu3O7,Ba-Cu-Pr-O,Ba15.385Cu23.077Pr7.692O53.84615384615385,P m m m,orthorhombic,3.903923,3.95568,11.916432,data/final/MP/cifs/Ba2Cu3Er0.1Pr0.9O7-MP-mp-20936-synth_doped.cif,data/source/MP/raw/cifs/mp-20936.cif,mp-20936,0.0,,2014-02-22 14:41:55,6.480717836004672,10.17188/1196129,"@misc{osti_1196129,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2PrCu3O7 (SG:47) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196129"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698257'}},0.0256000172756332,3.18514576,520.0,-78.62827906,-6.048329158461538,"{'tags': ['Dibarium praseodymium tricopper heptaoxide', 'Praseodymium dibarium dicopper copper(III) oxide', 'Praseodymium dibarium tricopper heptaoxide', 'Praseodymium dibarium copper(III) dicopper oxide']}",-78.62827906,-6.048329158461538,-2.145007016153845,"['xas', 'bandstructure']",True,"[41452, 94377, 81168, 173910, 89221]",True,2021-05-12 10:56:57.051000,NM,13,8,mp-20936,oxide,Ba2PrCu3O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Pr_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Pr': 1.0, 'Cu': 3.0, 'O': 7.0}",GGA,mp-20936,"['mp-988090', 'mp-987725', 'mp-20936', 'mp-1417367', 'mp-1698257', 'mp-1833655', 'mp-988324', 'mp-1602318']",0.0007234,"{'Ba': 2.0, 'Pr': 1.0, 'Cu': 3.0, 'O': 7.0}",184.02152853403555,[],NM,False,47,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.931061793491212e-06,0.0007234,0,0.0007234,MP,data/source/MP/cleaned/cifs/MP-mp-20936.cif,True,,data/final/MP/graphs/Ba2Cu3Er0.1Pr0.9O7-MP-mp-20936-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Hf1Rh3,1,0.0,1.0,True,Hf1Rh3,Hf1Rh3,0.0,Other,True,Hf25Rh75,Hf-Rh,2,Supercon,Hf1Rh3,MP-mp-1027,Hf1Rh3,Hf-Rh,Hf25Rh75,P m -3 m,cubic,3.952285,3.952285,3.952285,data/final/MP/cifs/Hf1Rh3-MP-mp-1027.cif,data/source/MP/raw/cifs/mp-1027.cif,mp-1027,0.0,,2011-05-13 05:26:44,13.104408081912483,10.17188/1186864,"@misc{osti_1186864,
    author = ""Persson, Kristin"",
    title = ""Materials Data on HfRh3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1186864"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672139'}},0.0,6.20119709,520.0,-35.03566384,-8.75891596,{'tags': ['Hafnium rhodium (1/3)']},-35.03566384,-8.75891596,-0.7463878449999992,"['xas', 'elasticity', 'bandstructure']",True,"[638821, 104266, 185648]",True,2021-05-12 10:56:10.715000,NM,4,12,mp-1027,,HfRh3,"{'functional': 'PBE', 'labels': ['Hf_pv', 'Rh_pv'], 'pot_type': 'paw'}","{'Hf': 1.0, 'Rh': 3.0}",GGA,mp-1027,"['mp-993432', 'mp-991482', 'mp-1027', 'mp-1067668', 'mp-1067697', 'mp-1067724', 'mp-1439760', 'mp-1672139', 'mp-1794783', 'mp-994743', 'mp-1594457', 'mp-1067727']",0.0024915,"{'Hf': 1.0, 'Rh': 3.0}",61.73689202094674,[],NM,False,221,0,"[0, 0, 0, 0]",4.03567448642322e-05,0.0024915,0,0.0024915,MP,data/source/MP/cleaned/cifs/MP-mp-1027.cif,False,,data/final/MP/graphs/Hf1Rh3-MP-mp-1027.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
B2Co3Lu1,1,0.0,1.0,True,B2Co3Lu1,B2Co3Lu1,0.0,Other,True,B33.333Co50Lu16.667,B-Co-Lu,3,Supercon,Lu1Co3B2,MP-mp-15709,Lu1Co3B2,B-Co-Lu,B33.333Co50Lu16.667,P 6/m m m,hexagonal,3.023016,4.9393040020548655,4.93930336,data/final/MP/cifs/B2Co3Lu1-MP-mp-15709.cif,data/source/MP/raw/cifs/mp-15709.cif,mp-15709,0.0,,2011-05-28 01:10:45,9.707504911019516,10.17188/1191337,"@misc{osti_1191337,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LuCo3B2 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191337"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687752'}},0.0,5.55738956,520.0,-42.46184627,-7.076974378333333,{'tags': ['Lutetium cobalt boride (1/3/2)']},-42.46184627,-7.076974378333333,-0.5428598038888891,"['xas', 'bandstructure']",True,[44171],True,2021-05-12 10:56:53.126000,NM,6,8,mp-15709,,LuCo3B2,"{'functional': 'PBE', 'labels': ['Lu_3', 'Co', 'B'], 'pot_type': 'paw'}","{'Lu': 1.0, 'Co': 3.0, 'B': 2.0}",GGA,mp-15709,"['mp-1000788', 'mp-1007241', 'mp-15709', 'mp-1300849', 'mp-1687752', 'mp-1784128', 'mp-1011983', 'mp-1591064']",0.0540857,"{'Lu': 1.0, 'Co': 3.0, 'B': 2.0}",63.87082346063705,[],NM,False,191,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0008467982260058,0.0540857,0,0.0540857,MP,data/source/MP/cleaned/cifs/MP-mp-15709.cif,False,,data/final/MP/graphs/B2Co3Lu1-MP-mp-15709.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Al0.402V0.598,3,0.1373333333333333,3.0,False,Al1.206V1.794,Al1V2,0.0,Other,True,Al40.2V59.8,Al-V,2,Supercon,Al0.402V0.598,MP-mp-1228006,Al1V2,Al-V,Al33.333V66.667,F m m m,orthorhombic,2.638417030067773,2.63841703,6.52520259,data/final/MP/cifs/Al0.402V0.598-MP-mp-1228006-synth_doped.cif,data/source/MP/raw/cifs/mp-1228006.cif,mp-1228006,0.0,,2019-01-13 03:46:17.646000,5.060291952263772,,,{'GGA': {'task_id': 'mp-1765520'}},0.0197279783333339,6.79077974,520.0,-22.34946043,-7.449820143333333,{'tags': []},-22.34946043,-7.449820143333333,-0.1453574866666672,['bandstructure'],True,[],True,2021-05-12 10:58:49.477000,NM,3,5,mp-1228006,,AlV2,"{'functional': 'PBE', 'labels': ['Al', 'V_pv'], 'pot_type': 'paw'}","{'Al': 1.0, 'V': 2.0}",GGA,mp-1228006,"['mp-1228006', 'mp-1434860', 'mp-1765520', 'mp-1790730', 'mp-1629563']",0.0011423,"{'Al': 1.0, 'V': 2.0}",42.28700688879334,[],NM,False,69,0,"[0.0, -0.0, -0.0]",2.7013025608646843e-05,0.0011423,0,0.0011423,MP,data/source/MP/cleaned/cifs/MP-mp-1228006.cif,True,,data/final/MP/graphs/Al0.402V0.598-MP-mp-1228006-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,0,0,1,1.0,False
As2Pt2Sr1,1,0.0,4.0,False,As8Pt8Sr4,As8Pt8Sr4,5.083333333,Other,True,As40Pt40Sr20,As-Pt-Sr,3,Supercon,Sr1Pt2As2,MP-mp-571534,Sr4As8Pt8,As-Pt-Sr,As40Pt40Sr20,P 1 21/c 1,monoclinic,4.525638,8.998361999999998,10.09417957,data/final/MP/cifs/As2Pt2Sr1-MP-mp-571534.cif,data/source/MP/raw/cifs/mp-571534.cif,mp-571534,0.0,,2014-02-24 20:00:30,10.142405921941448,10.17188/1276307,"@misc{osti_1276307,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr(AsPt)2 (SG:14) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1276307"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1675398'}},0.0267469720000015,5.5773686,520.0,-108.07977415,-5.4039887075,{'tags': ['High pressure experimental phase']},-108.07977415,-5.4039887075,-0.7740795708333337,"['xas', 'bandstructure']",True,[418156],True,2021-05-12 10:57:26.891000,NM,20,8,mp-571534,,Sr(AsPt)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'As', 'Pt'], 'pot_type': 'paw'}","{'Sr': 1.0, 'As': 2.0, 'Pt': 2.0}",GGA,mp-571534,"['mp-918350', 'mp-919366', 'mp-904976', 'mp-571534', 'mp-1382194', 'mp-1675398', 'mp-1817649', 'mp-1629993']",6.0625e-05,"{'Sr': 4.0, 'As': 8.0, 'Pt': 8.0}",411.02915226944094,[],NM,False,14,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.899824833860801e-07,6.0625e-05,0,0.0002425,MP,data/source/MP/cleaned/cifs/MP-mp-571534.cif,False,,data/final/MP/graphs/As2Pt2Sr1-MP-mp-571534.json,0,True,2/m,0,0,3,0,0,0,0,1,0,0,0,1.0,False
Co1Ga5Pu0.9U0.1,2,0.0285714285714285,1.0,True,Co1Ga5Pu0.9U0.1,Co1Ga5Pu1,8.4,Heavy_fermion,True,Co14.286Ga71.429Pu12.857U1.429,Co-Ga-Pu-U,4,Supercon,Pu0.9U0.1Co1Ga5,MP-mp-1206185,Pu1Ga5Co1,Co-Ga-Pu,Co14.286Ga71.429Pu14.286,P 4/m m m,tetragonal,4.21614,4.21614,6.713162,data/final/MP/cifs/Co1Ga5Pu0.9U0.1-MP-mp-1206185-synth_doped.cif,data/source/MP/raw/cifs/mp-1206185.cif,mp-1206185,0.0,,2019-01-12 09:32:50.345000,9.066475010423687,,,{'GGA': {'task_id': 'mp-1735508'}},0.1559735717857142,5.95141073,520.0,-37.77932529,-5.39704647,"{'tags': ['PuCoGa5 hyp', 'HoCoGa5']}",-37.77932529,-5.39704647,-0.1803841503571429,['bandstructure'],True,[],True,2021-05-12 10:58:37.524000,FM,7,5,mp-1206185,,PuGa5Co,"{'functional': 'PBE', 'labels': ['Pu', 'Ga_d', 'Co'], 'pot_type': 'paw'}","{'Pu': 1.0, 'Ga': 5.0, 'Co': 1.0}",GGA,mp-1206185,"['mp-1206185', 'mp-1446054', 'mp-1735508', 'mp-1784841', 'mp-1627590']",0.283083,"{'Pu': 1.0, 'Ga': 5.0, 'Co': 1.0}",119.33207010732774,[],FM,True,123,2,"[0.3, -0.0, -0.0, -0.0, -0.0, -0.0, 0.1]",0.0023722290223021,0.283083,2,0.283083,MP,data/source/MP/cleaned/cifs/MP-mp-1206185.cif,True,,data/final/MP/graphs/Co1Ga5Pu0.9U0.1-MP-mp-1206185-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ba2Cu1Hg1O4.052,2,0.0064580228514654,0.987041707798618,True,Ba1.974Cu0.987Hg0.987O4,Ba2Cu1Hg1O4,82.0,Cuprate,True,Ba24.839Cu12.419Hg12.419O50.32290114257327,Ba-Cu-Hg-O,4,Supercon,Hg1Ba2Cu1O4.052,MP-mp-6562,Ba2Cu1Hg1O4,Ba-Cu-Hg-O,Ba25Cu12.5Hg12.5O50,P 4/m m m,tetragonal,3.933714,3.933714,9.827602,data/final/MP/cifs/Ba2Cu1Hg1O4.052-MP-mp-6562-synth_doped.cif,data/source/MP/raw/cifs/mp-6562.cif,mp-6562,0.0,,2011-05-13 18:18:06,6.582036471328142,10.17188/1281336,"@misc{osti_1281336,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2CuHgO4 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281336"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697135'}},0.0234340381250053,2.58068675,520.0,-40.91481298,-5.1143516225,"{'tags': ['Mercury dibarium copper oxide', 'High pressure experimental phase']}",-40.91481298,-5.1143516225,-1.953767533125,"['xas', 'bandstructure']",True,"[75722, 75720, 75724, 75721, 75723]",True,2021-05-12 10:57:32.679000,NM,8,8,mp-6562,oxide,Ba2CuHgO4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Cu_pv', 'Hg', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",GGA,mp-6562,"['mp-6562', 'mp-990899', 'mp-992892', 'mp-1435690', 'mp-1697135', 'mp-1878488', 'mp-994198', 'mp-1592659']",0.0003984,"{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",152.07335344042525,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0, 0, 0]",2.619788352047311e-06,0.0003984,0,0.0003984,MP,data/source/MP/cleaned/cifs/MP-mp-6562.cif,True,,data/final/MP/graphs/Ba2Cu1Hg1O4.052-MP-mp-6562-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ga3Sc1,1,0.0,1.0,True,Ga3Sc1,Ga3Sc1,2.1,Other,True,Ga75Sc25,Ga-Sc,2,Supercon,Ga3Sc1,MP-mp-932,Sc1Ga3,Ga-Sc,Ga75Sc25,P m -3 m,cubic,4.121613,4.121613,4.121613,data/final/MP/cifs/Ga3Sc1-MP-mp-932.cif,data/source/MP/raw/cifs/mp-932.cif,mp-932,0.0,,2011-05-13 02:52:24,6.0269099870401615,10.17188/1281977,"@misc{osti_1281977,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ScGa3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281977"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1673202'}},0.0,4.62384207,520.0,-17.41944649,-4.3548616225,{'tags': ['Gallium scandium (3/1)']},-17.41944649,-4.3548616225,-0.5006723293749991,"['xas', 'elasticity', 'bandstructure']",True,"[635343, 635332, 103958, 103959]",True,2021-05-12 10:56:35.166000,NM,4,8,mp-932,,ScGa3,"{'functional': 'PBE', 'labels': ['Sc_sv', 'Ga_d'], 'pot_type': 'paw'}","{'Sc': 1.0, 'Ga': 3.0}",GGA,mp-932,"['mp-912476', 'mp-929310', 'mp-928964', 'mp-932', 'mp-1439804', 'mp-1673202', 'mp-1798946', 'mp-1595394']",0.0006952,"{'Sc': 1.0, 'Ga': 3.0}",70.01669928366148,[],NM,False,221,0,"[0, 0, 0, 0]",9.92905988303602e-06,0.0006952,0,0.0006952,MP,data/source/MP/cleaned/cifs/MP-mp-932.cif,False,,data/final/MP/graphs/Ga3Sc1-MP-mp-932.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ce0.9Pr0.1Ru2,3,0.0666666666666666,2.0,False,Ce1.8Pr0.2Ru4,Ce2Ru4,6.55,Heavy_fermion,True,Ce30Pr3.333Ru66.667,Ce-Pr-Ru,3,Supercon,Ce0.9Pr0.1Ru2,MP-mp-607,Ce2Ru4,Ce-Ru,Ce33.333Ru66.667,F d -3 m,cubic,5.35903077,5.35903077,5.35903077,data/final/MP/cifs/Ce0.9Pr0.1Ru2-MP-mp-607-synth_doped.cif,data/source/MP/raw/cifs/mp-607.cif,mp-607,0.0,,2011-05-13 22:34:26,10.444470046690055,10.17188/1277529,"@misc{osti_1277529,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeRu2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277529"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686879'}},0.0,8.61419203,520.0,-50.66413619,-8.444022698333333,"{'tags': ['Cerium ruthenium (1/2)', 'Cerium ruthenium hydride (1/2/4)']}",-50.66413619,-8.444022698333333,-0.2833998766666663,"['xas', 'elasticity', 'bandstructure']",True,"[621326, 656077, 621978, 621973, 621980, 621984, 102277, 621972, 621976, 621979, 604113, 621977, 621982, 621983, 102276, 656078]",True,2021-05-12 10:56:27.046000,NM,6,14,mp-607,,CeRu2,"{'functional': 'PBE', 'labels': ['Ce', 'Ru_pv'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Ru': 2.0}",GGA,mp-607,"['mp-928203', 'mp-912221', 'mp-928809', 'mp-607', 'mp-1071462', 'mp-1071593', 'mp-1071613', 'mp-1077792', 'mp-1440763', 'mp-1686879', 'mp-1803198', 'mp-1591928', 'mp-1591642', 'mp-1071635']",1.005e-05,"{'Ce': 2.0, 'Ru': 4.0}",108.82877852828122,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",1.846937939745105e-07,1.005e-05,0,2.01e-05,MP,data/source/MP/cleaned/cifs/MP-mp-607.cif,True,,data/final/MP/graphs/Ce0.9Pr0.1Ru2-MP-mp-607-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
C1Th1,1,0.0,1.0,True,C1Th1,C1Th1,0.0,Other,True,C50Th50,C-Th,2,Supercon,C1Th1,MP-mp-1164,Th1C1,C-Th,C50Th50,F m -3 m,cubic,3.7862768,3.7862768,3.7862768,data/final/MP/cifs/C1Th1-MP-mp-1164.cif,data/source/MP/raw/cifs/mp-1164.cif,mp-1164,0.0,,2011-05-12 17:45:12,10.558533930758896,10.17188/1188121,"@misc{osti_1188121,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ThC (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188121"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668825'}},0.0,6.95598381,520.0,-17.19332327,-8.596661635,"{'tags': ['Thorium carbide (1/1)', 'Thorium carbide', 'Thorium carbide (2.66/5.32)']}",-17.19332327,-8.596661635,-0.2763421600000004,"['xas', 'elasticity', 'bandstructure']",True,"[618902, 618907, 260883, 618908, 618913, 618905, 618894, 43378, 290715, 618899, 618904, 618910]",True,2021-05-12 10:56:12.755000,NM,2,17,mp-1164,,ThC,"{'functional': 'PBE', 'labels': ['Th', 'C'], 'pot_type': 'paw'}","{'Th': 1.0, 'C': 1.0}",GGA,mp-1164,"['mp-925968', 'mp-1164', 'mp-1060268', 'mp-1060278', 'mp-1060307', 'mp-1060355', 'mp-1060372', 'mp-1060393', 'mp-910006', 'mp-925535', 'mp-1440621', 'mp-1668825', 'mp-1793462', 'mp-1591913', 'mp-1587491', 'mp-1060391', 'mp-1060303']",0.0004217,"{'Th': 1.0, 'C': 1.0}",38.38151231912174,[],NM,False,225,0,"[0, 0]",1.0987060553888293e-05,0.0004217,0,0.0004217,MP,data/source/MP/cleaned/cifs/MP-mp-1164.cif,False,,data/final/MP/graphs/C1Th1-MP-mp-1164.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
H0.94Pd1,2,0.0309278350515464,2.0,False,H1.88Pd2,H2Pd2,6.6,Other,True,H48.454Pd51.546,H-Pd,2,Supercon,H0.94Pd1,MP-mp-1184548,H2Pd2,H-Pd,H50Pd50,P 63 m c,hexagonal,2.968136003881316,2.96813585,5.040799,data/final/MP/cifs/H0.94Pd1-MP-mp-1184548-synth_doped.cif,data/source/MP/raw/cifs/mp-1184548.cif,mp-1184548,0.0,,2019-01-11 12:52:40.348000,9.276812227294194,,,{'GGA': {'task_id': 'mp-1734957'}},0.0,3.52113336,520.0,-17.47744839,-4.3693620975,{'tags': []},-17.47744839,-4.3693620975,-0.0830581699999992,['bandstructure'],True,[],True,2021-05-12 10:58:27.755000,NM,4,5,mp-1184548,,HPd,"{'functional': 'PBE', 'labels': ['H', 'Pd'], 'pot_type': 'paw'}","{'H': 1.0, 'Pd': 1.0}",GGA,mp-1184548,"['mp-1184548', 'mp-1426775', 'mp-1734957', 'mp-1792734', 'mp-1612181']",3.7e-05,"{'H': 2.0, 'Pd': 2.0}",38.45896345503417,[],NM,False,186,0,"[0, 0, 0, 0]",1.924128820749941e-06,3.7e-05,0,7.4e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1184548.cif,True,,data/final/MP/graphs/H0.94Pd1-MP-mp-1184548-synth_doped.json,0,True,6mm,0,5,0,0,0,0,0,1,0,0,0,1.0,False
Ba1Bi0.2Pb0.8O3,3,0.0799999999999999,2.0,False,Ba2Bi0.4Pb1.6O6,Ba2Pb2O6,9.875,Oxide,True,Ba20Bi4Pb16O60,Ba-Bi-Pb-O,4,Supercon,Ba1Pb0.8Bi0.2O3,MP-mp-22230,Ba2Pb2O6,Ba-Pb-O,Ba20Pb20O60,I m m a,orthorhombic,6.133862002250079,6.155866510000001,6.155866509646406,data/final/MP/cifs/Ba1Bi0.2Pb0.8O3-MP-mp-22230-synth_doped.cif,data/source/MP/raw/cifs/mp-22230.cif,mp-22230,0.2093999999999996,,2014-02-21 02:34:22,7.878976238337828,10.17188/1197446,"@misc{osti_1197446,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BaPbO3 (SG:74) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197446"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677620'}},0.0,2.99294363,520.0,-57.91751158,-5.791751158,"{'tags': ['Barium plumbate(IV)', 'Barium lead oxide', 'Barium plumbate', 'Barium lead(IV) oxide']}",-57.91751158,-5.791751158,-2.1088509750000006,"['xas', 'bandstructure']",True,"[252031, 94313, 154038, 245600, 51657, 94312, 245601, 78681, 154039, 15933, 67811, 245602]",True,2021-05-12 10:56:59.077000,NM,10,7,mp-22230,oxide,BaPbO3,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Pb_d', 'O'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Pb': 1.0, 'O': 3.0}",GGA,mp-22230,"['mp-547522', 'mp-22230', 'mp-1078282', 'mp-1437547', 'mp-1677620', 'mp-1828697', 'mp-1589590']",5.66e-05,"{'Ba': 2.0, 'Pb': 2.0, 'O': 6.0}",165.45383803885784,[],NM,False,74,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.841787494431788e-07,5.66e-05,0,0.0001132,MP,data/source/MP/cleaned/cifs/MP-mp-22230.cif,True,,data/final/MP/graphs/Ba1Bi0.2Pb0.8O3-MP-mp-22230-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,0,1,0,0.5,False
Fe2Zr1,1,0.0,2.0,False,Fe4Zr2,Fe4Zr2,0.0,Other,True,Fe66.667Zr33.333,Fe-Zr,2,Supercon,Fe2Zr1,MP-mp-1718,Zr2Fe4,Fe-Zr,Fe66.667Zr33.333,F d -3 m,cubic,4.985067450000001,4.98506745,4.98506745,data/final/MP/cifs/Fe2Zr1-MP-mp-1718.cif,data/source/MP/raw/cifs/mp-1718.cif,mp-1718,0.0,,2011-05-13 22:57:36,7.692951349068744,10.17188/1192376,"@misc{osti_1192376,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrFe2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1192376"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686911'}},0.0,5.0018912,520.0,-52.65811053,-8.776351755,"{'tags': ['Iron scandium zirconium (4/1/1)', 'Iron zirconium (2/1)', 'Zirconium iron (1/2)']}",-52.65811053,-8.776351755,-0.2804459116666677,"['xas', 'elasticity', 'bandstructure']",True,"[634186, 106701, 634174, 634148, 96315, 634158, 634172, 634187, 634159, 634163, 103714, 634166, 634190, 634156, 634155, 634179, 634181, 634189, 634165, 633464, 634162, 634173, 103715, 55590, 634143, 634178, 634168, 634147, 634161]",True,2021-05-12 10:56:14.760000,FiM,6,10,mp-1718,,ZrFe2,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Fe_pv'], 'pot_type': 'paw'}","{'Zr': 1.0, 'Fe': 2.0}",GGA,mp-1718,"['mp-906980', 'mp-920542', 'mp-1718', 'mp-1077801', 'mp-1440748', 'mp-1686911', 'mp-1801114', 'mp-921561', 'mp-1593652', 'mp-1596661']",3.05398945,"{'Zr': 2.0, 'Fe': 4.0}",87.59879241946872,[],FiM,True,227,2,"[-0.5, -0.5, 1.9, 1.9, 1.9, 1.9]",0.0697267477244641,3.05398945,6,6.1079789,MP,data/source/MP/cleaned/cifs/MP-mp-1718.cif,False,,data/final/MP/graphs/Fe2Zr1-MP-mp-1718.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ce0.07Ge12Pr0.93Pt4,2,0.008235294117647,1.0,True,Ce0.07Ge12Pr0.93Pt4,Ge12Pr1Pt4,5.52,Heavy_fermion,True,Ce0.412Ge70.588Pr5.471Pt23.529,Ce-Ge-Pr-Pt,4,Supercon,Pr0.93Ce0.07Pt4Ge12,MP-mp-1105939,Pr1Ge12Pt4,Ge-Pr-Pt,Ge70.588Pr5.882Pt23.529,I m -3,cubic,7.560907531676135,7.560907530000001,7.56090753,data/final/MP/cifs/Ce0.07Ge12Pr0.93Pt4-MP-mp-1105939-synth_doped.cif,data/source/MP/raw/cifs/mp-1105939.cif,mp-1105939,0.0,,2018-07-19 06:58:09,8.947691530234051,,,{'GGA': {'task_id': 'mp-1705662'}},0.0059454020588258,4.25899828,520.0,-91.15368674,-5.361981572941176,{'tags': ['Praseodymium platinum germanide (1/4/12)']},-91.15368674,-5.361981572941176,-0.3889895585294119,['bandstructure'],True,[174554],True,2021-05-12 10:58:22.271000,NM,17,5,mp-1105939,,Pr(Ge3Pt)4,"{'functional': 'PBE', 'labels': ['Pr_3', 'Ge_d', 'Pt'], 'pot_type': 'paw'}","{'Pr': 1.0, 'Ge': 12.0, 'Pt': 4.0}",GGA,mp-1105939,"['mp-1105939', 'mp-1427343', 'mp-1705662', 'mp-1805701', 'mp-1584493']",0.0022709,"{'Pr': 1.0, 'Ge': 12.0, 'Pt': 4.0}",332.73607546662794,[],NM,False,204,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.824928727115922e-06,0.0022709,0,0.0022709,MP,data/source/MP/cleaned/cifs/MP-mp-1105939.cif,True,,data/final/MP/graphs/Ce0.07Ge12Pr0.93Pt4-MP-mp-1105939-synth_doped.json,0,True,m-3,2,0,0,0,0,0,0,0,0,1,0,1.0,False
C0.48Nb1,2,0.018018018018018,8.0,False,C3.84Nb8,C4Nb8,0.0,Other,True,C32.432Nb67.568,C-Nb,2,Supercon,C0.48Nb1,MP-mp-569989,Nb8C4,C-Nb,C33.333Nb66.667,P n m a,orthorhombic,3.106926,4.999598,11.023332,data/final/MP/cifs/C0.48Nb1-MP-mp-569989-synth_doped.cif,data/source/MP/raw/cifs/mp-569989.cif,mp-569989,0.0,,2014-02-16 07:25:00,7.673756240471026,10.17188/1275403,"@misc{osti_1275403,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb2C (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1275403"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704125'}},0.0,5.52186425,520.0,-123.31748068,-10.276456723333334,{'tags': []},-123.31748068,-10.276456723333334,-0.4666597966666674,"['xas', 'elasticity', 'bandstructure']",True,[31973],True,2021-05-12 10:56:22.739000,NM,12,8,mp-569989,,Nb2C,"{'functional': 'PBE', 'labels': ['Nb_pv', 'C'], 'pot_type': 'paw'}","{'Nb': 2.0, 'C': 1.0}",GGA,mp-569989,"['mp-920740', 'mp-907295', 'mp-921769', 'mp-569989', 'mp-1435281', 'mp-1704125', 'mp-1789819', 'mp-1599122']",0.000586975,"{'Nb': 8.0, 'C': 4.0}",171.22961601908742,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.3711997109999204e-05,0.000586975,0,0.0023479,MP,data/source/MP/cleaned/cifs/MP-mp-569989.cif,True,,data/final/MP/graphs/C0.48Nb1-MP-mp-569989-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ba2Ca0.25Cu4Y0.75O8,3,0.0333333333333333,1.0,True,Ba2Ca0.25Cu4Y0.75O8,Ba2Cu4Y1O8,82.9,Cuprate,True,Ba13.333Ca1.667Cu26.667Y5O53.333333333333336,Ba-Ca-Cu-Y-O,5,Supercon,Y0.75Ca0.25Ba2Cu4O8,MP-mp-6790,Ba2Y1Cu4O8,Ba-Cu-Y-O,Ba13.333Cu26.667Y6.667O53.333333333333336,C m m m,orthorhombic,3.889922,3.899603999537882,13.88942687,data/final/MP/cifs/Ba2Ca0.25Cu4Y0.75O8-MP-mp-6790-synth_doped.cif,data/source/MP/raw/cifs/mp-6790.cif,mp-6790,0.0,,2011-05-16 03:21:24,5.936250568336678,10.17188/1283441,"@misc{osti_1283441,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Y(CuO2)4 (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1283441"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686864'}},0.0,3.31391536,520.0,-91.58381472,-6.105587648,"{'tags': ['Yttrium barium copper oxide (1/2/4/8)', 'High pressure experimental phase']}",-91.58381472,-6.105587648,-2.0529924817777783,"['xas', 'bandstructure']",True,"[72261, 85273, 74251, 400273, 85277, 85275, 400280, 67632, 85272, 67631, 83920, 66613, 85279, 400277, 75689, 74259, 85278, 85280, 66603, 94265, 400276, 88873, 71417, 75712, 97052, 66605, 72258, 85281, 85274, 400279, 66604, 69698]",True,2021-05-12 10:57:34.594000,NM,15,10,mp-6790,oxide,Ba2Y(CuO2)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-6790,"['mp-1000664', 'mp-6790', 'mp-1007136', 'mp-1237713', 'mp-1440937', 'mp-1686864', 'mp-1834179', 'mp-1011883', 'mp-1590064', 'mp-1590433']",0.0004643,"{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",208.60454115924333,[],NM,False,65,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.225742533790601e-06,0.0004643,0,0.0004643,MP,data/source/MP/cleaned/cifs/MP-mp-6790.cif,True,,data/final/MP/graphs/Ba2Ca0.25Cu4Y0.75O8-MP-mp-6790-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Be12Ta1,1,0.0,1.0,True,Be12Ta1,Be12Ta1,0.0,Other,True,Be92.308Ta7.692,Be-Ta,2,Supercon,Be12Ta1,MP-mp-567842,Ta1Be12,Be-Ta,Be92.308Ta7.692,I 4/m m m,tetragonal,4.213959997726749,5.574445049027919,5.57444505,data/final/MP/cifs/Be12Ta1-MP-mp-567842.cif,data/source/MP/raw/cifs/mp-567842.cif,mp-567842,0.0,,2014-02-24 17:23:04,4.2770465082757205,10.17188/1183325,"@misc{osti_1183325,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TaBe12 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1183325"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696794'}},0.0,4.640236,520.0,-58.541769,-4.503213000000001,{'tags': ['Beryllium tantalum (12/1)']},-58.541769,-4.503213000000001,-0.139310537692308,"['xas', 'elasticity', 'bandstructure']",True,"[109317, 616426]",True,2021-05-12 10:56:22.739000,NM,13,8,mp-567842,,TaBe12,"{'functional': 'PBE', 'labels': ['Ta_pv', 'Be_sv'], 'pot_type': 'paw'}","{'Ta': 1.0, 'Be': 12.0}",GGA,mp-567842,"['mp-1006870', 'mp-1000397', 'mp-567842', 'mp-1429744', 'mp-1696794', 'mp-1804355', 'mp-1011607', 'mp-1601321']",0.0016591,"{'Ta': 1.0, 'Be': 12.0}",112.2391319021902,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.4781832074804428e-05,0.0016591,0,0.0016591,MP,data/source/MP/cleaned/cifs/MP-mp-567842.cif,False,,data/final/MP/graphs/Be12Ta1-MP-mp-567842.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Rh1Se1.75,3,0.0727272727272727,6.8570714285714285,False,Rh6.857Se12,Rh8Se12,6.0,Other,True,Rh36.364Se63.636,Rh-Se,2,Supercon,Rh1Se1.75,MP-mp-1105666,Rh8Se12,Rh-Se,Rh40Se60,P b c n,orthorhombic,6.40112,6.528961,9.028515,data/final/MP/cifs/Rh1Se1.75-MP-mp-1105666-synth_doped.cif,data/source/MP/raw/cifs/mp-1105666.cif,mp-1105666,0.0,,2018-07-19 05:33:41,7.792797919168858,,,{'GGA': {'task_id': 'mp-1672524'}},0.0,5.34141672,520.0,-108.98817982,-5.449408991,"{'tags': ['Rhodium selenide (2/3)', 'Rh2Se3 rt', 'Rh2S3']}",-108.98817982,-5.449408991,-0.6893389564062495,['bandstructure'],True,[650282],True,2021-05-12 10:58:22.271000,NM,20,5,mp-1105666,,Rh2Se3,"{'functional': 'PBE', 'labels': ['Rh_pv', 'Se'], 'pot_type': 'paw'}","{'Rh': 2.0, 'Se': 3.0}",GGA,mp-1105666,"['mp-1105666', 'mp-1428202', 'mp-1672524', 'mp-1842625', 'mp-1584235']",0.000419625,"{'Rh': 8.0, 'Se': 12.0}",377.3256833076576,[],NM,False,60,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.44841174151247e-06,0.000419625,0,0.0016785,MP,data/source/MP/cleaned/cifs/MP-mp-1105666.cif,True,,data/final/MP/graphs/Rh1Se1.75-MP-mp-1105666-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Sn0.995Te1,2,0.0025062656641604,1.0,True,Sn0.995Te1,Sn1Te1,0.0138,Other,True,Sn49.875Te50.125,Sn-Te,2,Supercon,Sn0.995Te1,MP-mp-1883,Sn1Te1,Sn-Te,Sn50Te50,F m -3 m,cubic,4.53766968,4.53766968,4.53766968,data/final/MP/cifs/Sn0.995Te1-MP-mp-1883-synth_doped.cif,data/source/MP/raw/cifs/mp-1883.cif,mp-1883,0.6623999999999999,,2011-05-12 18:43:07,6.19081042904143,10.17188/1193534,"@misc{osti_1193534,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SnTe (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1193534"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686906'}},0.0,6.06645058,520.0,-7.72519638,-3.86259819,"{'tags': ['Tin telluride (1/1)', 'Tin telluride']}",-7.72519638,-3.86259819,-0.4971617975000004,"['eos', 'elasticity', 'bandstructure', 'xas']",True,"[52489, 652760, 652744, 652756, 652761, 600865, 652763, 652745, 652742, 604177, 600813, 652741, 601065, 652750, 652755, 652753, 652751, 652749, 652752, 600136, 652754, 652746, 652759]",True,2021-05-12 10:56:14.760000,NM,2,9,mp-1883,,SnTe,"{'functional': 'PBE', 'labels': ['Sn_d', 'Te'], 'pot_type': 'paw'}","{'Sn': 1.0, 'Te': 1.0}",GGA,mp-1883,"['mp-663289', 'mp-655511', 'mp-657302', 'mp-1883', 'mp-1440781', 'mp-1686906', 'mp-1784332', 'mp-1596407', 'mp-1596974']",0.0,"{'Sn': 1.0, 'Te': 1.0}",66.06685541129963,[],NM,False,225,0,"[0, 0]",0.0,0.0,0,0.0,MP,data/source/MP/cleaned/cifs/MP-mp-1883.cif,True,,data/final/MP/graphs/Sn0.995Te1-MP-mp-1883-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
B2C1Ho0.75Lu0.25Ni2,3,0.0833333333333333,1.0,True,B2C1Ho0.75Lu0.25Ni2,B2C1Ho1Ni2,8.81,Other,True,B33.333C16.667Ho12.5Lu4.167Ni33.333,B-C-Ho-Lu-Ni,5,Supercon,Ho0.75Lu0.25Ni2B2C1,MP-mp-6646,Ho1Ni2B2C1,B-C-Ho-Ni,B33.333C16.667Ho16.667Ni33.333,I 4/m m m,tetragonal,3.529863997734658,3.529863997734658,5.76032203,data/final/MP/cifs/B2C1Ho0.75Lu0.25Ni2-MP-mp-6646-synth_doped.cif,data/source/MP/raw/cifs/mp-6646.cif,mp-6646,0.0,,2011-05-13 04:24:09,8.11075125231065,10.17188/1281460,"@misc{osti_1281460,
    author = ""Persson, Kristin"",
    title = ""Materials Data on HoNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281460"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1670774'}},0.0,6.70981387,520.0,-41.84364575,-6.973940958333333,{'tags': ['Holmium dinickel diboride carbide']},-41.84364575,-6.973940958333333,-0.5192332130555558,"['xas', 'elasticity', 'bandstructure']",True,"[79064, 56650, 79065, 79062, 79063, 79575]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-6646,,HoNi2B2C,"{'functional': 'PBE', 'labels': ['Ho_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Ho': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6646,"['mp-1007146', 'mp-6646', 'mp-1000682', 'mp-1439301', 'mp-1670774', 'mp-1782657', 'mp-1011887', 'mp-1589032']",0.0032459,"{'Ho': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",64.68537905730652,[],NM,False,139,0,"[0.0, -0.0, -0.0, 0.0, 0.0, 0.0]",5.017980952271099e-05,0.0032459,0,0.0032459,MP,data/source/MP/cleaned/cifs/MP-mp-6646.cif,True,,data/final/MP/graphs/B2C1Ho0.75Lu0.25Ni2-MP-mp-6646-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As1Fe0.975Na1Ni0.025,2,0.0166666666666666,2.0,False,As2Fe1.95Na2Ni0.05,As2Fe2Na2,15.4,Ferrite,True,As33.333Fe32.5Na33.333Ni0.833,As-Fe-Na-Ni,4,Supercon,Na1Fe0.975Ni0.025As1,MP-mp-22152,Na2Fe2As2,As-Fe-Na,As33.333Fe33.333Na33.333,P 4/n m m,tetragonal,3.923688,3.923688,6.918844,data/final/MP/cifs/As1Fe0.975Na1Ni0.025-MP-mp-22152-synth_doped.cif,data/source/MP/raw/cifs/mp-22152.cif,mp-22152,0.0,,2014-02-21 10:51:39,4.793908463406792,10.17188/1197381,"@misc{osti_1197381,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NaFeAs (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197381"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704688'}},0.0,4.10723066,520.0,-30.57538864,-5.095898106666667,{'tags': ['Sodium iron arsenide']},-30.57538864,-5.095898106666667,-0.2786807238505749,"['xas', 'elasticity', 'bandstructure']",True,"[163144, 163143]",True,2021-05-12 10:56:16.728000,FM,6,8,mp-22152,,NaFeAs,"{'functional': 'PBE', 'labels': ['Na_pv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Na': 1.0, 'Fe': 1.0, 'As': 1.0}",GGA,mp-22152,"['mp-906352', 'mp-920130', 'mp-919102', 'mp-22152', 'mp-1413190', 'mp-1704688', 'mp-1797758', 'mp-1594769']",0.0693226,"{'Na': 2.0, 'Fe': 2.0, 'As': 2.0}",106.5178694490858,[],FM,True,129,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.0]",0.0013016144682303,0.0693226,2,0.1386452,MP,data/source/MP/cleaned/cifs/MP-mp-22152.cif,True,,data/final/MP/graphs/As1Fe0.975Na1Ni0.025-MP-mp-22152-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Co1.95Cr0.05Cu1S4,2,0.0142857142857142,2.0,False,Co3.9Cr0.1Cu2S8,Co4Cu2S8,3.4,Other,True,Co27.857Cr0.714Cu14.286S57.143,Co-Cr-Cu-S,4,Supercon,Cu1Co1.95Cr0.05S4,MP-mp-3925,Co4Cu2S8,Co-Cu-S,Co28.571Cu14.286S57.143,F d -3 m,cubic,6.69987918,6.699879179999999,6.699879179999999,data/final/MP/cifs/Co1.95Cr0.05Cu1S4-MP-mp-3925-synth_doped.cif,data/source/MP/raw/cifs/mp-3925.cif,mp-3925,0.0,,2011-05-15 03:07:38,4.836104359598833,10.17188/1207634,"@misc{osti_1207634,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Co2CuS4 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207634"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698326'}},0.0,5.68331854,520.0,-75.59837827,-5.399884162142857,"{'tags': ['Cobalt copper sulfide (2/1/4)', 'Carrollite', 'Dicobalt(III) copper sulfide']}",-75.59837827,-5.399884162142857,-0.7070782010714284,"['xas', 'bandstructure']",True,"[622571, 31107, 52943]",True,2021-05-12 10:57:08.928000,NM,14,8,mp-3925,,Co2CuS4,"{'functional': 'PBE', 'labels': ['Co', 'Cu_pv', 'S'], 'pot_type': 'paw'}","{'Co': 2.0, 'Cu': 1.0, 'S': 4.0}",GGA,mp-3925,"['mp-931396', 'mp-915858', 'mp-932359', 'mp-3925', 'mp-1425952', 'mp-1698326', 'mp-1833413', 'mp-1599756']",0.00593025,"{'Co': 4.0, 'Cu': 2.0, 'S': 8.0}",212.6600516474575,[],NM,False,227,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",5.5772110972972206e-05,0.00593025,0,0.0118605,MP,data/source/MP/cleaned/cifs/MP-mp-3925.cif,True,,data/final/MP/graphs/Co1.95Cr0.05Cu1S4-MP-mp-3925-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Pt4Th1,3,0.1,1.5,False,Pt6Th1.5,Pt6Th2,0.0,Other,True,Pt80Th20,Pt-Th,2,Supercon,Pt4Th1,MP-mp-865400,Th2Pt6,Pt-Th,Pt75Th25,P 63/m m c,hexagonal,5.019243,5.933378001821378,5.9333788,data/final/MP/cifs/Pt4Th1-MP-mp-865400-synth_doped.cif,data/source/MP/raw/cifs/mp-865400.cif,mp-865400,0.0,,2014-08-31 02:17:00,17.737088974285186,10.17188/1310691,"@misc{osti_1310691,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ThPt3 (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1310691"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1755379'}},0.0,7.6664673,520.0,-59.91290764,-7.489113455,{'tags': []},-59.91290764,-7.489113455,-1.0824681099999998,"['xas', 'elasticity', 'bandstructure']",True,[],True,2021-05-12 10:56:33.121000,NM,8,8,mp-865400,,ThPt3,"{'functional': 'PBE', 'labels': ['Th', 'Pt'], 'pot_type': 'paw'}","{'Th': 1.0, 'Pt': 3.0}",GGA,mp-865400,"['mp-865400', 'mp-1052694', 'mp-1052713', 'mp-1390782', 'mp-1755379', 'mp-1938908', 'mp-1618848', 'mp-1052714']",1.22e-05,"{'Th': 2.0, 'Pt': 6.0}",153.0287270184426,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.5944718665181988e-07,1.22e-05,0,2.44e-05,MP,data/source/MP/cleaned/cifs/MP-mp-865400.cif,True,,data/final/MP/graphs/Pt4Th1-MP-mp-865400-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Bi2Rh1,1,0.0,4.0,False,Bi8Rh4,Bi8Rh4,1.1,Other,True,Bi66.667Rh33.333,Bi-Rh,2,Supercon,Bi2Rh1,MP-mp-23217,Bi8Rh4,Bi-Rh,Bi66.667Rh33.333,P 1 21/c 1,monoclinic,6.925618,7.021260999999999,7.06388571,data/final/MP/cifs/Bi2Rh1-MP-mp-23217.cif,data/source/MP/raw/cifs/mp-23217.cif,mp-23217,0.0,,2014-02-22 11:57:57,11.342732873965444,10.17188/1199335,"@misc{osti_1199335,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Bi2Rh (SG:14) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199335"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1676246'}},0.0,6.39073037,520.0,-62.89577003,-5.2413141691666665,"{'tags': ['Bismuth rhodium (2/1)', 'Rhodium bismuthide (1/2)', 'Rhodium bismuthide (1/2) - alpha']}",-62.89577003,-5.2413141691666665,-0.1931886725000004,"['xas', 'bandstructure']",True,"[617009, 617003, 659574, 43503]",True,2021-05-12 10:56:59.077000,NM,12,8,mp-23217,,Bi2Rh,"{'functional': 'PBE', 'labels': ['Bi', 'Rh_pv'], 'pot_type': 'paw'}","{'Bi': 2.0, 'Rh': 1.0}",GGA,mp-23217,"['mp-913868', 'mp-990739', 'mp-930647', 'mp-23217', 'mp-1442554', 'mp-1676246', 'mp-1810674', 'mp-1597197']",8.2325e-05,"{'Bi': 8.0, 'Rh': 4.0}",305.01250421249426,[],NM,False,14,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.079627869192488e-06,8.2325e-05,0,0.0003293,MP,data/source/MP/cleaned/cifs/MP-mp-23217.cif,False,,data/final/MP/graphs/Bi2Rh1-MP-mp-23217.json,0,True,2/m,0,0,3,0,0,0,0,1,0,0,0,1.0,False
Hf1Os1P1,1,0.0,3.0,False,Hf3Os3P3,Hf3Os3P3,5.815,Other,True,Hf33.333Os33.333P33.333,Hf-Os-P,3,Supercon,Hf1Os1P1,MP-mp-1080463,Hf3P3Os3,Hf-Os-P,Hf33.333Os33.333P33.333,P -6 2 m,hexagonal,3.845747,6.426490001280437,6.42649035,data/final/MP/cifs/Hf1Os1P1-MP-mp-1080463.cif,data/source/MP/raw/cifs/mp-1080463.cif,mp-1080463,0.0,,2018-04-23 19:36:32,14.475670108445362,,,{'GGA': {'task_id': 'mp-1695935'}},0.0,8.62933772,520.0,-87.73875262,-9.748750291111111,{'tags': ['Hafnium osmium phosphide (1/1/1)']},-87.73875262,-9.748750291111111,-0.8827977538888897,['bandstructure'],True,[638751],True,2021-05-12 10:58:16.596000,NM,9,5,mp-1080463,,HfPOs,"{'functional': 'PBE', 'labels': ['Hf_pv', 'P', 'Os_pv'], 'pot_type': 'paw'}","{'Hf': 1.0, 'P': 1.0, 'Os': 1.0}",GGA,mp-1080463,"['mp-1080463', 'mp-1434421', 'mp-1695935', 'mp-1876820', 'mp-1589722']",0.0068200333333333,"{'Hf': 3.0, 'P': 3.0, 'Os': 3.0}",137.54950924657453,[],NM,False,189,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0001487471682892,0.0068200333333333,0,0.0204601,MP,data/source/MP/cleaned/cifs/MP-mp-1080463.cif,False,,data/final/MP/graphs/Hf1Os1P1-MP-mp-1080463.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Be12Pd1,1,0.0,1.0,True,Be12Pd1,Be12Pd1,0.0,Other,True,Be92.308Pd7.692,Be-Pd,2,Supercon,Be12Pd1,MP-mp-12666,Be12Pd1,Be-Pd,Be92.308Pd7.692,I 4/m m m,tetragonal,4.182208000070801,5.551765528906616,5.55176553,data/final/MP/cifs/Be12Pd1-MP-mp-12666.cif,data/source/MP/raw/cifs/mp-12666.cif,mp-12666,0.0,,2011-05-28 08:59:23,3.2209885095075323,10.17188/1189114,"@misc{osti_1189114,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Be12Pd (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189114"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703087'}},0.0794515811538456,5.08493896,520.0,-50.91201729,-3.9163090223076926,{'tags': ['Beryllium palladium (12/1)']},-50.91201729,-3.9163090223076926,-0.0660908538461544,"['xas', 'elasticity', 'bandstructure']",True,[109314],True,2021-05-12 10:56:12.755000,NM,13,8,mp-12666,,Be12Pd,"{'functional': 'PBE', 'labels': ['Be_sv', 'Pd'], 'pot_type': 'paw'}","{'Be': 12.0, 'Pd': 1.0}",GGA,mp-12666,"['mp-929696', 'mp-930239', 'mp-913152', 'mp-12666', 'mp-1422139', 'mp-1703087', 'mp-1804618', 'mp-1597254']",0.0002701,"{'Be': 12.0, 'Pd': 1.0}",110.61682767622136,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.4417623039289328e-06,0.0002701,0,0.0002701,MP,data/source/MP/cleaned/cifs/MP-mp-12666.cif,False,,data/final/MP/graphs/Be12Pd1-MP-mp-12666.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Au5Ba1,1,0.0,1.0,True,Au5Ba1,Au5Ba1,0.4,Other,True,Au83.333Ba16.667,Au-Ba,2,Supercon,Au5Ba1,MP-mp-30364,Ba1Au5,Au-Ba,Au83.333Ba16.667,P 6/m m m,hexagonal,4.538061,5.948045996956236,5.94804605,data/final/MP/cifs/Au5Ba1-MP-mp-30364.cif,data/source/MP/raw/cifs/mp-30364.cif,mp-30364,0.0,,2014-02-24 01:25:51,13.401524918642073,10.17188/1204779,"@misc{osti_1204779,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BaAu5 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1204779"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698473'}},0.0,4.14492518,520.0,-20.94639953,-3.4910665883333336,{'tags': ['Gold barium (5/1)']},-20.94639953,-3.4910665883333336,-0.4430035000000002,"['xas', 'elasticity', 'bandstructure']",True,[58395],True,2021-05-12 10:56:18.721000,NM,6,8,mp-30364,,BaAu5,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Au'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Au': 5.0}",GGA,mp-30364,"['mp-992651', 'mp-992597', 'mp-30364', 'mp-1434835', 'mp-1698473', 'mp-1921142', 'mp-994092', 'mp-1596021']",0.0028921,"{'Ba': 1.0, 'Au': 5.0}",139.0431516491267,[],NM,False,191,0,"[0, 0, 0, 0, 0, 0]",2.080001758949028e-05,0.0028921,0,0.0028921,MP,data/source/MP/cleaned/cifs/MP-mp-30364.cif,False,,data/final/MP/graphs/Au5Ba1-MP-mp-30364.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Be12Mo1,1,0.0,1.0,True,Be12Mo1,Be12Mo1,0.0,Other,True,Be92.308Mo7.692,Be-Mo,2,Supercon,Be12Mo1,MP-mp-1475,Be12Mo1,Be-Mo,Be92.308Mo7.692,I 4/m m m,tetragonal,4.196968002060744,5.520535490728164,5.520535490000001,data/final/MP/cifs/Be12Mo1-MP-mp-1475.cif,data/source/MP/raw/cifs/mp-1475.cif,mp-1475,0.0,,2011-05-13 08:19:46,3.0970015373398945,10.17188/1190877,"@misc{osti_1190877,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Be12Mo (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1190877"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701877'}},0.0,5.13670239,520.0,-57.38006194,-4.413850918461538,{'tags': ['Beryllium molybdenum (12/1)']},-57.38006194,-4.413850918461538,-0.1278049638461541,"['xas', 'elasticity', 'bandstructure']",True,"[58717, 616334, 616339]",True,2021-05-12 10:56:12.755000,NM,13,8,mp-1475,,Be12Mo,"{'functional': 'PBE', 'labels': ['Be_sv', 'Mo_pv'], 'pot_type': 'paw'}","{'Be': 12.0, 'Mo': 1.0}",GGA,mp-1475,"['mp-930536', 'mp-913636', 'mp-929990', 'mp-1475', 'mp-1418995', 'mp-1701877', 'mp-1803804', 'mp-1601858']",0.0024745,"{'Be': 12.0, 'Mo': 1.0}",109.42619091380918,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0]",2.261341621540193e-05,0.0024745,0,0.0024745,MP,data/source/MP/cleaned/cifs/MP-mp-1475.cif,False,,data/final/MP/graphs/Be12Mo1-MP-mp-1475.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B2C1Co0.1Ni1.9Y1,2,0.0333333333333333,1.0,True,B2C1Co0.1Ni1.9Y1,B2C1Ni2Y1,9.65,Other,True,B33.333C16.667Co1.667Ni31.667Y16.667,B-C-Co-Ni-Y,5,Supercon,Y1Ni1.9Co0.1B2C1,MP-mp-6576,Y1Ni2B2C1,B-C-Ni-Y,B33.333C16.667Ni33.333Y16.667,I 4/m m m,tetragonal,3.548790000501972,3.548790000501972,5.76144136,data/final/MP/cifs/B2C1Co0.1Ni1.9Y1-MP-mp-6576-synth_doped.cif,data/source/MP/raw/cifs/mp-6576.cif,mp-6576,0.0,,2011-05-13 05:21:43,6.099730998852292,10.17188/1281366,"@misc{osti_1281366,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281366"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688230'}},0.0,6.81083016,520.0,-43.677878,-7.279646333333333,{'tags': []},-43.677878,-7.279646333333333,-0.5109282141666659,"['xas', 'bandstructure']",True,"[75816, 89142, 83231, 79574, 41549]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6576,,YNi2B2C,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6576,"['mp-6576', 'mp-1007054', 'mp-1000583', 'mp-1439516', 'mp-1688230', 'mp-1794280', 'mp-1011792', 'mp-1597064']",0.0006603,"{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.3152437079014,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",1.010943177297096e-05,0.0006603,0,0.0006603,MP,data/source/MP/cleaned/cifs/MP-mp-6576.cif,True,,data/final/MP/graphs/B2C1Co0.1Ni1.9Y1-MP-mp-6576-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Al3Pd2U0.8Y0.2,3,0.0666666666666666,1.0,True,Al3Pd2U0.8Y0.2,Al3Pd2U1,0.0,Heavy_fermion,True,Al50Pd33.333U13.333Y3.333,Al-Pd-U-Y,4,Supercon,U0.8Y0.2Pd2Al3,MP-mp-4561,U1Al3Pd2,Al-Pd-U,Al50Pd33.333U16.667,P 6/m m m,hexagonal,4.239652,5.384229999094356,5.3842309,data/final/MP/cifs/Al3Pd2U0.8Y0.2-MP-mp-4561-synth_doped.cif,data/source/MP/raw/cifs/mp-4561.cif,mp-4561,0.0,,2011-05-12 23:59:10,8.296603403902926,10.17188/1208253,"@misc{osti_1208253,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UAl3Pd2 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208253"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700804'}},0.0796314472916668,8.0468212,520.0,-36.36476907,-6.060794845,"{'tags': ['Aluminium palladium uranium (3/2/1)', 'Aluminum palladium uranium (3/2/1)']}",-36.36476907,-6.060794845,-0.5794779916666665,"['xas', 'elasticity', 'bandstructure']",True,"[657574, 106242, 659234]",True,2021-05-12 10:56:20.740000,FM,6,9,mp-4561,,UAl3Pd2,"{'functional': 'PBE', 'labels': ['U', 'Al', 'Pd'], 'pot_type': 'paw'}","{'U': 1.0, 'Al': 3.0, 'Pd': 2.0}",GGA,mp-4561,"['mp-4561', 'mp-991619', 'mp-993538', 'mp-1251974', 'mp-1441898', 'mp-1700804', 'mp-1933710', 'mp-994863', 'mp-1593816']",2.2050571,"{'U': 1.0, 'Al': 3.0, 'Pd': 2.0}",106.4408038742404,[],FM,True,191,1,"[2.2, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0207162762750765,2.2050571,1,2.2050571,MP,data/source/MP/cleaned/cifs/MP-mp-4561.cif,True,,data/final/MP/graphs/Al3Pd2U0.8Y0.2-MP-mp-4561-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
La2Ni1O4.077,2,0.0093259855871131,3.924318085193361,False,La7.849Ni3.924O16,La8Ni4O16,0.0,Oxide,True,La28.261Ni14.13O57.609156422212806,La-Ni-O,3,Supercon,La2Ni1O4.077,MP-mp-21874,La8Ni4O16,La-Ni-O,La28.571Ni14.286O57.142857142857146,P 42/n c m,tetragonal,5.607892,5.607892,12.423229,data/final/MP/cifs/La2Ni1O4.077-MP-mp-21874-synth_doped.cif,data/source/MP/raw/cifs/mp-21874.cif,mp-21874,0.0346000000000001,,2013-06-09 07:15:40,6.808946783295827,,,{'GGA+U': {'task_id': 'mp-1767279'}},0.0468913437499995,7.93744356,520.0,-206.53456634,-7.376234512142857,"{'tags': ['Dilanthanum niccolate', 'Dilanthanum niccolate - LT']}",-206.53456634,-7.376234512142857,-3.0683780964285714,"['xas', 'bandstructure']",True,"[63396, 65920, 69753, 56319]",True,2021-05-12 10:57:01.079000,AFM,28,17,mp-21874,oxide,La2NiO4,"{'functional': 'PBE', 'labels': ['La', 'Ni_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Ni': 1.0, 'O': 4.0}",GGA+U,mp-21874,"['mp-795798', 'mp-819481', 'mp-616538', 'mp-25711', 'mp-21874', 'mp-1272397', 'mp-1287242', 'mp-1273910', 'mp-1289543', 'mp-1295462', 'mp-1287775', 'mp-1281171', 'mp-1283506', 'mp-1422956', 'mp-1767279', 'mp-820353', 'mp-1629609']",2.9e-06,"{'La': 8.0, 'Ni': 4.0, 'O': 16.0}",390.6913293848223,[],AFM,True,14,1,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -1.7, -1.7, 1.7, 1.7, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",2.9690958379509523e-08,2.9e-06,4,1.16e-05,MP,data/source/MP/cleaned/cifs/MP-mp-21874.cif,True,,data/final/MP/graphs/La2Ni1O4.077-MP-mp-21874-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Cl1Li0.16N1Zr1,3,0.0525803310613437,4.0,False,Cl4Li0.64N4Zr4,Cl4Li1N4Zr4,13.8,Other,True,Cl31.646Li5.063N31.646Zr31.646,Cl-Li-N-Zr,4,Supercon,Li0.16Zr1N1Cl1,MP-mp-1222362,Li1Zr4N4Cl4,Cl-Li-N-Zr,Cl30.769Li7.692N30.769Zr30.769,R -3 m,trigonal,3.681774253191133,3.681774253191133,19.4360702,data/final/MP/cifs/Cl1Li0.16N1Zr1-MP-mp-1222362-synth_doped.cif,data/source/MP/raw/cifs/mp-1222362.cif,mp-1222362,0.0,,2019-01-12 22:54:36.562000,4.170964502866723,,,,0.0903183780769225,5.20200093,520.0,-98.5732949,-7.582561146153846,{'tags': []},-98.5732949,-7.582561146153846,-1.971803321025641,[],False,[],True,2021-05-12 11:00:49.659000,NM,13,3,mp-1222362,,LiZr4(NCl)4,"{'functional': 'PBE', 'labels': ['Li_sv', 'Zr_sv', 'N', 'Cl'], 'pot_type': 'paw'}","{'Li': 1.0, 'Zr': 4.0, 'N': 4.0, 'Cl': 4.0}",GGA,mp-1222362,"['mp-1222362', 'mp-1411613', 'mp-1872376']",0.0031614,"{'Li': 1.0, 'Zr': 4.0, 'N': 4.0, 'Cl': 4.0}",226.7986027084237,[],NM,False,166,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.3939239317379532e-05,0.0031614,0,0.0031614,MP,data/source/MP/cleaned/cifs/MP-mp-1222362.cif,True,,data/final/MP/graphs/Cl1Li0.16N1Zr1-MP-mp-1222362-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ba0.094Cu1La1.906O4,2,0.0268571428571428,1.0,True,Ba0.094Cu1La1.906O4,Cu1La2O4,32.0,Cuprate,True,Ba1.343Cu14.286La27.229O57.142857142857146,Ba-Cu-La-O,4,Supercon,La1.906Ba0.094Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ba0.094Cu1La1.906O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ba0.094Cu1La1.906O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ca0.075Cu1La1.925O4,2,0.0214285714285714,1.0,True,Ca0.075Cu1La1.925O4,Cu1La2O4,9.2,Cuprate,True,Ca1.071Cu14.286La27.5O57.142857142857146,Ca-Cu-La-O,4,Supercon,La1.925Ca0.075Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ca0.075Cu1La1.925O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ca0.075Cu1La1.925O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Co1Nb1V1,1,0.0,4.0,False,Co4Nb4V4,Co4Nb4V4,0.0,Other,True,Co33.333Nb33.333V33.333,Co-Nb-V,3,Supercon,Co1Nb1V1,MP-mp-1220522,Nb4V4Co4,Co-Nb-V,Co33.333Nb33.333V33.333,A m m 2,orthorhombic,4.83953703,4.83953703,8.107039,data/final/MP/cifs/Co1Nb1V1-MP-mp-1220522.cif,data/source/MP/raw/cifs/mp-1220522.cif,mp-1220522,0.0,,2019-01-12 21:21:21.230000,8.073557922660136,,,{'GGA': {'task_id': 'mp-1742718'}},0.0100048409259247,5.62075101,520.0,-107.09911212,-8.92492601,{'tags': []},-107.09911212,-8.92492601,-0.1604163750000017,[],False,[],True,2021-05-12 11:00:47.244000,FM,12,4,mp-1220522,,NbVCo,"{'functional': 'PBE', 'labels': ['Nb_pv', 'V_pv', 'Co'], 'pot_type': 'paw'}","{'Nb': 1.0, 'V': 1.0, 'Co': 1.0}",GGA,mp-1220522,"['mp-1220522', 'mp-1410016', 'mp-1742718', 'mp-1786356']",0.07963185,"{'Nb': 4.0, 'V': 4.0, 'Co': 4.0}",166.82899917497468,[],FM,True,38,2,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, 0.1, 0.1, 0.0, 0.0]",0.0019093047466281,0.07963185,2,0.3185274,MP,data/source/MP/cleaned/cifs/MP-mp-1220522.cif,False,,data/final/MP/graphs/Co1Nb1V1-MP-mp-1220522.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Ba2Ho1Sb1O6,1,0.0,1.0,True,Ba2Ho1Sb1O6,Ba2Ho1Sb1O6,0.0,Oxide,True,Ba20Ho10Sb10O60,Ba-Ho-Sb-O,4,Supercon,Ho1Ba2Sb1O6,MP-mp-6687,Ba2Ho1Sb1O6,Ba-Ho-Sb-O,Ba20Ho10Sb10O60,F m -3 m,cubic,6.013500530000001,6.01350053,6.01350053,data/final/MP/cifs/Ba2Ho1Sb1O6-MP-mp-6687.cif,data/source/MP/raw/cifs/mp-6687.cif,mp-6687,3.4228,,2011-05-13 16:03:46,7.0985978264567215,,,{'GGA': {'task_id': 'mp-1701151'}},0.0,2.95841346,520.0,-69.12921878,-6.912921878000001,"{'tags': ['Dibarium holmium antimonate', 'Dibarium holmium antimony(V) oxide']}",-69.12921878,-6.912921878000001,-3.101410098,"['xas', 'bandstructure']",True,"[84651, 150862]",True,2021-05-12 10:57:32.679000,NM,10,8,mp-6687,oxide,Ba2HoSbO6,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ho_3', 'Sb', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Ho': 1.0, 'Sb': 1.0, 'O': 6.0}",GGA,mp-6687,"['mp-662036', 'mp-657113', 'mp-6687', 'mp-1429652', 'mp-1701151', 'mp-1778299', 'mp-1595319', 'mp-671380']",0.0007888,"{'Ba': 2.0, 'Ho': 1.0, 'Sb': 1.0, 'O': 6.0}",153.76838811163023,[],NM,False,225,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.12979299378075e-06,0.0007888,0,0.0007888,MP,data/source/MP/cleaned/cifs/MP-mp-6687.cif,False,,data/final/MP/graphs/Ba2Ho1Sb1O6-MP-mp-6687.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ba1.85Cu3Sm1.15O7,2,0.023076923076923,1.0,True,Ba1.85Cu3Sm1.15O7,Ba2Cu3Sm1O7,83.0,Cuprate,True,Ba14.231Cu23.077Sm8.846O53.84615384615385,Ba-Cu-Sm-O,4,Supercon,Sm1.15Ba1.85Cu3O7,MP-mp-21451,Ba2Sm1Cu3O7,Ba-Cu-Sm-O,Ba15.385Cu23.077Sm7.692O53.84615384615385,P m m m,orthorhombic,3.877678,3.939094,11.853576,data/final/MP/cifs/Ba1.85Cu3Sm1.15O7-MP-mp-21451-synth_doped.cif,data/source/MP/raw/cifs/mp-21451.cif,mp-21451,0.0,,2014-02-22 18:35:26,6.673487359328427,10.17188/1196908,"@misc{osti_1196908,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2SmCu3O7 (SG:47) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196908"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668270'}},0.024943947852555,3.19944098,520.0,-78.88111791,-6.067778300769231,"{'tags': ['Samarium dibarium dicopper copper(III) oxide', 'Samarium dibarium tricopper heptaoxide']}",-78.88111791,-6.067778300769231,-2.169249466923077,"['xas', 'bandstructure']",True,"[71707, 71708, 71717, 71709, 89227, 71716, 89228, 71711, 71706, 71705, 71719, 71718, 71712, 71713, 71714, 81170, 89229, 71710, 71715]",True,2021-05-12 10:56:59.077000,NM,13,8,mp-21451,oxide,Ba2SmCu3O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Sm_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Sm': 1.0, 'Cu': 3.0, 'O': 7.0}",GGA,mp-21451,"['mp-922854', 'mp-908553', 'mp-21451', 'mp-1440211', 'mp-1668270', 'mp-1785635', 'mp-923634', 'mp-1593751']",0.0079753,"{'Ba': 2.0, 'Sm': 1.0, 'Cu': 3.0, 'O': 7.0}",181.05789875162617,[],NM,False,47,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.404834064124678e-05,0.0079753,0,0.0079753,MP,data/source/MP/cleaned/cifs/MP-mp-21451.cif,True,,data/final/MP/graphs/Ba1.85Cu3Sm1.15O7-MP-mp-21451-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ba0.095Cu1La1.905O4,2,0.0271428571428571,1.0,True,Ba0.095Cu1La1.905O4,Cu1La2O4,29.0,Cuprate,True,Ba1.357Cu14.286La27.214O57.142857142857146,Ba-Cu-La-O,4,Supercon,La1.905Ba0.095Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ba0.095Cu1La1.905O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ba0.095Cu1La1.905O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Cu1Nd1.7O4,3,0.0639658848614072,1.0,True,Cu1Nd1.7O4,Cu1Nd2O4,30.7,Cuprate,True,Cu14.925Nd25.373O59.701492537313435,Cu-Nd-O,3,Supercon,Nd1.7Cu1O4,MP-mp-4158,Nd2Cu1O4,Cu-Nd-O,Cu14.286Nd28.571O57.142857142857146,I 4/m m m,tetragonal,3.973854000245551,3.973854000245551,6.78296857,data/final/MP/cifs/Cu1Nd1.7O4-MP-mp-4158-synth_doped.cif,data/source/MP/raw/cifs/mp-4158.cif,mp-4158,0.0,,2011-05-13 10:19:33,7.086167303782593,10.17188/1207899,"@misc{osti_1207899,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nd2CuO4 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207899"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-670050'}},0.0009497997619085,3.16510927,520.0,-51.48091453,-7.354416361428571,"{'tags': ['Dineodymium copper tetraoxide', 'Dineodymium copper oxide', 'Dineodymium cuprate', 'High pressure experimental phase']}",-51.48091453,-7.354416361428571,-2.971653917142857,"['xas', 'elasticity', 'bandstructure']",True,"[261376, 203228, 160629, 261375, 69479, 186590, 4203, 75830, 75825, 202885, 203229, 71181, 82067, 75828, 69886, 75826, 75829, 75824, 75827, 69482, 86752]",True,2021-05-12 10:56:20.740000,NM,7,11,mp-4158,oxide,Nd2CuO4,"{'functional': 'PBE', 'labels': ['Nd_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Nd': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-4158,"['mp-670050', 'mp-660368', 'mp-4158', 'mp-1078016', 'mp-1173374', 'mp-1440751', 'mp-1668619', 'mp-1797319', 'mp-1588086', 'mp-1590518', 'mp-688505']",0.0084899,"{'Nd': 2.0, 'Cu': 1.0, 'O': 4.0}",97.4899480873212,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",8.708487558528232e-05,0.0084899,0,0.0084899,MP,data/source/MP/cleaned/cifs/MP-mp-4158.cif,True,,data/final/MP/graphs/Cu1Nd1.7O4-MP-mp-4158-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
La1Rh1Si3,1,0.0,1.0,True,La1Rh1Si3,La1Rh1Si3,2.245,Other,True,La20Rh20Si60,La-Rh-Si,3,Supercon,La1Rh1Si3,MP-mp-1070124,La1Si3Rh1,La-Rh-Si,La20Rh20Si60,I 4 m m,tetragonal,4.279268001234386,4.279268001234386,5.80764916,data/final/MP/cifs/La1Rh1Si3-MP-mp-1070124.cif,data/source/MP/raw/cifs/mp-1070124.cif,mp-1070124,0.0,,2018-03-22 02:34:06,5.964732480213067,,,{'GGA': {'task_id': 'mp-1696951'}},0.0,8.97903428,520.0,-32.76863695,-6.553727390000001,"{'tags': ['Lanthanum rhodium silicide (1/1/3)', 'BaNiSn3', 'LaRhSi3']}",-32.76863695,-6.553727390000001,-0.838475983,['bandstructure'],True,[604624],True,2021-05-12 10:58:14.654000,NM,5,8,mp-1070124,,LaSi3Rh,"{'functional': 'PBE', 'labels': ['La', 'Si', 'Rh_pv'], 'pot_type': 'paw'}","{'La': 1.0, 'Si': 3.0, 'Rh': 1.0}",GGA,mp-1070124,"['mp-1070124', 'mp-1070164', 'mp-1070207', 'mp-1424867', 'mp-1696951', 'mp-1796309', 'mp-1589028', 'mp-1070193']",0.0004402,"{'La': 1.0, 'Si': 3.0, 'Rh': 1.0}",90.77486275848575,[],NM,False,107,0,"[0, 0, 0, 0, 0]",4.8493601270562044e-06,0.0004402,0,0.0004402,MP,data/source/MP/cleaned/cifs/MP-mp-1070124.cif,False,,data/final/MP/graphs/La1Rh1Si3-MP-mp-1070124.json,0,True,4mm,0,0,0,0,5,0,0,0,0,1,0,1.0,False
Fe1Se0.02Te0.98,2,0.02,2.0,False,Fe2Se0.04Te1.96,Fe2Te2,0.0,Ferrite,True,Fe50Se1Te49,Fe-Se-Te,3,Supercon,Fe1Te0.98Se0.02,MP-mp-21273,Fe2Te2,Fe-Te,Fe50Te50,P 4/n m m,tetragonal,3.65601,3.65601,6.514508,data/final/MP/cifs/Fe1Se0.02Te0.98-MP-mp-21273-synth_doped.cif,data/source/MP/raw/cifs/mp-21273.cif,mp-21273,0.0,,2015-11-26 15:42:53,6.996625048410066,10.17188/1196541,"@misc{osti_1196541,
    author = ""Persson, Kristin"",
    title = ""Materials Data on FeTe (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196541"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687548'}},0.0764545287500002,6.29104431,520.0,-23.46280856,-5.86570214,"{'tags': ['Iron telluride', 'Iron telluride - beta', 'Iron telluride (1/1)']}",-23.46280856,-5.86570214,-0.2700474499999998,"['xas', 'elasticity', 'bandstructure']",True,"[44753, 633877, 180602, 169974]",True,2021-05-12 10:56:16.728000,FM,4,9,mp-21273,,FeTe,"{'functional': 'PBE', 'labels': ['Fe_pv', 'Te'], 'pot_type': 'paw'}","{'Fe': 1.0, 'Te': 1.0}",GGA,mp-21273,"['mp-991220', 'mp-987578', 'mp-992375', 'mp-21273', 'mp-1439792', 'mp-1687548', 'mp-1800961', 'mp-993959', 'mp-1596778']",1.99364605,"{'Fe': 2.0, 'Te': 2.0}",87.07557914416442,[],FM,True,129,1,"[2.0, 2.0, 0.0, 0.0]",0.0457911637130606,1.99364605,2,3.9872921,MP,data/source/MP/cleaned/cifs/MP-mp-21273.cif,True,,data/final/MP/graphs/Fe1Se0.02Te0.98-MP-mp-21273-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
As2Eu1Fe1.8Ni0.2,3,0.0799999999999999,1.0,True,As2Eu1Fe1.8Ni0.2,As2Eu1Fe2,0.0,Ferrite,True,As40Eu20Fe36Ni4,As-Eu-Fe-Ni,4,Supercon,Eu1Fe1.8Ni0.2As2,MP-mp-20890,Eu1Fe2As2,As-Eu-Fe,As40Eu20Fe40,I 4/m m m,tetragonal,3.9736679999368567,3.9736679999368567,6.07120609,data/final/MP/cifs/As2Eu1Fe1.8Ni0.2-MP-mp-20890-synth_doped.cif,data/source/MP/raw/cifs/mp-20890.cif,mp-20890,0.0,,2014-02-21 09:03:25,8.079887417044961,10.17188/1196086,"@misc{osti_1196086,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Eu(FeAs)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196086"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687595'}},0.0,5.69045342,520.0,-39.43180547,-7.886361094,"{'tags': ['High pressure experimental phase', 'Europium diiron diarsenide - HP', 'Europium diiron diarsenide', 'Europium iron arsenide (1/2/2)']}",-39.43180547,-7.886361094,-0.5763016570000005,"['xas', 'bandstructure']",True,"[169689, 169687, 185355, 169691, 163211, 185356, 610431, 169690, 169688, 163210]",True,2021-05-12 10:56:57.051000,FM,5,16,mp-20890,,Eu(FeAs)2,"{'functional': 'PBE', 'labels': ['Eu', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Eu': 1.0, 'Fe': 2.0, 'As': 2.0}",GGA,mp-20890,"['mp-991161', 'mp-993140', 'mp-20890', 'mp-1069324', 'mp-1069480', 'mp-1069596', 'mp-1069907', 'mp-1070115', 'mp-1069978', 'mp-1442076', 'mp-1687595', 'mp-1782260', 'mp-994461', 'mp-1594012', 'mp-1069557', 'mp-1070074']",6.9579645,"{'Eu': 1.0, 'Fe': 2.0, 'As': 2.0}",84.97992844321493,[],FM,True,139,1,"[6.7, -0.0, -0.0, 0.0, 0.0]",0.0818777401613068,6.9579645,1,6.9579645,MP,data/source/MP/cleaned/cifs/MP-mp-20890.cif,True,,data/final/MP/graphs/As2Eu1Fe1.8Ni0.2-MP-mp-20890-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Al2Si2U1,3,0.1,1.5,False,Al3Si3U1.5,Al3Si3U2,1.34,Heavy_fermion,True,Al40Si40U20,Al-Si-U,3,Supercon,Al2Si2U1,MP-mp-1216639,U2Al3Si3,Al-Si-U,Al37.5Si37.5U25,P m m m,orthorhombic,4.163037,4.270003,8.011615,data/final/MP/cifs/Al2Si2U1-MP-mp-1216639-synth_doped.cif,data/source/MP/raw/cifs/mp-1216639.cif,mp-1216639,0.0,,2019-01-12 18:06:49.337000,7.476941891743186,,,{'GGA': {'task_id': 'mp-1754414'}},0.0,9.67527386,520.0,-52.31312245,-6.53914030625,{'tags': []},-52.31312245,-6.53914030625,-0.2505791100000003,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,8,5,mp-1216639,,U2(AlSi)3,"{'functional': 'PBE', 'labels': ['U', 'Al', 'Si'], 'pot_type': 'paw'}","{'U': 2.0, 'Al': 3.0, 'Si': 3.0}",GGA,mp-1216639,"['mp-1216639', 'mp-1383307', 'mp-1754414', 'mp-1921244', 'mp-1620259']",0.0640694,"{'U': 2.0, 'Al': 3.0, 'Si': 3.0}",142.4159141691529,[],NM,False,47,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0004498752851728,0.0640694,0,0.0640694,MP,data/source/MP/cleaned/cifs/MP-mp-1216639.cif,True,,data/final/MP/graphs/Al2Si2U1-MP-mp-1216639-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Pt0.2Ta0.8,3,0.1,4.0,False,Pt0.8Ta3.2,Pt1Ta3,0.0,Other,True,Pt20Ta80,Pt-Ta,2,Supercon,Pt0.2Ta0.8,MP-mp-1187219,Ta3Pt1,Pt-Ta,Pt25Ta75,P m -3 m,cubic,4.128618,4.128618,4.128618,data/final/MP/cifs/Pt0.2Ta0.8-MP-mp-1187219-synth_doped.cif,data/source/MP/raw/cifs/mp-1187219.cif,mp-1187219,0.0,,2019-01-11 14:55:13.700000,17.41200447596201,,,{'GGA': {'task_id': 'mp-1763652'}},0.0472411499999996,6.25291344,520.0,-42.5757307,-10.643932675,{'tags': []},-42.5757307,-10.643932675,-0.2328725250000012,['bandstructure'],True,[],True,2021-05-12 10:58:31.620000,NM,4,5,mp-1187219,,Ta3Pt,"{'functional': 'PBE', 'labels': ['Ta_pv', 'Pt'], 'pot_type': 'paw'}","{'Ta': 3.0, 'Pt': 1.0}",GGA,mp-1187219,"['mp-1187219', 'mp-1415032', 'mp-1763652', 'mp-1799805', 'mp-1616496']",0.0074793,"{'Ta': 3.0, 'Pt': 1.0}",70.37430275391887,[],NM,False,221,0,"[0, 0, 0, 0]",0.0001062788504797,0.0074793,0,0.0074793,MP,data/source/MP/cleaned/cifs/MP-mp-1187219.cif,True,,data/final/MP/graphs/Pt0.2Ta0.8-MP-mp-1187219-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Rh0.4Zr0.6,3,0.1333333333333333,6.0,False,Rh2.4Zr3.6,Rh2Zr4,7.0,Other,True,Rh40Zr60,Rh-Zr,2,Supercon,Rh0.4Zr0.6,MP-mp-571664,Zr4Rh2,Rh-Zr,Rh33.333Zr66.667,I 4/m c m,tetragonal,5.424551640917728,5.42455164,5.424551640000001,data/final/MP/cifs/Rh0.4Zr0.6-MP-mp-571664-synth_doped.cif,data/source/MP/raw/cifs/mp-571664.cif,mp-571664,0.0,,2014-02-16 05:17:29,7.817083063733077,10.17188/1276382,"@misc{osti_1276382,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Zr2Rh (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1276382"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704186'}},0.0,4.85143713,520.0,-52.2156124,-8.702602066666666,"{'tags': ['Rhodium zirconium hydride (1/2/4)', 'Rhodium zirconium (1/2)']}",-52.2156124,-8.702602066666666,-0.5493656899999996,"['xas', 'elasticity', 'bandstructure']",True,"[650562, 658071, 102807, 650557]",True,2021-05-12 10:56:27.046000,NM,6,17,mp-571664,,Zr2Rh,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Rh_pv'], 'pot_type': 'paw'}","{'Zr': 2.0, 'Rh': 1.0}",GGA,mp-571664,"['mp-941245', 'mp-934770', 'mp-941545', 'mp-571664', 'mp-1071440', 'mp-1071460', 'mp-1071500', 'mp-1072883', 'mp-1072945', 'mp-1072899', 'mp-1077561', 'mp-1441114', 'mp-1704186', 'mp-1802450', 'mp-1595340', 'mp-1071495', 'mp-1072938']",0.01533035,"{'Zr': 4.0, 'Rh': 2.0}",121.23208380358663,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0]",0.0002529091230476,0.01533035,0,0.0306607,MP,data/source/MP/cleaned/cifs/MP-mp-571664.cif,True,,data/final/MP/graphs/Rh0.4Zr0.6-MP-mp-571664-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Au1Ga40Mo8,1,0.0,1.0,True,Au1Ga40Mo8,Au1Ga40Mo8,9.4,Other,True,Au2.041Ga81.633Mo16.327,Au-Ga-Mo,3,Supercon,Au1Ga40Mo8,MP-mp-1195837,Ga40Mo8Au1,Au-Ga-Mo,Au2.041Ga81.633Mo16.327,R -3,trigonal,9.59798076,9.59798076,9.59798017,data/final/MP/cifs/Au1Ga40Mo8-MP-mp-1195837.cif,data/source/MP/raw/cifs/mp-1195837.cif,mp-1195837,0.0,,2019-01-12 01:07:37.674000,7.1273166455793255,,,,0.0,4.50684559,520.0,-218.75711197,-4.464430856530613,{'tags': ['Molybdenum gold gallide (8/1/40)']},-218.75711197,-4.464430856530613,-0.1549845977551027,[],False,[611886],True,2021-05-12 10:59:59.077000,NM,49,3,mp-1195837,,Ga40Mo8Au,"{'functional': 'PBE', 'labels': ['Ga_d', 'Mo_pv', 'Au'], 'pot_type': 'paw'}","{'Ga': 40.0, 'Mo': 8.0, 'Au': 1.0}",GGA,mp-1195837,"['mp-1195837', 'mp-1353167', 'mp-1896125']",0.0087954,"{'Ga': 40.0, 'Mo': 8.0, 'Au': 1.0}",874.477527881878,[],NM,False,148,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.0057891391793498e-05,0.0087954,0,0.0087954,MP,data/source/MP/cleaned/cifs/MP-mp-1195837.cif,False,,data/final/MP/graphs/Au1Ga40Mo8-MP-mp-1195837.json,0,True,-3,0,0,0,0,0,0,2,1,0,0,0,1.0,False
Bi1.5La4Sb1.5,1,0.0,2.0,False,Bi3La8Sb3,Bi3La8Sb3,0.158,Other,True,Bi21.429La57.143Sb21.429,Bi-La-Sb,3,Supercon,Bi1.5La4Sb1.5,MP-mp-1223101,La8Bi3Sb3,Bi-La-Sb,Bi21.429La57.143Sb21.429,C 1 2 1,monoclinic,8.46327703,8.46327703,8.46983304545466,data/final/MP/cifs/Bi1.5La4Sb1.5-MP-mp-1223101.cif,data/source/MP/raw/cifs/mp-1223101.cif,mp-1223101,0.0,,2019-01-12 23:32:33.837000,7.476307247499308,,,,0.0,7.80418433,520.0,-78.0045191,-5.571751364285714,{'tags': []},-78.0045191,-5.571751364285714,-1.0739539721428568,[],False,[],True,2021-05-12 11:00:52.054000,NM,14,3,mp-1223101,,La8(BiSb)3,"{'functional': 'PBE', 'labels': ['La', 'Bi', 'Sb'], 'pot_type': 'paw'}","{'La': 8.0, 'Bi': 3.0, 'Sb': 3.0}",GGA,mp-1223101,"['mp-1223101', 'mp-1352999', 'mp-1817935']",0.772804,"{'La': 8.0, 'Bi': 3.0, 'Sb': 3.0}",467.1939803534044,[],NM,False,5,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0016541394634738,0.772804,0,0.772804,MP,data/source/MP/cleaned/cifs/MP-mp-1223101.cif,False,,data/final/MP/graphs/Bi1.5La4Sb1.5-MP-mp-1223101.json,0,True,2,0,0,1,0,0,0,0,0,1,0,0,1.0,False
Ba2Cu3Eu0.1Pr0.9O7,2,0.0153846153846153,1.0,True,Ba2Cu3Eu0.1Pr0.9O7,Ba2Cu3Pr1O7,0.0,Cuprate,True,Ba15.385Cu23.077Eu0.769Pr6.923O53.84615384615385,Ba-Cu-Eu-Pr-O,5,Supercon,Eu0.1Pr0.9Ba2Cu3O7,MP-mp-20936,Ba2Pr1Cu3O7,Ba-Cu-Pr-O,Ba15.385Cu23.077Pr7.692O53.84615384615385,P m m m,orthorhombic,3.903923,3.95568,11.916432,data/final/MP/cifs/Ba2Cu3Eu0.1Pr0.9O7-MP-mp-20936-synth_doped.cif,data/source/MP/raw/cifs/mp-20936.cif,mp-20936,0.0,,2014-02-22 14:41:55,6.480717836004672,10.17188/1196129,"@misc{osti_1196129,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2PrCu3O7 (SG:47) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196129"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698257'}},0.0256000172756332,3.18514576,520.0,-78.62827906,-6.048329158461538,"{'tags': ['Dibarium praseodymium tricopper heptaoxide', 'Praseodymium dibarium dicopper copper(III) oxide', 'Praseodymium dibarium tricopper heptaoxide', 'Praseodymium dibarium copper(III) dicopper oxide']}",-78.62827906,-6.048329158461538,-2.145007016153845,"['xas', 'bandstructure']",True,"[41452, 94377, 81168, 173910, 89221]",True,2021-05-12 10:56:57.051000,NM,13,8,mp-20936,oxide,Ba2PrCu3O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Pr_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Pr': 1.0, 'Cu': 3.0, 'O': 7.0}",GGA,mp-20936,"['mp-988090', 'mp-987725', 'mp-20936', 'mp-1417367', 'mp-1698257', 'mp-1833655', 'mp-988324', 'mp-1602318']",0.0007234,"{'Ba': 2.0, 'Pr': 1.0, 'Cu': 3.0, 'O': 7.0}",184.02152853403555,[],NM,False,47,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.931061793491212e-06,0.0007234,0,0.0007234,MP,data/source/MP/cleaned/cifs/MP-mp-20936.cif,True,,data/final/MP/graphs/Ba2Cu3Eu0.1Pr0.9O7-MP-mp-20936-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ba2Cu1Tl2O6.19,2,0.0154358599398814,1.9386526655896603,False,Ba3.877Cu1.939Tl3.877O12,Ba4Cu2Tl4O12,45.3,Cuprate,True,Ba17.873Cu8.937Tl17.873O55.31724754244861,Ba-Cu-Tl-O,4,Supercon,Tl2Ba2Cu1O6.19,MP-mp-6027,Ba4Tl4Cu2O12,Ba-Cu-Tl-O,Ba18.182Cu9.091Tl18.182O54.54545454545455,C m c a,orthorhombic,5.504110002693673,5.585743,12.28312762,data/final/MP/cifs/Ba2Cu1Tl2O6.19-MP-mp-6027-synth_doped.cif,data/source/MP/raw/cifs/mp-6027.cif,mp-6027,0.0,,2011-05-19 00:05:23,7.606665315628389,10.17188/1277350,"@misc{osti_1277350,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Tl2CuO6 (SG:64) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277350"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1673478'}},0.0059215576010052,4.10961464,520.0,-115.75418737,-5.261553971363636,"{'tags': ['Dithallium dibarium cuprate', 'Dithallium(III) dibarium copper oxide']}",-115.75418737,-5.261553971363636,-1.7862630028787878,"['xas', 'bandstructure']",True,"[202723, 202724, 202722]",True,2021-05-12 10:57:28.836000,NM,22,8,mp-6027,oxide,Ba2Tl2CuO6,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Tl_d', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Tl': 2.0, 'Cu': 1.0, 'O': 6.0}",GGA,mp-6027,"['mp-925246', 'mp-909581', 'mp-924678', 'mp-6027', 'mp-1504634', 'mp-1673478', 'mp-1837163', 'mp-1605186']",2.9e-05,"{'Ba': 4.0, 'Tl': 4.0, 'Cu': 2.0, 'O': 12.0}",368.0385386017736,[],NM,False,64,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.5759219189476614e-07,2.9e-05,0,5.8e-05,MP,data/source/MP/cleaned/cifs/MP-mp-6027.cif,True,,data/final/MP/graphs/Ba2Cu1Tl2O6.19-MP-mp-6027-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ce0.75Ge12Pr0.25Pt4,3,0.0294117647058823,1.0,True,Ce0.75Ge12Pr0.25Pt4,Ce1Ge12Pt4,0.0,Heavy_fermion,True,Ce4.412Ge70.588Pr1.471Pt23.529,Ce-Ge-Pr-Pt,4,Supercon,Pr0.25Ce0.75Pt4Ge12,MP-mp-1190040,Ce1Ge12Pt4,Ce-Ge-Pt,Ce5.882Ge70.588Pt23.529,I m -3,cubic,7.554374241674687,7.55437424,7.55437424,data/final/MP/cifs/Ce0.75Ge12Pr0.25Pt4-MP-mp-1190040-synth_doped.cif,data/source/MP/raw/cifs/mp-1190040.cif,mp-1190040,0.0,,2019-01-11 20:38:55.889000,8.966965437997649,,,{'GGA': {'task_id': 'mp-1707713'}},0.0,4.51971036,520.0,-92.33742426,-5.431613191764706,{'tags': ['Cerium platinum germanide (1/4/12)']},-92.33742426,-5.431613191764706,-0.3908452944117654,['bandstructure'],True,[174553],True,2021-05-12 10:58:33.577000,FM,17,5,mp-1190040,,Ce(Ge3Pt)4,"{'functional': 'PBE', 'labels': ['Ce', 'Ge_d', 'Pt'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Ge': 12.0, 'Pt': 4.0}",GGA,mp-1190040,"['mp-1190040', 'mp-1428966', 'mp-1707713', 'mp-1812627', 'mp-1638005']",0.0676464,"{'Ce': 1.0, 'Ge': 12.0, 'Pt': 4.0}",331.87427999817515,[],FM,True,204,1,"[0.1, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0002038314026635,0.0676464,1,0.0676464,MP,data/source/MP/cleaned/cifs/MP-mp-1190040.cif,True,,data/final/MP/graphs/Ce0.75Ge12Pr0.25Pt4-MP-mp-1190040-synth_doped.json,0,True,m-3,2,0,0,0,0,0,0,0,0,1,0,1.0,False
Ga1Si1Sr1,1,0.0,1.0,True,Ga1Si1Sr1,Ga1Si1Sr1,5.0,Other,True,Ga33.333Si33.333Sr33.333,Ga-Si-Sr,3,Supercon,Sr1Ga1Si1,MP-mp-1218262,Sr1Ga1Si1,Ga-Si-Sr,Ga33.333Si33.333Sr33.333,P -6 m 2,hexagonal,4.2209479997069455,4.220947830000001,4.723355,data/final/MP/cifs/Ga1Si1Sr1-MP-mp-1218262.cif,data/source/MP/raw/cifs/mp-1218262.cif,mp-1218262,0.0,,2019-01-12 19:27:35.341000,4.224977327446255,,,{'GGA': {'task_id': 'mp-1767455'}},0.0,4.14906217,520.0,-11.52735393,-3.84245131,{'tags': []},-11.52735393,-3.84245131,-0.4378168113888889,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,3,5,mp-1218262,,SrGaSi,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ga_d', 'Si'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Ga': 1.0, 'Si': 1.0}",GGA,mp-1218262,"['mp-1218262', 'mp-1432931', 'mp-1767455', 'mp-1801429', 'mp-1611910']",0.0052074,"{'Sr': 1.0, 'Ga': 1.0, 'Si': 1.0}",72.87879778923026,[],NM,False,187,0,"[0, 0, 0]",7.14528800963499e-05,0.0052074,0,0.0052074,MP,data/source/MP/cleaned/cifs/MP-mp-1218262.cif,False,,data/final/MP/graphs/Ga1Si1Sr1-MP-mp-1218262.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Ce1Rh2Si2,1,0.0,1.0,True,Ce1Rh2Si2,Ce1Rh2Si2,0.356666667,Heavy_fermion,True,Ce20Rh40Si40,Ce-Rh-Si,3,Supercon,Ce1Rh2Si2,MP-mp-4090,Ce1Si2Rh2,Ce-Rh-Si,Ce20Rh40Si40,I 4/m m m,tetragonal,4.098522002815402,4.098522002815402,5.83166964,data/final/MP/cifs/Ce1Rh2Si2-MP-mp-4090.cif,data/source/MP/raw/cifs/mp-4090.cif,mp-4090,0.0,,2011-05-13 04:02:11,7.854644209730276,10.17188/1207844,"@misc{osti_1207844,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ce(SiRh)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207844"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1670882'}},0.0,8.46220497,520.0,-36.82170574,-7.364341147999999,"{'tags': ['Cerium rhodium silicide (1/2/2)', 'Cerium rhodium silicon (1/2/2)']}",-36.82170574,-7.364341147999999,-1.061874560999999,"['xas', 'elasticity', 'bandstructure']",True,"[621957, 621950, 621944, 621948, 621951, 52896, 87146, 621952, 621959, 621946]",True,2021-05-12 10:56:20.740000,FM,5,9,mp-4090,,Ce(SiRh)2,"{'functional': 'PBE', 'labels': ['Ce', 'Si', 'Rh_pv'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Si': 2.0, 'Rh': 2.0}",GGA,mp-4090,"['mp-906901', 'mp-920506', 'mp-921520', 'mp-4090', 'mp-1171210', 'mp-1442109', 'mp-1670882', 'mp-1865276', 'mp-1596185']",0.5123439,"{'Ce': 1.0, 'Si': 2.0, 'Rh': 2.0}",85.0069614578577,[],FM,True,139,1,"[0.5, 0.0, 0.0, 0.0, 0.0]",0.0060270816791163,0.5123439,1,0.5123439,MP,data/source/MP/cleaned/cifs/MP-mp-4090.cif,False,,data/final/MP/graphs/Ce1Rh2Si2-MP-mp-4090.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B2Ho1Os1,1,0.0,4.0,False,B8Ho4Os4,B8Ho4Os4,0.0,Other,True,B50Ho25Os25,B-Ho-Os,3,Supercon,Ho1Os1B2,MP-mp-1189925,Ho4B8Os4,B-Ho-Os,B50Ho25Os25,P n m a,orthorhombic,5.317054,5.89538,6.362782,data/final/MP/cifs/B2Ho1Os1-MP-mp-1189925.cif,data/source/MP/raw/cifs/mp-1189925.cif,mp-1189925,0.0,,2019-01-11 20:33:44.600000,12.547860624223452,,,{'GGA': {'task_id': 'mp-1668999'}},0.0,6.25929452,520.0,-126.12999135,-7.883124459375,"{'tags': ['HoOsB2', 'LuRuB2', 'Holmium osmium boride (1/1/2)']}",-126.12999135,-7.883124459375,-0.5909847927083325,['bandstructure'],True,[614489],True,2021-05-12 10:58:33.577000,NM,16,5,mp-1189925,,HoB2Os,"{'functional': 'PBE', 'labels': ['Ho_3', 'B', 'Os_pv'], 'pot_type': 'paw'}","{'Ho': 1.0, 'B': 2.0, 'Os': 1.0}",GGA,mp-1189925,"['mp-1189925', 'mp-1419494', 'mp-1668999', 'mp-1789434', 'mp-1603784']",4.785e-05,"{'Ho': 4.0, 'B': 8.0, 'Os': 4.0}",199.4481069566081,[],NM,False,6,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, 0.0, 0.0]",9.596481155955066e-07,4.785e-05,0,0.0001914,MP,data/source/MP/cleaned/cifs/MP-mp-1189925.cif,False,,data/final/MP/graphs/B2Ho1Os1-MP-mp-1189925.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Al3Ni1.98U1,2,0.0044593088071348,1.0,True,Al3Ni1.98U1,Al3Ni2U1,1.13,Heavy_fermion,True,Al50.167Ni33.11U16.722,Al-Ni-U,3,Supercon,U1Ni1.98Al3,MP-mp-2903,U1Al3Ni2,Al-Ni-U,Al50Ni33.333U16.667,P 6/m m m,hexagonal,4.031899,5.147229997095757,5.14723005,data/final/MP/cifs/Al3Ni1.98U1-MP-mp-2903-synth_doped.cif,data/source/MP/raw/cifs/mp-2903.cif,mp-2903,0.0,,2011-05-13 05:51:52,7.832617582421956,10.17188/1203074,"@misc{osti_1203074,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UAl3Ni2 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1203074"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678525'}},0.1051396383333314,9.05221071,520.0,-36.52297192,-6.087161986666668,"{'tags': ['Uranium nickel aluminium (1/2/3)', 'Aluminum nickel uranium (3/2/1)', 'Aluminium nickel uranium (3/2/1)']}",-36.52297192,-6.087161986666668,-0.4057601766666678,"['xas', 'elasticity', 'bandstructure']",True,"[659220, 602903, 104408, 659142, 370029]",True,2021-05-12 10:56:18.721000,NM,6,9,mp-2903,,UAl3Ni2,"{'functional': 'PBE', 'labels': ['U', 'Al', 'Ni_pv'], 'pot_type': 'paw'}","{'U': 1.0, 'Al': 3.0, 'Ni': 2.0}",GGA,mp-2903,"['mp-991128', 'mp-2903', 'mp-993112', 'mp-1256856', 'mp-1437596', 'mp-1678525', 'mp-1796633', 'mp-994437', 'mp-1589145']",0.0881673,"{'U': 1.0, 'Al': 3.0, 'Ni': 2.0}",92.50973387636644,[],NM,False,191,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0009530597084824,0.0881673,0,0.0881673,MP,data/source/MP/cleaned/cifs/MP-mp-2903.cif,True,,data/final/MP/graphs/Al3Ni1.98U1-MP-mp-2903-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Au0.02Nb3Rh0.98,2,0.01,2.0,False,Au0.04Nb6Rh1.96,Nb6Rh2,2.53,Other,True,Au0.5Nb75Rh24.5,Au-Nb-Rh,3,Supercon,Nb3Rh0.98Au0.02,MP-mp-1545,Nb6Rh2,Nb-Rh,Nb75Rh25,P m -3 n,cubic,5.186072,5.186072,5.186072,data/final/MP/cifs/Au0.02Nb3Rh0.98-MP-mp-1545-synth_doped.cif,data/source/MP/raw/cifs/mp-1545.cif,mp-1545,0.0,,2011-05-14 11:20:25,9.086567873234834,10.17188/1191190,"@misc{osti_1191190,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Rh (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191190"",
    place = ""United States"",
    year = ""2015"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700041'}},0.0,5.48706495,520.0,-77.37430008,-9.67178751,{'tags': ['Niobium rhodium (3/1)']},-77.37430008,-9.67178751,-0.2547317625000005,"['xas', 'elasticity', 'bandstructure']",True,"[105216, 645269]",True,2021-05-12 10:56:12.755000,NM,8,8,mp-1545,,Nb3Rh,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Rh_pv'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Rh': 1.0}",GGA,mp-1545,"['mp-942004', 'mp-943019', 'mp-935201', 'mp-1545', 'mp-1433570', 'mp-1700041', 'mp-1786474', 'mp-1591392']",0.00021655,"{'Nb': 6.0, 'Rh': 2.0}",139.48118416938905,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",3.1050783127424102e-06,0.00021655,0,0.0004331,MP,data/source/MP/cleaned/cifs/MP-mp-1545.cif,True,,data/final/MP/graphs/Au0.02Nb3Rh0.98-MP-mp-1545-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Bi2F0.1S2O0.9,2,0.0399999999999999,2.0,False,Bi4F0.2S4O1.8,Bi4S4O2,3.675,Oxide,True,Bi40F2S40O18,Bi-F-S-O,4,Supercon,Bi2S2F0.1O0.9,MP-mp-1078366,Bi4S4O2,Bi-S-O,Bi40S40O20,P 4/n m m,tetragonal,3.978733,3.978733,14.232676,data/final/MP/cifs/Bi2F0.1S2O0.9-MP-mp-1078366-synth_doped.cif,data/source/MP/raw/cifs/mp-1078366.cif,mp-1078366,1.1660999999999992,,2018-04-11 09:14:16,7.341941760049853,,,{'GGA': {'task_id': 'mp-1696674'}},0.0,4.62383276,700.0,-48.62854824,-4.862854824,{'tags': []},-48.62854824,-4.862854824,-1.0012689522500005,"['diel', 'bandstructure']",True,[196230],True,2021-05-12 10:56:43.348000,NM,10,7,mp-1078366,oxide,Bi2S2O,"{'functional': 'PBE', 'labels': ['Bi', 'S', 'O'], 'pot_type': 'paw'}","{'Bi': 2.0, 'S': 2.0, 'O': 1.0}",GGA,mp-1078366,"['mp-1078366', 'mp-1417642', 'mp-1540066', 'mp-1539562', 'mp-1696674', 'mp-1877541', 'mp-1608391']",9.01e-05,"{'Bi': 4.0, 'S': 4.0, 'O': 2.0}",225.30776266604192,[],NM,False,129,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",7.997949021716485e-07,9.01e-05,0,0.0001802,MP,data/source/MP/cleaned/cifs/MP-mp-1078366.cif,True,,data/final/MP/graphs/Bi2F0.1S2O0.9-MP-mp-1078366-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
H0.87Pd1,3,0.0695187165775401,2.0,False,H1.74Pd2,H2Pd2,3.625,Other,True,H46.524Pd53.476,H-Pd,2,Supercon,H0.87Pd1,MP-mp-1184548,H2Pd2,H-Pd,H50Pd50,P 63 m c,hexagonal,2.968136003881316,2.96813585,5.040799,data/final/MP/cifs/H0.87Pd1-MP-mp-1184548-synth_doped.cif,data/source/MP/raw/cifs/mp-1184548.cif,mp-1184548,0.0,,2019-01-11 12:52:40.348000,9.276812227294194,,,{'GGA': {'task_id': 'mp-1734957'}},0.0,3.52113336,520.0,-17.47744839,-4.3693620975,{'tags': []},-17.47744839,-4.3693620975,-0.0830581699999992,['bandstructure'],True,[],True,2021-05-12 10:58:27.755000,NM,4,5,mp-1184548,,HPd,"{'functional': 'PBE', 'labels': ['H', 'Pd'], 'pot_type': 'paw'}","{'H': 1.0, 'Pd': 1.0}",GGA,mp-1184548,"['mp-1184548', 'mp-1426775', 'mp-1734957', 'mp-1792734', 'mp-1612181']",3.7e-05,"{'H': 2.0, 'Pd': 2.0}",38.45896345503417,[],NM,False,186,0,"[0, 0, 0, 0]",1.924128820749941e-06,3.7e-05,0,7.4e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1184548.cif,True,,data/final/MP/graphs/H0.87Pd1-MP-mp-1184548-synth_doped.json,0,True,6mm,0,5,0,0,0,0,0,1,0,0,0,1.0,False
Cu1La1.847Sr0.153O4,3,0.0437142857142857,1.0,True,Cu1La1.847Sr0.153O4,Cu1La2O4,39.25,Cuprate,True,Cu14.286La26.386Sr2.186O57.142857142857146,Cu-La-Sr-O,4,Supercon,La1.847Sr0.153Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La1.847Sr0.153O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La1.847Sr0.153O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B2C1Mn0.3Ni1.7Y1,3,0.1,1.0,True,B2C1Mn0.3Ni1.7Y1,B2C1Ni2Y1,5.7,Other,True,B33.333C16.667Mn5Ni28.333Y16.667,B-C-Mn-Ni-Y,5,Supercon,Y1Ni1.7Mn0.3B2C1,MP-mp-6576,Y1Ni2B2C1,B-C-Ni-Y,B33.333C16.667Ni33.333Y16.667,I 4/m m m,tetragonal,3.548790000501972,3.548790000501972,5.76144136,data/final/MP/cifs/B2C1Mn0.3Ni1.7Y1-MP-mp-6576-synth_doped.cif,data/source/MP/raw/cifs/mp-6576.cif,mp-6576,0.0,,2011-05-13 05:21:43,6.099730998852292,10.17188/1281366,"@misc{osti_1281366,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281366"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688230'}},0.0,6.81083016,520.0,-43.677878,-7.279646333333333,{'tags': []},-43.677878,-7.279646333333333,-0.5109282141666659,"['xas', 'bandstructure']",True,"[75816, 89142, 83231, 79574, 41549]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6576,,YNi2B2C,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6576,"['mp-6576', 'mp-1007054', 'mp-1000583', 'mp-1439516', 'mp-1688230', 'mp-1794280', 'mp-1011792', 'mp-1597064']",0.0006603,"{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.3152437079014,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",1.010943177297096e-05,0.0006603,0,0.0006603,MP,data/source/MP/cleaned/cifs/MP-mp-6576.cif,True,,data/final/MP/graphs/B2C1Mn0.3Ni1.7Y1-MP-mp-6576-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Cr0.25Mo0.75,1,0.0,4.0,False,Cr1Mo3,Cr1Mo3,0.155,Other,True,Cr25Mo75,Cr-Mo,2,Supercon,Cr0.25Mo0.75,MP-mp-1226250,Cr1Mo3,Cr-Mo,Cr25Mo75,R 3 m,trigonal,2.9292595012012965,2.929259,8.402550146982588,data/final/MP/cifs/Cr0.25Mo0.75-MP-mp-1226250.cif,data/source/MP/raw/cifs/mp-1226250.cif,mp-1226250,0.0,,2019-01-13 02:14:49.683000,9.226047679982164,,,,0.4474087025000006,7.61248478,520.0,-40.40034175,-10.1000854375,{'tags': []},-40.40034175,-10.1000854375,0.4474087025000006,[],False,[],True,2021-05-12 11:00:56.634000,NM,4,2,mp-1226250,,CrMo3,"{'functional': 'PBE', 'labels': ['Cr_pv', 'Mo_pv'], 'pot_type': 'paw'}","{'Cr': 1.0, 'Mo': 3.0}",GGA,mp-1226250,"['mp-1226250', 'mp-1875050']",0.0006411,"{'Cr': 1.0, 'Mo': 3.0}",61.161390996707176,[],NM,False,160,0,"[0.0, 0.0, 0.0, 0.0]",1.048210299917011e-05,0.0006411,0,0.0006411,MP,data/source/MP/cleaned/cifs/MP-mp-1226250.cif,False,,data/final/MP/graphs/Cr0.25Mo0.75-MP-mp-1226250.json,0,True,3m,0,0,0,0,0,0,5,1,0,0,0,1.0,False
La1Rh3,1,0.0,6.0,False,La6Rh18,La6Rh18,2.6,Other,True,La25Rh75,La-Rh,2,Supercon,La1Rh3,MP-mp-974030,La6Rh18,La-Rh,La25Rh75,P 63/m m c,hexagonal,5.377119999451483,5.377119550000001,17.845956,data/final/MP/cifs/La1Rh3-MP-mp-974030.cif,data/source/MP/raw/cifs/mp-974030.cif,mp-974030,0.0,,2015-09-16 19:32:51,9.98026064888116,10.17188/1314396,"@misc{osti_1314396,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaRh3 (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1314396"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1731932'}},0.0,7.51131764,520.0,-174.79382463,-7.28307602625,{'tags': ['Gadolinium rhodium (1/3)']},-174.79382463,-7.28307602625,-0.5258433474999992,"['xas', 'bandstructure']",True,[641723],True,2021-05-12 10:57:55.580000,NM,24,8,mp-974030,,LaRh3,"{'functional': 'PBE', 'labels': ['La', 'Rh_pv'], 'pot_type': 'paw'}","{'La': 1.0, 'Rh': 3.0}",GGA,mp-974030,"['mp-974448', 'mp-974677', 'mp-974030', 'mp-1446636', 'mp-1731932', 'mp-1816783', 'mp-975101', 'mp-1611179']",4.568333333333333e-05,"{'La': 6.0, 'Rh': 18.0}",446.8583303002895,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.133935106811243e-07,4.568333333333333e-05,0,0.0002741,MP,data/source/MP/cleaned/cifs/MP-mp-974030.cif,False,,data/final/MP/graphs/La1Rh3-MP-mp-974030.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Cr1Si2,1,0.0,1.0,True,Cr1Si2,Cr1Si2,0.0,Other,True,Cr33.333Si66.667,Cr-Si,2,Supercon,Cr1Si2,MP-mp-8937,Cr1Si2,Cr-Si,Cr33.333Si66.667,I 4/m m m,tetragonal,3.0829320006202496,3.0829320006202496,4.3529562,data/final/MP/cifs/Cr1Si2-MP-mp-8937.cif,data/source/MP/raw/cifs/mp-8937.cif,mp-8937,0.0,,2011-05-27 17:10:42,5.015722573893226,10.17188/1312847,"@misc{osti_1312847,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CrSi2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1312847"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1675474'}},0.0,10.58519539,520.0,-21.62040737,-7.206802456666666,{'tags': ['Chromium silicide (1/2)']},-21.62040737,-7.206802456666666,-0.3249106199999995,"['xas', 'elasticity', 'bandstructure']",True,[71499],True,2021-05-12 10:56:33.121000,NM,3,11,mp-8937,,CrSi2,"{'functional': 'PBE', 'labels': ['Cr_pv', 'Si'], 'pot_type': 'paw'}","{'Cr': 1.0, 'Si': 2.0}",GGA,mp-8937,"['mp-923582', 'mp-922807', 'mp-908480', 'mp-8937', 'mp-1138588', 'mp-1146631', 'mp-1248534', 'mp-1417922', 'mp-1675474', 'mp-1793772', 'mp-1637671']",3.7e-06,"{'Cr': 1.0, 'Si': 2.0}",35.8105323060981,[],NM,False,139,0,"[0, 0, 0]",1.0332155826038745e-07,3.7e-06,0,3.7e-06,MP,data/source/MP/cleaned/cifs/MP-mp-8937.cif,False,,data/final/MP/graphs/Cr1Si2-MP-mp-8937.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Al1Na1Si1,1,0.0,2.0,False,Al2Na2Si2,Al2Na2Si2,7.2,Other,True,Al33.333Na33.333Si33.333,Al-Na-Si,3,Supercon,Na1Al1Si1,MP-mp-27335,Na2Al2Si2,Al-Na-Si,Al33.333Na33.333Si33.333,P 4/n m m,tetragonal,4.139325,4.139325,7.310042,data/final/MP/cifs/Al1Na1Si1-MP-mp-27335.cif,data/source/MP/raw/cifs/mp-27335.cif,mp-27335,0.0,,2014-02-25 23:08:42,2.06971694308038,10.17188/1201540,"@misc{osti_1201540,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NaAlSi (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201540"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703212'}},0.0,4.48213628,520.0,-21.55950661,-3.5932511016666666,"{'tags': ['Sodium aluminium silicon', 'Sodium aluminium silicide (1/1/1)', 'Aluminium sodium silicide (1/1/1)']}",-21.55950661,-3.5932511016666666,-0.071779387183908,"['xas', 'elasticity', 'bandstructure']",True,"[238553, 182834, 10146]",True,2021-05-12 10:56:18.721000,NM,6,17,mp-27335,,NaAlSi,"{'functional': 'PBE', 'labels': ['Na_pv', 'Al', 'Si'], 'pot_type': 'paw'}","{'Na': 1.0, 'Al': 1.0, 'Si': 1.0}",GGA,mp-27335,"['mp-922481', 'mp-907996', 'mp-923262', 'mp-504504', 'mp-27335', 'mp-1070847', 'mp-1070870', 'mp-1070892', 'mp-1077419', 'mp-1170832', 'mp-1248687', 'mp-1256385', 'mp-1432632', 'mp-1703212', 'mp-1804708', 'mp-1589369', 'mp-1070891']",0.00059845,"{'Na': 2.0, 'Al': 2.0, 'Si': 2.0}",125.25034336909992,[],NM,False,129,0,"[0, 0, 0, 0, 0, 0]",9.556061626696372e-06,0.00059845,0,0.0011969,MP,data/source/MP/cleaned/cifs/MP-mp-27335.cif,False,,data/final/MP/graphs/Al1Na1Si1-MP-mp-27335.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
C1Ga1Mo2,1,0.0,2.0,False,C2Ga2Mo4,C2Ga2Mo4,3.9,Other,True,C25Ga25Mo50,C-Ga-Mo,3,Supercon,C1Ga1Mo2,MP-mp-1079635,Ga2Mo4C2,C-Ga-Mo,C25Ga25Mo50,P 63/m m c,hexagonal,3.0627099992808984,3.06271029,13.240542,data/final/MP/cifs/C1Ga1Mo2-MP-mp-1079635.cif,data/source/MP/raw/cifs/mp-1079635.cif,mp-1079635,0.0,,2018-04-15 19:35:32,8.448288363392336,,,{'GGA': {'task_id': 'mp-1698498'}},0.0063441651724147,7.61152947,520.0,-68.81949019,-8.60243627375,"{'tags': ['Cr2AlC', 'Mo2GaC', 'Molybdenum gallium carbide (2/1/1)']}",-68.81949019,-8.60243627375,-0.1158955781249986,['bandstructure'],True,"[617917, 180615, 167967]",True,2021-05-12 10:58:16.596000,NM,8,5,mp-1079635,,GaMo2C,"{'functional': 'PBE', 'labels': ['Ga_d', 'Mo_pv', 'C'], 'pot_type': 'paw'}","{'Ga': 1.0, 'Mo': 2.0, 'C': 1.0}",GGA,mp-1079635,"['mp-1079635', 'mp-1422100', 'mp-1698498', 'mp-1939395', 'mp-1593634']",0.00110975,"{'Ga': 2.0, 'Mo': 4.0, 'C': 2.0}",107.55935840820034,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",2.063511750950334e-05,0.00110975,0,0.0022195,MP,data/source/MP/cleaned/cifs/MP-mp-1079635.cif,False,,data/final/MP/graphs/C1Ga1Mo2-MP-mp-1079635.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Os3Th7,1,0.0,2.0,False,Os6Th14,Os6Th14,1.51,Other,True,Os30Th70,Os-Th,2,Supercon,Os3Th7,MP-mp-569819,Th14Os6,Os-Th,Os30Th70,P 63 m c,hexagonal,6.347595,10.033913997023374,10.03391363,data/final/MP/cifs/Os3Th7-MP-mp-569819.cif,data/source/MP/raw/cifs/mp-569819.cif,mp-569819,0.0,,2014-12-22 16:29:20,13.171172156879535,10.17188/1275279,"@misc{osti_1275279,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Th7Os3 (SG:186) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1275279"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1675445'}},0.0,7.42894192,520.0,-177.86702483,-8.8933512415,{'tags': ['Thorium osmium (7/3)']},-177.86702483,-8.8933512415,-0.3354405899999989,"['xas', 'bandstructure']",True,"[647834, 150669]",True,2021-05-12 10:57:24.969000,NM,20,8,mp-569819,,Th7Os3,"{'functional': 'PBE', 'labels': ['Th', 'Os_pv'], 'pot_type': 'paw'}","{'Th': 7.0, 'Os': 3.0}",GGA,mp-569819,"['mp-977921', 'mp-914536', 'mp-1382127', 'mp-1675445', 'mp-1883235', 'mp-978175', 'mp-1630321', 'mp-569819']",9.205e-05,"{'Th': 14.0, 'Os': 6.0}",553.452774207454,[],NM,False,186,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.326390409075675e-07,9.205e-05,0,0.0001841,MP,data/source/MP/cleaned/cifs/MP-mp-569819.cif,False,,data/final/MP/graphs/Os3Th7-MP-mp-569819.json,0,True,6mm,0,5,0,0,0,0,0,1,0,0,0,1.0,False
N0.906Zr1,2,0.049317943336831,1.0,True,N0.906Zr1,N1Zr1,1.5,Other,True,N47.534Zr52.466,N-Zr,2,Supercon,N0.906Zr1,MP-mp-1352,Zr1N1,N-Zr,N50Zr50,F m -3 m,cubic,3.26515324,3.26515324,3.26515324,data/final/MP/cifs/N0.906Zr1-MP-mp-1352-synth_doped.cif,data/source/MP/raw/cifs/mp-1352.cif,mp-1352,0.0,,2011-05-12 18:00:29,7.098978292634157,10.17188/1189641,"@misc{osti_1189641,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrN (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189641"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688030'}},0.0,7.38623329,520.0,-20.24349199,-10.121745995,"{'tags': ['Zirconium(III) nitride', 'Zirconium nitride', 'Zirconium nitride (1/1) - RS-type', 'Zirconium nitride - B1, NP', 'Zirconium nitride (1/1)', 'Zirconium nitride - B1', 'Zirconium nitride (1/1) - rocksalt type', 'Zirconium nitride (1/1) - thin film']}",-20.24349199,-10.121745995,-1.8601482175000008,"['xas', 'elasticity', 'bandstructure']",True,"[41934, 644891, 644889, 189103, 167851, 44506, 183181, 644893, 180850, 644895, 644881, 644887, 180849, 180847, 644886, 644898, 644890, 644884, 644888, 644894, 181143, 183417, 658394, 644885, 180848, 186384, 187189, 169453, 26950, 644897, 644882, 644892, 644896, 192045, 658332, 76530, 185548]",True,2021-05-12 10:56:12.755000,NM,2,37,mp-1352,,ZrN,"{'functional': 'PBE', 'labels': ['Zr_sv', 'N'], 'pot_type': 'paw'}","{'Zr': 1.0, 'N': 1.0}",GGA,mp-1352,"['mp-1007211', 'mp-1000757', 'mp-1352', 'mp-1057220', 'mp-1057225', 'mp-1057243', 'mp-1057499', 'mp-1057470', 'mp-1057478', 'mp-1059440', 'mp-1059449', 'mp-1059470', 'mp-1059884', 'mp-1059923', 'mp-1059899', 'mp-1059911', 'mp-1059943', 'mp-1059870', 'mp-1060984', 'mp-1061045', 'mp-1060997', 'mp-1061257', 'mp-1061274', 'mp-1061302', 'mp-1440615', 'mp-1688030', 'mp-1794882', 'mp-1011953', 'mp-1593178', 'mp-1595221', 'mp-1059908', 'mp-1061030', 'mp-1059465', 'mp-1057239', 'mp-1057491', 'mp-1059936', 'mp-1061294']",0.0002243,"{'Zr': 1.0, 'N': 1.0}",24.614765837074486,[],NM,False,225,0,"[0, 0]",9.112416566732552e-06,0.0002243,0,0.0002243,MP,data/source/MP/cleaned/cifs/MP-mp-1352.cif,True,,data/final/MP/graphs/N0.906Zr1-MP-mp-1352-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Al0.185B2Mg0.815,3,0.1233333333333333,1.0,True,Al0.185B2Mg0.815,B2Mg1,25.3,Other,True,Al6.167B66.667Mg27.167,Al-B-Mg,3,Supercon,Mg0.815Al0.185B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/Al0.185B2Mg0.815-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/Al0.185B2Mg0.815-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
B1.84F0.16Mg1,3,0.1066666666666666,1.0,True,B1.84F0.16Mg1,B2Mg1,16.0,Other,True,B61.333F5.333Mg33.333,B-F-Mg,3,Supercon,Mg1B1.84F0.16,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B1.84F0.16Mg1-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B1.84F0.16Mg1-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Al1Ba1Si1,1,0.0,1.0,True,Al1Ba1Si1,Al1Ba1Si1,0.0,Other,True,Al33.333Ba33.333Si33.333,Al-Ba-Si,3,Supercon,Ba1Al1Si1,MP-mp-13149,Ba1Al1Si1,Al-Ba-Si,Al33.333Ba33.333Si33.333,P -6 m 2,hexagonal,4.321636000482016,4.32163638,5.189042,data/final/MP/cifs/Al1Ba1Si1-MP-mp-13149.cif,data/source/MP/raw/cifs/mp-13149.cif,mp-13149,0.0,,2011-05-27 18:23:22,3.806505581790664,10.17188/1189416,"@misc{osti_1189416,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BaAlSi (SG:187) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189416"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1764250'}},0.0,4.21068016,520.0,-12.253411,-4.084470333333333,{'tags': ['Barium aluminium silicide (1/1/1) - (SrPtSb)-type']},-12.253411,-4.084470333333333,-0.3641834399999997,"['xas', 'elasticity', 'bandstructure']",True,[162866],True,2021-05-12 10:56:12.755000,NM,3,12,mp-13149,,BaAlSi,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Al', 'Si'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Al': 1.0, 'Si': 1.0}",GGA,mp-13149,"['mp-1006947', 'mp-1000475', 'mp-13149', 'mp-1156365', 'mp-1115778', 'mp-1248464', 'mp-1256285', 'mp-1386818', 'mp-1764250', 'mp-1782405', 'mp-1011669', 'mp-1610069']",0.0004086,"{'Ba': 1.0, 'Al': 1.0, 'Si': 1.0}",83.92942303947942,[],NM,False,187,0,"[0, 0, 0]",4.868376133216112e-06,0.0004086,0,0.0004086,MP,data/source/MP/cleaned/cifs/MP-mp-13149.cif,False,,data/final/MP/graphs/Al1Ba1Si1-MP-mp-13149.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Ga1Hf0.261V2.739,3,0.1305,2.0,False,Ga2Hf0.522V5.478,Ga2V6,6.4,Other,True,Ga25Hf6.525V68.475,Ga-Hf-V,3,Supercon,V2.739Hf0.261Ga1,MP-mp-22568,V6Ga2,Ga-V,Ga25V75,P m -3 n,cubic,4.789645,4.789645,4.789645,data/final/MP/cifs/Ga1Hf0.261V2.739-MP-mp-22568-synth_doped.cif,data/source/MP/raw/cifs/mp-22568.cif,mp-22568,0.0,,2014-02-22 11:36:40,6.726541666276222,10.17188/1198793,"@misc{osti_1198793,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Ga (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198793"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686867'}},0.0,5.67452231,520.0,-61.95244347,-7.74405543375,{'tags': ['Gallium vanadium (1/3)']},-61.95244347,-7.74405543375,-0.1741018756249994,"['xas', 'elasticity', 'bandstructure']",True,"[635643, 635628, 635619, 635634, 104021, 635646, 635604, 635610, 635617, 635624, 635626, 635605, 635631, 635625, 635636, 635603, 104020, 635616, 635607]",True,2021-05-12 10:56:16.728000,FM,8,9,mp-22568,,V3Ga,"{'functional': 'PBE', 'labels': ['V_pv', 'Ga_d'], 'pot_type': 'paw'}","{'V': 3.0, 'Ga': 1.0}",GGA,mp-22568,"['mp-941343', 'mp-941663', 'mp-934924', 'mp-22568', 'mp-1440749', 'mp-1686867', 'mp-1804076', 'mp-1593784', 'mp-1595713']",0.09063635,"{'V': 6.0, 'Ga': 2.0}",109.87780534443452,[],FM,True,131,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.0, -0.0, -0.0]",0.0016497662965852,0.09063635,2,0.1812727,MP,data/source/MP/cleaned/cifs/MP-mp-22568.cif,True,,data/final/MP/graphs/Ga1Hf0.261V2.739-MP-mp-22568-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Cl1Hf1N1Na0.29,2,0.02370820668693,6.0,False,Cl6Hf6N6Na1.74,Cl6Hf6N6Na2,19.0,Other,True,Cl30.395Hf30.395N30.395Na8.815,Cl-Hf-N-Na,4,Supercon,Na0.29Hf1N1Cl1,MP-mp-1220765,Na2Hf6N6Cl6,Cl-Hf-N-Na,Cl30Hf30N30Na10,C 1 2/m 1,monoclinic,6.327425994906367,6.32844823,10.40157369,data/final/MP/cifs/Cl1Hf1N1Na0.29-MP-mp-1220765-synth_doped.cif,data/source/MP/raw/cifs/mp-1220765.cif,mp-1220765,0.0,,2019-01-12 21:33:40.303000,6.645973211107905,,,{'GGA': {'task_id': 'mp-1684280'}},0.1194778939999974,5.91846799,520.0,-157.73704614,-7.886852307,{'tags': []},-157.73704614,-7.886852307,-2.004433647155172,[],False,[],True,2021-05-12 11:00:47.244000,NM,20,4,mp-1220765,,NaHf3(NCl)3,"{'functional': 'PBE', 'labels': ['Na_pv', 'Hf_pv', 'N', 'Cl'], 'pot_type': 'paw'}","{'Na': 1.0, 'Hf': 3.0, 'N': 3.0, 'Cl': 3.0}",GGA,mp-1220765,"['mp-1220765', 'mp-1373092', 'mp-1684280', 'mp-1838829']",0.0001618,"{'Na': 2.0, 'Hf': 6.0, 'N': 6.0, 'Cl': 6.0}",353.21645722828464,[],NM,False,12,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",9.161521027058388e-07,0.0001618,0,0.0003236,MP,data/source/MP/cleaned/cifs/MP-mp-1220765.cif,True,,data/final/MP/graphs/Cl1Hf1N1Na0.29-MP-mp-1220765-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
As2Ba0.64Fe2K0.36,3,0.0560000000000001,2.0,False,As4Ba1.28Fe4K0.72,As4Ba1Fe4K1,25.6,Ferrite,True,As40Ba12.8Fe40K7.2,As-Ba-Fe-K,4,Supercon,Ba0.64K0.36Fe2As2,MP-mp-1223517,K1Ba1Fe4As4,As-Ba-Fe-K,As40Ba10Fe40K10,C m m m,orthorhombic,5.479027,5.480024002658328,7.13170472,data/final/MP/cifs/As2Ba0.64Fe2K0.36-MP-mp-1223517-synth_doped.cif,data/source/MP/raw/cifs/mp-1223517.cif,mp-1223517,0.0,,2019-01-12 23:54:03.876000,5.87534599912672,,,{'GGA': {'task_id': 'mp-1743010'}},0.0132513644999994,4.21185628,520.0,-59.66633886,-5.966633886,{'tags': []},-59.66633886,-5.966633886,-0.4120461663000007,[],False,[],True,2021-05-12 11:00:52.054000,FM,10,4,mp-1223517,,KBa(FeAs)4,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",GGA,mp-1223517,"['mp-1223517', 'mp-1396881', 'mp-1743010', 'mp-1827585']",0.9947188,"{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",197.6961518155852,[],FM,True,65,1,"[0.0, 0.0, 0.3, 0.3, 0.3, 0.3, 0.0, 0.0, 0.0, 0.0]",0.0050315536790412,0.9947188,4,0.9947188,MP,data/source/MP/cleaned/cifs/MP-mp-1223517.cif,True,,data/final/MP/graphs/As2Ba0.64Fe2K0.36-MP-mp-1223517-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Lu2Ni3Si5,1,0.0,2.0,False,Lu4Ni6Si10,Lu4Ni6Si10,0.0,Other,True,Lu20Ni30Si50,Lu-Ni-Si,3,Supercon,Lu2Ni3Si5,MP-mp-1105977,Lu4Si10Ni6,Lu-Ni-Si,Lu20Ni30Si50,I b a m,orthorhombic,5.578381997362685,7.80159672,7.801596718737771,data/final/MP/cifs/Lu2Ni3Si5-MP-mp-1105977.cif,data/source/MP/raw/cifs/mp-1105977.cif,mp-1105977,0.0,,2018-07-19 07:07:54,7.532838067224407,,,{'GGA': {'task_id': 'mp-1676213'}},0.0118992707500016,8.10377768,520.0,-122.12433158,-6.106216579,"{'tags': ['U2Co3Si5', 'Lutetium nickel silicide (2/3/5)', 'Lu2Ni3Si5 orth']}",-122.12433158,-6.106216579,-0.7198284610000002,['bandstructure'],True,[658652],True,2021-05-12 10:58:22.271000,NM,20,5,mp-1105977,,Lu2Si5Ni3,"{'functional': 'PBE', 'labels': ['Lu_3', 'Si', 'Ni_pv'], 'pot_type': 'paw'}","{'Lu': 2.0, 'Si': 5.0, 'Ni': 3.0}",GGA,mp-1105977,"['mp-1105977', 'mp-1211063', 'mp-1381741', 'mp-1676213', 'mp-1609364']",0.00940885,"{'Lu': 4.0, 'Si': 10.0, 'Ni': 6.0}",293.8208597039657,[],NM,False,72,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.404480614126396e-05,0.00940885,0,0.0188177,MP,data/source/MP/cleaned/cifs/MP-mp-1105977.cif,False,,data/final/MP/graphs/Lu2Ni3Si5-MP-mp-1105977.json,0,True,mmm,0,0,0,7,0,0,0,0,0,1,0,1.0,False
Co28Zr72,3,0.1066666666666666,0.055563492063492,False,Co1.556Zr4,Co2Zr4,3.12,Other,True,Co28Zr72,Co-Zr,2,Supercon,Co28Zr72,MP-mp-628,Zr4Co2,Co-Zr,Co33.333Zr66.667,I 4/m c m,tetragonal,5.27792884001752,5.27792884,5.277928840000001,data/final/MP/cifs/Co28Zr72-MP-mp-628-synth_doped.cif,data/source/MP/raw/cifs/mp-628.cif,mp-628,0.0,,2011-05-13 12:16:44,7.17077101131263,10.17188/1278899,"@misc{osti_1278899,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Zr2Co (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278899"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677545'}},0.0,4.51380976,520.0,-49.95120762,-8.325201269999999,"{'tags': ['Cobalt zirconium (1/2)', 'Zirconium cobalt (2/1)']}",-49.95120762,-8.325201269999999,-0.2572949183333328,"['xas', 'elasticity', 'bandstructure']",True,"[625671, 191386, 625688, 102740, 625665]",True,2021-05-12 10:56:27.046000,NM,6,20,mp-628,,Zr2Co,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Co'], 'pot_type': 'paw'}","{'Zr': 2.0, 'Co': 1.0}",GGA,mp-628,"['mp-928347', 'mp-912327', 'mp-928866', 'mp-628', 'mp-1071352', 'mp-1071381', 'mp-1071431', 'mp-1071762', 'mp-1071803', 'mp-1071859', 'mp-1071883', 'mp-1071742', 'mp-1071925', 'mp-1441633', 'mp-1677545', 'mp-1802810', 'mp-1591799', 'mp-1071792', 'mp-1071416', 'mp-1071915']",0.0001226,"{'Zr': 4.0, 'Co': 2.0}",111.79353060019714,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0]",2.1933290654975308e-06,0.0001226,0,0.0002452,MP,data/source/MP/cleaned/cifs/MP-mp-628.cif,True,,data/final/MP/graphs/Co28Zr72-MP-mp-628-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ba2Cu3Nd0.5Pr0.5O7,1,0.0,2.0,False,Ba4Cu6Nd1Pr1O14,Ba4Cu6Nd1Pr1O14,0.0,Cuprate,True,Ba15.385Cu23.077Nd3.846Pr3.846O53.84615384615385,Ba-Cu-Nd-Pr-O,5,Supercon,Nd0.5Pr0.5Ba2Cu3O7,MP-mp-1228202,Ba4Pr1Nd1Cu6O14,Ba-Cu-Nd-Pr-O,Ba15.385Cu23.077Nd3.846Pr3.846O53.84615384615385,P m m m,orthorhombic,3.889567,3.959351,23.802181,data/final/MP/cifs/Ba2Cu3Nd0.5Pr0.5O7-MP-mp-1228202.cif,data/source/MP/raw/cifs/mp-1228202.cif,mp-1228202,0.0,,2019-01-13 03:56:34.978000,6.5220887552009446,,,,0.0255490605208263,3.22208434,520.0,-157.3612514,-6.0523558230769225,{'tags': []},-157.3612514,-6.0523558230769225,-2.149524293653845,[],False,[],True,2021-05-12 11:00:59.151000,NM,26,3,mp-1228202,oxide,Ba4PrNd(Cu3O7)2,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Pr_3', 'Nd_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 4.0, 'Pr': 1.0, 'Nd': 1.0, 'Cu': 6.0, 'O': 14.0}",GGA,mp-1228202,"['mp-1228202', 'mp-1375393', 'mp-1836040']",0.0068628,"{'Ba': 4.0, 'Pr': 1.0, 'Nd': 1.0, 'Cu': 6.0, 'O': 14.0}",366.557419337326,[],NM,False,47,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, 0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",1.8722305532395948e-05,0.0068628,0,0.0068628,MP,data/source/MP/cleaned/cifs/MP-mp-1228202.cif,False,,data/final/MP/graphs/Ba2Cu3Nd0.5Pr0.5O7-MP-mp-1228202.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
As2Ba0.5Co0.1Fe1.9K0.5,2,0.04,2.0,False,As4Ba1Co0.2Fe3.8K1,As4Ba1Fe4K1,30.31,Ferrite,True,As40Ba10Co2Fe38K10,As-Ba-Co-Fe-K,5,Supercon,Ba0.5K0.5Fe1.9Co0.1As2,MP-mp-1223517,K1Ba1Fe4As4,As-Ba-Fe-K,As40Ba10Fe40K10,C m m m,orthorhombic,5.479027,5.480024002658328,7.13170472,data/final/MP/cifs/As2Ba0.5Co0.1Fe1.9K0.5-MP-mp-1223517-synth_doped.cif,data/source/MP/raw/cifs/mp-1223517.cif,mp-1223517,0.0,,2019-01-12 23:54:03.876000,5.87534599912672,,,{'GGA': {'task_id': 'mp-1743010'}},0.0132513644999994,4.21185628,520.0,-59.66633886,-5.966633886,{'tags': []},-59.66633886,-5.966633886,-0.4120461663000007,[],False,[],True,2021-05-12 11:00:52.054000,FM,10,4,mp-1223517,,KBa(FeAs)4,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",GGA,mp-1223517,"['mp-1223517', 'mp-1396881', 'mp-1743010', 'mp-1827585']",0.9947188,"{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",197.6961518155852,[],FM,True,65,1,"[0.0, 0.0, 0.3, 0.3, 0.3, 0.3, 0.0, 0.0, 0.0, 0.0]",0.0050315536790412,0.9947188,4,0.9947188,MP,data/source/MP/cleaned/cifs/MP-mp-1223517.cif,True,,data/final/MP/graphs/As2Ba0.5Co0.1Fe1.9K0.5-MP-mp-1223517-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Cu1La1.822Sr0.178O4,3,0.0508571428571428,1.0,True,Cu1La1.822Sr0.178O4,Cu1La2O4,36.0,Cuprate,True,Cu14.286La26.029Sr2.543O57.142857142857146,Cu-La-Sr-O,4,Supercon,La1.822Sr0.178Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La1.822Sr0.178O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La1.822Sr0.178O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As2Fe2Sr4V2O6,1,0.0,1.0,True,As2Fe2Sr4V2O6,As2Fe2Sr4V2O6,29.25,Ferrite,True,As12.5Fe12.5Sr25V12.5O37.5,As-Fe-Sr-V-O,5,Supercon,Fe2As2Sr4V2O6,MP-mp-1106248,Sr4V2Fe2As2O6,As-Fe-Sr-V-O,As12.5Fe12.5Sr25V12.5O37.5,P 4/n m m,tetragonal,4.014244,4.015757,16.476769,data/final/MP/cifs/As2Fe2Sr4V2O6-MP-mp-1106248.cif,data/source/MP/raw/cifs/mp-1106248.cif,mp-1106248,0.0,,2018-07-19 09:49:45,5.063295609126891,,,{'GGA+U': {'task_id': 'mp-1708431'}},0.1360098730625019,3.8462893,520.0,-101.34073511,-6.333795944375,"{'tags': ['Distrontium vanadate(III) iron(II) arsenide', 'Iron distrontium vanadate(III) arsenide', 'Distrontium iron vanadate(III) arsenide']}",-101.34073511,-6.333795944375,-2.0314330885416663,['bandstructure'],True,"[248695, 165984, 184994]",True,2021-05-12 10:58:22.271000,FiM,16,19,mp-1106248,oxide,Sr2VFeAsO3,"{'functional': 'PBE', 'labels': ['Sr_sv', 'V_pv', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'V': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 3.0}",GGA+U,mp-1106248,"['mp-1106248', 'mp-1190233', 'mp-1291490', 'mp-1284904', 'mp-1297196', 'mp-1297348', 'mp-1285256', 'mp-1288721', 'mp-1298909', 'mp-1283380', 'mp-1293419', 'mp-1286747', 'mp-1298992', 'mp-1294577', 'mp-1292404', 'mp-1274716', 'mp-1425554', 'mp-1708431', 'mp-1597928']",1.83902145,"{'Sr': 4.0, 'V': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 6.0}",265.609280174371,[],FiM,True,129,2,"[-0.0, -0.0, -0.0, -0.0, -1.9, -1.9, 3.6, 3.6, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0138475692475254,1.83902145,4,3.6780429,MP,data/source/MP/cleaned/cifs/MP-mp-1106248.cif,False,,data/final/MP/graphs/As2Fe2Sr4V2O6-MP-mp-1106248.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
As1Zr1,1,0.0,4.0,False,As4Zr4,As4Zr4,0.0,Other,True,As50Zr50,As-Zr,2,Supercon,As1Zr1,MP-mp-1682,Zr4As4,As-Zr,As50Zr50,P 63/m m c,hexagonal,3.838171998926663,3.83817247,13.007194,data/final/MP/cifs/As1Zr1-MP-mp-1682.cif,data/source/MP/raw/cifs/mp-1682.cif,mp-1682,0.0,,2011-05-13 13:43:15,6.650200618727967,10.17188/1192188,"@misc{osti_1192188,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrAs (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1192188"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700083'}},0.0,5.65608966,520.0,-61.96550595,-7.74568824375,"{'tags': ['Zirconium(III) arsenide (1/2)', 'Zirconium arsenide (1/1)']}",-61.96550595,-7.74568824375,-1.1422787262500007,"['xas', 'elasticity', 'bandstructure']",True,"[20291, 611618]",True,2021-05-12 10:56:14.760000,NM,8,8,mp-1682,,ZrAs,"{'functional': 'PBE', 'labels': ['Zr_sv', 'As'], 'pot_type': 'paw'}","{'Zr': 1.0, 'As': 1.0}",GGA,mp-1682,"['mp-1682', 'mp-927827', 'mp-927405', 'mp-911431', 'mp-1419162', 'mp-1700083', 'mp-1789286', 'mp-1587105']",0.007421,"{'Zr': 4.0, 'As': 4.0}",165.94462354518782,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.000178878949892,0.007421,0,0.029684,MP,data/source/MP/cleaned/cifs/MP-mp-1682.cif,False,,data/final/MP/graphs/As1Zr1-MP-mp-1682.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
La0.3Os4Pr0.7Sb12,3,0.0352941176470588,1.0,True,La0.3Os4Pr0.7Sb12,Os4Pr1Sb12,1.528,Heavy_fermion,True,La1.765Os23.529Pr4.118Sb70.588,La-Os-Pr-Sb,4,Supercon,Pr0.7La0.3Os4Sb12,MP-mp-4251,Pr1Sb12Os4,Os-Pr-Sb,Os23.529Pr5.882Sb70.588,I m -3,cubic,8.16020751180899,8.16020751,8.16020751,data/final/MP/cifs/La0.3Os4Pr0.7Sb12-MP-mp-4251-synth_doped.cif,data/source/MP/raw/cifs/mp-4251.cif,mp-4251,0.0,,2011-05-15 09:44:04,9.380402650313032,10.17188/1208003,"@misc{osti_1208003,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Pr(Sb3Os)4 (SG:204) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208003"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700242'}},0.0086126564705901,7.28147826,520.0,-102.089288,-6.005252235294117,{'tags': ['Praseodymium osmium antimonide (1/4/12)']},-102.089288,-6.005252235294117,-0.1677005267647063,"['xas', 'elasticity', 'bandstructure']",True,"[155178, 155187, 165911, 155182, 155185, 155181, 647731, 155183, 155188, 155180, 155179, 165910, 155184, 155186, 183087]",True,2021-05-12 10:56:20.740000,NM,17,9,mp-4251,,Pr(Sb3Os)4,"{'functional': 'PBE', 'labels': ['Pr_3', 'Sb', 'Os_pv'], 'pot_type': 'paw'}","{'Pr': 1.0, 'Sb': 12.0, 'Os': 4.0}",GGA,mp-4251,"['mp-1000443', 'mp-1006919', 'mp-4251', 'mp-1188290', 'mp-1430112', 'mp-1700242', 'mp-1817791', 'mp-1011635', 'mp-1609307']",0.0526026,"{'Pr': 1.0, 'Sb': 12.0, 'Os': 4.0}",418.2940787754696,[],NM,False,204,0,"[-0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.000125755067234,0.0526026,0,0.0526026,MP,data/source/MP/cleaned/cifs/MP-mp-4251.cif,True,,data/final/MP/graphs/La0.3Os4Pr0.7Sb12-MP-mp-4251-synth_doped.json,0,True,m-3,2,0,0,0,0,0,0,0,0,1,0,1.0,False
B2Nb0.83,3,0.0800942285041225,1.0,True,B2Nb0.83,B2Nb1,9.77,Other,True,B70.671Nb29.329,B-Nb,2,Supercon,B2Nb0.83,MP-mp-450,Nb1B2,B-Nb,B66.667Nb33.333,P 6/m m m,hexagonal,3.1120839952382067,3.1120833,3.337463,data/final/MP/cifs/B2Nb0.83-MP-mp-450-synth_doped.cif,data/source/MP/raw/cifs/mp-450.cif,mp-450,0.0,,2011-05-12 17:50:32,6.793798027120384,10.17188/1208214,"@misc{osti_1208214,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbB2 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208214"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668420'}},0.0,8.5150746,520.0,-25.54163782,-8.513879273333332,{'tags': ['Niobium boride (1/2)']},-25.54163782,-8.513879273333332,-0.6938497461111103,"['xas', 'elasticity', 'bandstructure']",True,"[614908, 614900, 614887, 30421, 30328, 614889, 614902, 614904, 191901, 614894, 614884, 614892, 44457, 656214, 108068]",True,2021-05-12 10:56:20.740000,NM,3,18,mp-450,,NbB2,"{'functional': 'PBE', 'labels': ['Nb_pv', 'B'], 'pot_type': 'paw'}","{'Nb': 1.0, 'B': 2.0}",GGA,mp-450,"['mp-1000549', 'mp-1007025', 'mp-672219', 'mp-450', 'mp-1062058', 'mp-1062041', 'mp-1062083', 'mp-1062744', 'mp-1062870', 'mp-1062829', 'mp-1440923', 'mp-1668420', 'mp-1792772', 'mp-1011762', 'mp-1595532', 'mp-1592705', 'mp-1062075', 'mp-1062849']",0.0024194,"{'Nb': 1.0, 'B': 2.0}",27.99300898631796,[],NM,False,191,0,"[0, 0, 0]",8.642872229928986e-05,0.0024194,0,0.0024194,MP,data/source/MP/cleaned/cifs/MP-mp-450.cif,True,,data/final/MP/graphs/B2Nb0.83-MP-mp-450-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
As3Rh5,3,0.0833333333333333,0.3333666666666667,False,As1Rh1.667,As1Rh2,0.0,Other,True,As37.5Rh62.5,As-Rh,2,Supercon,As3Rh5,MP-mp-2302,As1Rh2,As-Rh,As33.333Rh66.667,F m -3 m,cubic,4.07042342,4.070423419999999,4.070423419999999,data/final/MP/cifs/As3Rh5-MP-mp-2302-synth_doped.cif,data/source/MP/raw/cifs/mp-2302.cif,mp-2302,0.0,,2011-05-12 21:19:26,9.775481970156644,10.17188/1199170,"@misc{osti_1199170,
    author = ""Persson, Kristin"",
    title = ""Materials Data on AsRh2 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199170"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686531'}},0.0,6.35745476,520.0,-20.76696624,-6.92232208,{'tags': ['Rhodium arsenide (2/1)']},-20.76696624,-6.92232208,-0.4597440316666663,"['xas', 'elasticity', 'bandstructure']",True,"[43362, 44050, 611265, 43511]",True,2021-05-12 10:56:16.728000,NM,3,8,mp-2302,,AsRh2,"{'functional': 'PBE', 'labels': ['As', 'Rh_pv'], 'pot_type': 'paw'}","{'As': 1.0, 'Rh': 2.0}",GGA,mp-2302,"['mp-990941', 'mp-992935', 'mp-2302', 'mp-1440129', 'mp-1686531', 'mp-1794319', 'mp-994249', 'mp-1589754']",0.0038513,"{'As': 1.0, 'Rh': 2.0}",47.68741336655764,[],NM,False,225,0,"[0, 0, 0]",8.076135248511614e-05,0.0038513,0,0.0038513,MP,data/source/MP/cleaned/cifs/MP-mp-2302.cif,True,,data/final/MP/graphs/As3Rh5-MP-mp-2302-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Dy2Rh3Sn5,1,0.0,2.0,False,Dy4Rh6Sn10,Dy4Rh6Sn10,0.0,Other,True,Dy20Rh30Sn50,Dy-Rh-Sn,3,Supercon,Dy2Rh3Sn5,MP-mp-1106269,Dy4Sn10Rh6,Dy-Rh-Sn,Dy20Rh30Sn50,C m c 21,orthorhombic,4.398012001908321,7.334535,13.45591607,data/final/MP/cifs/Dy2Rh3Sn5-MP-mp-1106269.cif,data/source/MP/raw/cifs/mp-1106269.cif,mp-1106269,0.0,,2018-07-19 10:00:56,9.518180234797462,,,{'GGA': {'task_id': 'mp-1736468'}},0.0,7.52727516,520.0,-116.7121899,-5.835609495,"{'tags': ['Dysprosium rhodium stannide (2/3/5)', 'Dy2Rh3Sn5', 'Y2Rh3Sn5']}",-116.7121899,-5.835609495,-0.7001738384999996,['bandstructure'],True,[630166],True,2021-05-12 10:58:22.271000,NM,20,5,mp-1106269,,Dy2Sn5Rh3,"{'functional': 'PBE', 'labels': ['Dy_3', 'Sn_d', 'Rh_pv'], 'pot_type': 'paw'}","{'Dy': 2.0, 'Sn': 5.0, 'Rh': 3.0}",GGA,mp-1106269,"['mp-1106269', 'mp-1429643', 'mp-1736468', 'mp-1821107', 'mp-1584510']",5.09e-05,"{'Dy': 4.0, 'Sn': 10.0, 'Rh': 6.0}",428.21714195514255,[],NM,False,36,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.3772985718227962e-07,5.09e-05,0,0.0001018,MP,data/source/MP/cleaned/cifs/MP-mp-1106269.cif,False,,data/final/MP/graphs/Dy2Rh3Sn5-MP-mp-1106269.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
B2C1Pr1Rh2,1,0.0,1.0,True,B2C1Pr1Rh2,B2C1Pr1Rh2,0.0,Heavy_fermion,True,B33.333C16.667Pr16.667Rh33.333,B-C-Pr-Rh,4,Supercon,Pr1Rh2B2C1,MP-mp-568924,Pr1B2Rh2C1,B-C-Pr-Rh,B33.333C16.667Pr16.667Rh33.333,I 4/m m m,tetragonal,3.892569998487404,3.892569998487404,5.83037881,data/final/MP/cifs/B2C1Pr1Rh2-MP-mp-568924.cif,data/source/MP/raw/cifs/mp-568924.cif,mp-568924,0.0,,2014-02-16 05:34:54,8.10993285305586,,,{'GGA': {'task_id': 'mp-1702274'}},0.0,5.73032748,520.0,-45.49172405,-7.581954008333334,{'tags': ['Praseodymium rhodium boride carbide (1/2/2/1)']},-45.49172405,-7.581954008333334,-0.5661074872222223,"['xas', 'bandstructure']",True,[150151],True,2021-05-12 10:57:24.969000,NM,6,8,mp-568924,,PrB2Rh2C,"{'functional': 'PBE', 'labels': ['Pr_3', 'B', 'Rh_pv', 'C'], 'pot_type': 'paw'}","{'Pr': 1.0, 'B': 2.0, 'Rh': 2.0, 'C': 1.0}",GGA,mp-568924,"['mp-1001352', 'mp-1000423', 'mp-568924', 'mp-1433452', 'mp-1702274', 'mp-1801858', 'mp-1007741', 'mp-1589785']",0.0039148,"{'Pr': 1.0, 'B': 2.0, 'Rh': 2.0, 'C': 1.0}",77.87836066621249,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",5.026813567351368e-05,0.0039148,0,0.0039148,MP,data/source/MP/cleaned/cifs/MP-mp-568924.cif,False,,data/final/MP/graphs/B2C1Pr1Rh2-MP-mp-568924.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ba2Cu4Sc0.05Y0.95O8,2,0.0066666666666666,1.0,True,Ba2Cu4Sc0.05Y0.95O8,Ba2Cu4Y1O8,79.0,Cuprate,True,Ba13.333Cu26.667Sc0.333Y6.333O53.333333333333336,Ba-Cu-Sc-Y-O,5,Supercon,Y0.95Sc0.05Ba2Cu4O8,MP-mp-6790,Ba2Y1Cu4O8,Ba-Cu-Y-O,Ba13.333Cu26.667Y6.667O53.333333333333336,C m m m,orthorhombic,3.889922,3.899603999537882,13.88942687,data/final/MP/cifs/Ba2Cu4Sc0.05Y0.95O8-MP-mp-6790-synth_doped.cif,data/source/MP/raw/cifs/mp-6790.cif,mp-6790,0.0,,2011-05-16 03:21:24,5.936250568336678,10.17188/1283441,"@misc{osti_1283441,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Y(CuO2)4 (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1283441"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686864'}},0.0,3.31391536,520.0,-91.58381472,-6.105587648,"{'tags': ['Yttrium barium copper oxide (1/2/4/8)', 'High pressure experimental phase']}",-91.58381472,-6.105587648,-2.0529924817777783,"['xas', 'bandstructure']",True,"[72261, 85273, 74251, 400273, 85277, 85275, 400280, 67632, 85272, 67631, 83920, 66613, 85279, 400277, 75689, 74259, 85278, 85280, 66603, 94265, 400276, 88873, 71417, 75712, 97052, 66605, 72258, 85281, 85274, 400279, 66604, 69698]",True,2021-05-12 10:57:34.594000,NM,15,10,mp-6790,oxide,Ba2Y(CuO2)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-6790,"['mp-1000664', 'mp-6790', 'mp-1007136', 'mp-1237713', 'mp-1440937', 'mp-1686864', 'mp-1834179', 'mp-1011883', 'mp-1590064', 'mp-1590433']",0.0004643,"{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",208.60454115924333,[],NM,False,65,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.225742533790601e-06,0.0004643,0,0.0004643,MP,data/source/MP/cleaned/cifs/MP-mp-6790.cif,True,,data/final/MP/graphs/Ba2Cu4Sc0.05Y0.95O8-MP-mp-6790-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ta0.05V2Zr0.95,2,0.0333333333333333,4.0,False,Ta0.2V8Zr3.8,V8Zr4,8.9,Other,True,Ta1.667V66.667Zr31.667,Ta-V-Zr,3,Supercon,Ta0.05V2Zr0.95,MP-mp-1103264,Zr4V8,V-Zr,V66.667Zr33.333,P 63/m m c,hexagonal,5.208193229598517,5.20819373,8.45714,data/final/MP/cifs/Ta0.05V2Zr0.95-MP-mp-1103264-synth_doped.cif,data/source/MP/raw/cifs/mp-1103264.cif,mp-1103264,0.0,,2018-07-18 17:51:18,6.456226553557358,,,,0.0325666608333339,4.94123829,520.0,-106.47125115,-8.8726042625,{'tags': ['Vanadium zirconium (2/1)']},-106.47125115,-8.8726042625,0.0325666608333321,[],False,[653414],True,2021-05-12 10:59:31.014000,FM,12,3,mp-1103264,,ZrV2,"{'functional': 'PBE', 'labels': ['Zr_sv', 'V_pv'], 'pot_type': 'paw'}","{'Zr': 1.0, 'V': 2.0}",GGA,mp-1103264,"['mp-1103264', 'mp-1834547', 'mp-1986833']",0.158094725,"{'Zr': 4.0, 'V': 8.0}",198.6681941061952,[],FM,True,194,2,"[0.0, 0.0, 0.0, 0.0, -0.0, -0.0, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1]",0.0031830907954092,0.158094725,6,0.6323789,MP,data/source/MP/cleaned/cifs/MP-mp-1103264.cif,True,,data/final/MP/graphs/Ta0.05V2Zr0.95-MP-mp-1103264-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Hg0.714Tl0.286,3,0.072,4.0,False,Hg2.856Tl1.144,Hg3Tl1,3.875,Other,True,Hg71.4Tl28.6,Hg-Tl,2,Supercon,Hg0.714Tl0.286,MP-mp-11474,Tl1Hg3,Hg-Tl,Hg75Tl25,P m -3 m,cubic,4.882347,4.882347,4.882347,data/final/MP/cifs/Hg0.714Tl0.286-MP-mp-11474-synth_doped.cif,data/source/MP/raw/cifs/mp-11474.cif,mp-11474,0.0,,2011-05-28 03:43:13,11.502197118273612,10.17188/1187866,"@misc{osti_1187866,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TlHg3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187866"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699447'}},0.0,3.01175198,520.0,-3.42042044,-0.85510511,{'tags': ['Mercury thallium (3/1)']},-3.42042044,-0.85510511,-0.0366840495833333,"['xas', 'bandstructure']",True,[104362],True,2021-05-12 10:56:51.169000,NM,4,8,mp-11474,,TlHg3,"{'functional': 'PBE', 'labels': ['Tl_d', 'Hg'], 'pot_type': 'paw'}","{'Tl': 1.0, 'Hg': 3.0}",GGA,mp-11474,"['mp-992171', 'mp-991934', 'mp-11474', 'mp-1440524', 'mp-1699447', 'mp-1785402', 'mp-993811', 'mp-1591331']",0.0003805,"{'Tl': 1.0, 'Hg': 3.0}",116.382029846436,[],NM,False,221,0,"[0, 0, 0, 0]",3.269405083431376e-06,0.0003805,0,0.0003805,MP,data/source/MP/cleaned/cifs/MP-mp-11474.cif,True,,data/final/MP/graphs/Hg0.714Tl0.286-MP-mp-11474-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Bi0.343In0.657,2,0.0193333333333333,3.0,False,Bi1.029In1.971,Bi1In2,5.55,Other,True,Bi34.3In65.7,Bi-In,2,Supercon,Bi0.343In0.657,MP-mp-1223979,In2Bi1,Bi-In,Bi33.333In66.667,F m m m,orthorhombic,3.342860125832212,3.34286013,8.479954760000002,data/final/MP/cifs/Bi0.343In0.657-MP-mp-1223979-synth_doped.cif,data/source/MP/raw/cifs/mp-1223979.cif,mp-1223979,0.0,,2019-01-13 00:17:45.608000,8.030227006356316,,,{'GGA': {'task_id': 'mp-1766619'}},0.0472082416666652,6.385481,520.0,-9.25410649,-3.084702163333333,{'tags': []},-9.25410649,-3.084702163333333,0.0464317600000002,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,3,5,mp-1223979,,In2Bi,"{'functional': 'PBE', 'labels': ['In_d', 'Bi'], 'pot_type': 'paw'}","{'In': 2.0, 'Bi': 1.0}",GGA,mp-1223979,"['mp-1223979', 'mp-1427688', 'mp-1766619', 'mp-1797001', 'mp-1616846']",0.0199292,"{'In': 2.0, 'Bi': 1.0}",90.69976065121642,[],NM,False,69,0,"[0, 0, 0]",0.0002197271509528,0.0199292,0,0.0199292,MP,data/source/MP/cleaned/cifs/MP-mp-1223979.cif,True,,data/final/MP/graphs/Bi0.343In0.657-MP-mp-1223979-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,0,0,1,1.0,False
Au0.976Ga2Pd0.024,2,0.016,1.0,True,Au0.976Ga2Pd0.024,Au1Ga2,1.56,Other,True,Au32.533Ga66.667Pd0.8,Au-Ga-Pd,3,Supercon,Au0.976Pd0.024Ga2,MP-mp-2776,Ga2Au1,Au-Ga,Au33.333Ga66.667,F m -3 m,cubic,4.40327555,4.40327555,4.40327555,data/final/MP/cifs/Au0.976Ga2Pd0.024-MP-mp-2776-synth_doped.cif,data/source/MP/raw/cifs/mp-2776.cif,mp-2776,0.0,,2011-05-12 21:57:19,9.253557284351938,10.17188/1201942,"@misc{osti_1201942,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ga2Au (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201942"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687524'}},0.0,3.58527429,520.0,-10.04441228,-3.3481374266666664,"{'tags': ['Gold gallium (1/2)', 'Gallium gold (2/1)']}",-10.04441228,-3.3481374266666664,-0.2381128983333328,"['xas', 'elasticity', 'bandstructure']",True,"[611874, 611864, 150958, 58458]",True,2021-05-12 10:56:18.721000,NM,3,8,mp-2776,,Ga2Au,"{'functional': 'PBE', 'labels': ['Ga_d', 'Au'], 'pot_type': 'paw'}","{'Ga': 2.0, 'Au': 1.0}",GGA,mp-2776,"['mp-991379', 'mp-2776', 'mp-993315', 'mp-1439079', 'mp-1687524', 'mp-1795480', 'mp-994626', 'mp-1589089']",0.000866,"{'Ga': 2.0, 'Au': 1.0}",60.36880695215696,[],NM,False,225,0,"[0, 0, 0]",1.4345156774198237e-05,0.000866,0,0.000866,MP,data/source/MP/cleaned/cifs/MP-mp-2776.cif,True,,data/final/MP/graphs/Au0.976Ga2Pd0.024-MP-mp-2776-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Cu1La1.93Sr0.07O4,2,0.02,1.0,True,Cu1La1.93Sr0.07O4,Cu1La2O4,17.2,Cuprate,True,Cu14.286La27.571Sr1O57.142857142857146,Cu-La-Sr-O,4,Supercon,La1.93Sr0.07Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La1.93Sr0.07O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La1.93Sr0.07O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Cu1La0.15Sr0.85O2,3,0.075,2.0,False,Cu2La0.3Sr1.7O4,Cu2Sr2O4,31.9,Cuprate,True,Cu25La3.75Sr21.25O50,Cu-La-Sr-O,4,Supercon,Sr0.85La0.15Cu1O2,MP-mp-5787,Sr2Cu2O4,Cu-Sr-O,Cu25Sr25O50,C m c m,orthorhombic,3.644437999912225,3.974263,8.32909336,data/final/MP/cifs/Cu1La0.15Sr0.85O2-MP-mp-5787-synth_doped.cif,data/source/MP/raw/cifs/mp-5787.cif,mp-5787,0.0,,2011-05-13 22:43:08,5.167573150857569,10.17188/1276630,"@misc{osti_1276630,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SrCuO2 (SG:63) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1276630"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703560'}},0.0,3.45760864,520.0,-45.24374469,-5.65546808625,"{'tags': ['Strontium cuprate', 'Strontium copper oxide']}",-45.24374469,-5.65546808625,-2.0778125529166664,"['xas', 'elasticity', 'bandstructure']",True,"[77291, 93653, 202992, 16217, 83051, 77293]",True,2021-05-12 10:56:27.046000,NM,8,8,mp-5787,oxide,SrCuO2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Cu': 1.0, 'O': 2.0}",GGA,mp-5787,"['mp-924142', 'mp-909103', 'mp-5787', 'mp-924940', 'mp-1475985', 'mp-1703560', 'mp-1802910', 'mp-1593696']",4e-07,"{'Sr': 2.0, 'Cu': 2.0, 'O': 4.0}",117.71572347282628,[],NM,False,63,0,"[0, 0, 0, 0, 0, 0, 0, 0]",6.796033498317439e-09,4e-07,0,8e-07,MP,data/source/MP/cleaned/cifs/MP-mp-5787.cif,True,,data/final/MP/graphs/Cu1La0.15Sr0.85O2-MP-mp-5787-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
P1Rh1Ta1,1,0.0,4.0,False,P4Rh4Ta4,P4Rh4Ta4,4.635,Other,True,P33.333Rh33.333Ta33.333,P-Rh-Ta,3,Supercon,Ta1Rh1P1,MP-mp-1095548,Ta4P4Rh4,P-Rh-Ta,P33.333Rh33.333Ta33.333,P n m a,orthorhombic,3.781943,6.311532,7.212805,data/final/MP/cifs/P1Rh1Ta1-MP-mp-1095548.cif,data/source/MP/raw/cifs/mp-1095548.cif,mp-1095548,0.0,,2018-04-28 07:20:03,12.145832765136062,,,{'GGA': {'task_id': 'mp-1697724'}},0.0204271650000045,9.07879513,520.0,-107.93821982,-8.994851651666666,"{'tags': ['TaRhP', 'AlB2 family', 'TiNiSi', 'Rhodium tantalum phosphide (1/1/1)']}",-107.93821982,-8.994851651666666,-0.7830556494444446,['bandstructure'],True,[648003],True,2021-05-12 10:58:18.470000,NM,12,5,mp-1095548,,TaPRh,"{'functional': 'PBE', 'labels': ['Ta_pv', 'P', 'Rh_pv'], 'pot_type': 'paw'}","{'Ta': 1.0, 'P': 1.0, 'Rh': 1.0}",GGA,mp-1095548,"['mp-1095548', 'mp-1435352', 'mp-1697724', 'mp-1780736', 'mp-1598707']",1.425e-06,"{'Ta': 4.0, 'P': 4.0, 'Rh': 4.0}",172.168604203952,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.3107081435403545e-08,1.425e-06,0,5.7e-06,MP,data/source/MP/cleaned/cifs/MP-mp-1095548.cif,False,,data/final/MP/graphs/P1Rh1Ta1-MP-mp-1095548.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Hg2Na1,1,0.0,1.0,True,Hg2Na1,Hg2Na1,1.62,Other,True,Hg66.667Na33.333,Hg-Na,2,Supercon,Hg2Na1,MP-mp-11466,Na1Hg2,Hg-Na,Hg66.667Na33.333,P 6/m m m,hexagonal,3.348606,5.203064004751562,5.203064350000001,data/final/MP/cifs/Hg2Na1-MP-mp-11466.cif,data/source/MP/raw/cifs/mp-11466.cif,mp-11466,0.0,,2011-05-27 20:56:03,8.971720872425093,10.17188/1187857,"@misc{osti_1187857,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NaHg2 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187857"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677495'}},0.0,2.01029399,520.0,-2.63769575,-0.8792319166666666,{'tags': ['Mercury sodium (2/1)']},-2.63769575,-0.8792319166666666,-0.2359365755172412,"['xas', 'elasticity', 'bandstructure']",True,[104327],True,2021-05-12 10:56:10.715000,NM,3,8,mp-11466,,NaHg2,"{'functional': 'PBE', 'labels': ['Na_pv', 'Hg'], 'pot_type': 'paw'}","{'Na': 1.0, 'Hg': 2.0}",GGA,mp-11466,"['mp-991492', 'mp-993437', 'mp-11466', 'mp-1437790', 'mp-1677495', 'mp-1798766', 'mp-994739', 'mp-1589442']",0.0239627,"{'Na': 1.0, 'Hg': 2.0}",78.50784512534212,[],NM,False,191,0,"[0, 0, 0]",0.0003052268211124,0.0239627,0,0.0239627,MP,data/source/MP/cleaned/cifs/MP-mp-11466.cif,False,,data/final/MP/graphs/Hg2Na1-MP-mp-11466.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ce1Co1.95,2,0.0112994350282486,2.0,False,Ce2Co3.9,Ce2Co4,0.87,Heavy_fermion,True,Ce33.898Co66.102,Ce-Co,2,Supercon,Ce1Co1.95,MP-mp-1112,Ce2Co4,Ce-Co,Ce33.333Co66.667,F d -3 m,cubic,4.99867784,4.99867784,4.99867784,data/final/MP/cifs/Ce1Co1.95-MP-mp-1112-synth_doped.cif,data/source/MP/raw/cifs/mp-1112.cif,mp-1112,0.0,,2011-05-13 09:02:17,9.701049230746174,10.17188/1187580,"@misc{osti_1187580,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeCo2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187580"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686856'}},0.0,8.26937171,520.0,-41.81273492,-6.968789153333333,{'tags': ['Cerium cobalt (1/2)']},-41.81273492,-6.968789153333333,-0.2522142383333327,"['xas', 'bandstructure']",True,"[102094, 620652, 620671, 657905, 108239, 620681, 620677, 620694, 620679, 620691, 620644, 656107, 620672, 620661, 620654]",True,2021-05-12 10:56:51.169000,NM,6,9,mp-1112,,CeCo2,"{'functional': 'PBE', 'labels': ['Ce', 'Co'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Co': 2.0}",GGA,mp-1112,"['mp-930540', 'mp-929975', 'mp-913634', 'mp-1112', 'mp-1440572', 'mp-1686856', 'mp-1801907', 'mp-1593275', 'mp-1596792']",0.0056005,"{'Ce': 2.0, 'Co': 4.0}",88.31824824311025,[],NM,False,227,0,"[0.0, 0.0, -0.0, -0.0, -0.0, -0.0]",0.0001268254321481,0.0056005,0,0.011201,MP,data/source/MP/cleaned/cifs/MP-mp-1112.cif,True,,data/final/MP/graphs/Ce1Co1.95-MP-mp-1112-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Cu1La1.72Sr0.28O4,3,0.08,1.0,True,Cu1La1.72Sr0.28O4,Cu1La2O4,4.98,Cuprate,True,Cu14.286La24.571Sr4O57.142857142857146,Cu-La-Sr-O,4,Supercon,La1.72Sr0.28Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La1.72Sr0.28O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La1.72Sr0.28O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B1.1C0.9Lu1Ni1,2,0.05,2.0,False,B2.2C1.8Lu2Ni2,B2C2Lu2Ni2,2.4,Other,True,B27.5C22.5Lu25Ni25,B-C-Lu-Ni,4,Supercon,Lu1Ni1B1.1C0.9,MP-mp-6188,Lu2Ni2B2C2,B-C-Lu-Ni,B25C25Lu25Ni25,P 4/n m m,tetragonal,3.499459,3.499459,7.54108,data/final/MP/cifs/B1.1C0.9Lu1Ni1-MP-mp-6188-synth_doped.cif,data/source/MP/raw/cifs/mp-6188.cif,mp-6188,0.0,,2011-05-13 11:39:58,9.22360692471969,10.17188/1277950,"@misc{osti_1277950,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LuNiBC (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277950"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701902'}},0.0,5.56637243,520.0,-56.94584528,-7.11823066,{'tags': []},-56.94584528,-7.11823066,-0.5664157422916656,"['xas', 'bandstructure']",True,"[54041, 75610]",True,2021-05-12 10:57:28.836000,NM,8,8,mp-6188,,LuNiBC,"{'functional': 'PBE', 'labels': ['Lu_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Lu': 1.0, 'Ni': 1.0, 'B': 1.0, 'C': 1.0}",GGA,mp-6188,"['mp-6188', 'mp-1007095', 'mp-1000629', 'mp-1426768', 'mp-1701902', 'mp-1796435', 'mp-1011840', 'mp-1591367']",0.0004347,"{'Lu': 2.0, 'Ni': 2.0, 'B': 2.0, 'C': 2.0}",92.34967413717082,[],NM,False,129,0,"[0, 0, 0, 0, 0, 0, 0, 0]",9.414218383798992e-06,0.0004347,0,0.0008694,MP,data/source/MP/cleaned/cifs/MP-mp-6188.cif,True,,data/final/MP/graphs/B1.1C0.9Lu1Ni1-MP-mp-6188-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
C1Ti0.5W0.5,1,0.0,2.0,False,C2Ti1W1,C2Ti1W1,6.7,Other,True,C50Ti25W25,C-Ti-W,3,Supercon,Ti0.5W0.5C1,MP-mp-1216690,Ti1W1C2,C-Ti-W,C50Ti25W25,R -3 m,trigonal,3.068849100971496,3.068849100971496,5.35699476,data/final/MP/cifs/C1Ti0.5W0.5-MP-mp-1216690.cif,data/source/MP/raw/cifs/mp-1216690.cif,mp-1216690,0.0,,2019-01-12 18:09:19.693000,10.298686888476032,,,{'GGA': {'task_id': 'mp-1768017'}},0.0695049749999991,8.66646518,520.0,-40.89445113,-10.2236127825,{'tags': []},-40.89445113,-10.2236127825,-0.3968178108333333,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,4,5,mp-1216690,,TiWC2,"{'functional': 'PBE', 'labels': ['Ti_pv', 'W_pv', 'C'], 'pot_type': 'paw'}","{'Ti': 1.0, 'W': 1.0, 'C': 2.0}",GGA,mp-1216690,"['mp-1216690', 'mp-1428512', 'mp-1768017', 'mp-1791232', 'mp-1609759']",5.67e-05,"{'Ti': 1.0, 'W': 1.0, 'C': 2.0}",41.23312061407368,[],NM,False,166,0,"[0, 0, 0, 0]",1.3751081449956318e-06,5.67e-05,0,5.67e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1216690.cif,False,,data/final/MP/graphs/C1Ti0.5W0.5-MP-mp-1216690.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ir1Th1,1,0.0,2.0,False,Ir2Th2,Ir2Th2,0.37,Other,True,Ir50Th50,Ir-Th,2,Supercon,Ir1Th1,MP-mp-12774,Th2Ir2,Ir-Th,Ir50Th50,C m c m,orthorhombic,3.9289900019439137,4.209439,6.05957668,data/final/MP/cifs/Ir1Th1-MP-mp-12774.cif,data/source/MP/raw/cifs/mp-12774.cif,mp-12774,0.0,,2011-05-28 01:45:06,14.861830236980015,10.17188/1189181,"@misc{osti_1189181,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ThIr (SG:63) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189181"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696073'}},0.0,7.96132056,520.0,-36.60810337,-9.1520258425,"{'tags': ['Thorium iridium (1/1)', 'Iridium thorium (1/1)']}",-36.60810337,-9.1520258425,-1.0258815075000012,"['xas', 'bandstructure']",True,"[150819, 641097]",True,2021-05-12 10:56:53.126000,NM,4,8,mp-12774,,ThIr,"{'functional': 'PBE', 'labels': ['Th', 'Ir'], 'pot_type': 'paw'}","{'Th': 1.0, 'Ir': 1.0}",GGA,mp-12774,"['mp-919584', 'mp-918594', 'mp-905452', 'mp-12774', 'mp-1412976', 'mp-1696073', 'mp-1797399', 'mp-1589056']",0.0004535,"{'Th': 2.0, 'Ir': 2.0}",94.8055643348383,[],NM,False,63,0,"[0, 0, 0, 0]",9.566949011522352e-06,0.0004535,0,0.000907,MP,data/source/MP/cleaned/cifs/MP-mp-12774.cif,False,,data/final/MP/graphs/Ir1Th1-MP-mp-12774.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
S1Sc1,1,0.0,1.0,True,S1Sc1,S1Sc1,0.0,Other,True,S50Sc50,S-Sc,2,Supercon,S1Sc1,MP-mp-1476,Sc1S1,S-Sc,S50Sc50,F m -3 m,cubic,3.69228109,3.69228109,3.69228109,data/final/MP/cifs/S1Sc1-MP-mp-1476.cif,data/source/MP/raw/cifs/mp-1476.cif,mp-1476,0.0,,2011-05-12 18:02:00,3.593258671299138,10.17188/1190879,"@misc{osti_1190879,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ScS (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1190879"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687620'}},0.0,7.53102588,520.0,-14.20489399,-7.102446995,"{'tags': ['Scandium(II) sulfide', 'Scandium sulfide (1/1)']}",-14.20489399,-7.102446995,-2.1194875090625,"['xas', 'elasticity', 'bandstructure']",True,"[22238, 44971, 650837, 650842]",True,2021-05-12 10:56:12.755000,NM,2,8,mp-1476,,ScS,"{'functional': 'PBE', 'labels': ['Sc_sv', 'S'], 'pot_type': 'paw'}","{'Sc': 1.0, 'S': 1.0}",GGA,mp-1476,"['mp-1000797', 'mp-1007249', 'mp-1476', 'mp-1476238', 'mp-1687620', 'mp-1794228', 'mp-1011986', 'mp-1588496']",0.0010328,"{'Sc': 1.0, 'S': 1.0}",35.593383338283296,[],NM,False,225,0,"[0, 0]",2.9016629022988883e-05,0.0010328,0,0.0010328,MP,data/source/MP/cleaned/cifs/MP-mp-1476.cif,False,,data/final/MP/graphs/S1Sc1-MP-mp-1476.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Nb3Sb0.8Sn0.2,3,0.0999999999999999,2.0,False,Nb6Sb1.6Sn0.4,Nb6Sb2,0.0,Other,True,Nb75Sb20Sn5,Nb-Sb-Sn,3,Supercon,Nb3Sn0.2Sb0.8,MP-mp-2053,Nb6Sb2,Nb-Sb,Nb75Sb25,P m -3 n,cubic,5.311983,5.311983,5.311983,data/final/MP/cifs/Nb3Sb0.8Sn0.2-MP-mp-2053-synth_doped.cif,data/source/MP/raw/cifs/mp-2053.cif,mp-2053,0.0,,2011-05-13 19:35:55,8.87337760679475,10.17188/1195662,"@misc{osti_1195662,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Sb (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195662"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696683'}},0.0,7.01392698,520.0,-71.08518378,-8.8856479725,"{'tags': ['Niobium antimony (3/1)', 'Niobium antimonide (3/1)']}",-71.08518378,-8.8856479725,-0.3254188824999993,"['xas', 'elasticity', 'bandstructure']",True,"[645347, 76572, 645349, 190178, 645357, 645352]",True,2021-05-12 10:56:14.760000,NM,8,8,mp-2053,,Nb3Sb,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Sb'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Sb': 1.0}",GGA,mp-2053,"['mp-910444', 'mp-926252', 'mp-926772', 'mp-2053', 'mp-1413395', 'mp-1696683', 'mp-1877686', 'mp-1592488']",0.00022775,"{'Nb': 6.0, 'Sb': 2.0}",149.88909224806147,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",3.0389135938335167e-06,0.00022775,0,0.0004555,MP,data/source/MP/cleaned/cifs/MP-mp-2053.cif,True,,data/final/MP/graphs/Nb3Sb0.8Sn0.2-MP-mp-2053-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
B0.6Nb5Si2.4,3,0.1388888888888888,2.0,False,B1.2Nb10Si4.8,B2Nb10Si6,7.8,Other,True,B7.5Nb62.5Si30,B-Nb-Si,3,Supercon,Nb5Si2.4B0.6,MP-mp-1106165,Nb10Si6B2,B-Nb-Si,B11.111Nb55.556Si33.333,P 63/m c m,hexagonal,5.310039,7.673267999856193,7.67326885,data/final/MP/cifs/B0.6Nb5Si2.4-MP-mp-1106165-synth_doped.cif,data/source/MP/raw/cifs/mp-1106165.cif,mp-1106165,0.0,,2018-07-19 08:44:17,6.863840658405542,,,{'GGA': {'task_id': 'mp-1708629'}},0.0,7.30893094,520.0,-159.35464851,-8.853036028333333,{'tags': ['Niobium silicide boride (5/3/1)']},-159.35464851,-8.853036028333333,-0.6669405804629633,['bandstructure'],True,[614916],True,2021-05-12 10:58:22.271000,NM,18,5,mp-1106165,,Nb5Si3B,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Si', 'B'], 'pot_type': 'paw'}","{'Nb': 5.0, 'Si': 3.0, 'B': 1.0}",GGA,mp-1106165,"['mp-1106165', 'mp-1415924', 'mp-1708629', 'mp-1938688', 'mp-1604572']",0.00120275,"{'Nb': 10.0, 'Si': 6.0, 'B': 2.0}",270.7628896390436,[],NM,False,193,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",8.884156921233901e-06,0.00120275,0,0.0024055,MP,data/source/MP/cleaned/cifs/MP-mp-1106165.cif,True,,data/final/MP/graphs/B0.6Nb5Si2.4-MP-mp-1106165-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ba1Bi0.17Pb0.83O3,3,0.068,2.0,False,Ba2Bi0.34Pb1.66O6,Ba2Pb2O6,7.6,Oxide,True,Ba20Bi3.4Pb16.6O60,Ba-Bi-Pb-O,4,Supercon,Ba1Pb0.83Bi0.17O3,MP-mp-20461,Ba2Pb2O6,Ba-Pb-O,Ba20Pb20O60,C 1 2/m 1,monoclinic,6.13110795,6.15036645,6.15036645,data/final/MP/cifs/Ba1Bi0.17Pb0.83O3-MP-mp-20461-synth_doped.cif,data/source/MP/raw/cifs/mp-20461.cif,mp-20461,0.2051999999999996,,2014-02-21 12:57:54,7.877180851020856,10.17188/1195591,"@misc{osti_1195591,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BaPbO3 (SG:12) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195591"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688120'}},0.0,2.99844765,520.0,-57.91699323,-5.7916993230000005,"{'tags': ['Barium plumbate', 'Barium lead(IV) oxide']}",-57.91699323,-5.7916993230000005,-2.108799140000001,"['diel', 'xas', 'bandstructure']",True,"[67299, 51656]",True,2021-05-12 10:56:45.290000,NM,10,10,mp-20461,oxide,BaPbO3,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Pb_d', 'O'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Pb': 1.0, 'O': 3.0}",GGA,mp-20461,"['mp-919763', 'mp-918765', 'mp-905786', 'mp-551164', 'mp-20461', 'mp-1141988', 'mp-1439228', 'mp-1688120', 'mp-1833847', 'mp-1588870']",5.695e-05,"{'Ba': 2.0, 'Pb': 2.0, 'O': 6.0}",165.49154870311418,[],NM,False,12,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.882526684449154e-07,5.695e-05,0,0.0001139,MP,data/source/MP/cleaned/cifs/MP-mp-20461.cif,True,,data/final/MP/graphs/Ba1Bi0.17Pb0.83O3-MP-mp-20461-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,0.5,False
Al0.25Ti0.525V0.255,2,0.0194174757281553,3.808455648926237,False,Al0.952Ti2V0.971,Al1Ti2V1,0.0,Other,True,Al24.272Ti50.971V24.757,Al-Ti-V,3,Supercon,Ti0.525V0.255Al0.25,MP-mp-999068,Ti2Al1V1,Al-Ti-V,Al25Ti50V25,F -4 3 m,cubic,4.48093567,4.480935669999999,4.48093567,data/final/MP/cifs/Al0.25Ti0.525V0.255-MP-mp-999068-synth_doped.cif,data/source/MP/raw/cifs/mp-999068.cif,mp-999068,0.0,,2016-05-21 03:20:16,4.532630930595522,10.17188/1317462,"@misc{osti_1317462,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ti2AlV (SG:216) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1317462"",
    place = ""United States"",
    year = ""2016"",
    month = ""5"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1767122'}},0.1358033249999986,6.25783795,520.0,-29.04251091,-7.2606277275,{'tags': ['Titanium vanadium aluminium (2/1/1)']},-29.04251091,-7.2606277275,-0.1055112441666681,"['xas', 'elasticity', 'bandstructure']",True,[185875],True,2021-05-12 10:56:37.246000,FiM,4,14,mp-999068,,Ti2AlV,"{'functional': 'PBE', 'labels': ['Ti_pv', 'Al', 'V_pv'], 'pot_type': 'paw'}","{'Ti': 2.0, 'Al': 1.0, 'V': 1.0}",GGA,mp-999068,"['mp-999101', 'mp-999068', 'mp-999092', 'mp-1066960', 'mp-1067011', 'mp-1066942', 'mp-1252317', 'mp-1421413', 'mp-1655722', 'mp-1767122', 'mp-1790594', 'mp-999115', 'mp-1610958', 'mp-1067023']",1.9162878,"{'Ti': 2.0, 'Al': 1.0, 'V': 1.0}",63.61962868824999,[],FiM,True,216,3,"[-0.4, 0.6, 0.0, 1.4]",0.0301210151569765,1.9162878,3,1.9162878,MP,data/source/MP/cleaned/cifs/MP-mp-999068.cif,True,,data/final/MP/graphs/Al0.25Ti0.525V0.255-MP-mp-999068-synth_doped.json,0,True,-43m,5,0,0,0,0,0,0,0,0,0,1,1.0,False
As1Co0.075Fe0.925Na1,2,0.0499999999999999,2.0,False,As2Co0.15Fe1.85Na2,As2Fe2Na2,10.6,Ferrite,True,As33.333Co2.5Fe30.833Na33.333,As-Co-Fe-Na,4,Supercon,Na1Fe0.925Co0.075As1,MP-mp-22152,Na2Fe2As2,As-Fe-Na,As33.333Fe33.333Na33.333,P 4/n m m,tetragonal,3.923688,3.923688,6.918844,data/final/MP/cifs/As1Co0.075Fe0.925Na1-MP-mp-22152-synth_doped.cif,data/source/MP/raw/cifs/mp-22152.cif,mp-22152,0.0,,2014-02-21 10:51:39,4.793908463406792,10.17188/1197381,"@misc{osti_1197381,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NaFeAs (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197381"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704688'}},0.0,4.10723066,520.0,-30.57538864,-5.095898106666667,{'tags': ['Sodium iron arsenide']},-30.57538864,-5.095898106666667,-0.2786807238505749,"['xas', 'elasticity', 'bandstructure']",True,"[163144, 163143]",True,2021-05-12 10:56:16.728000,FM,6,8,mp-22152,,NaFeAs,"{'functional': 'PBE', 'labels': ['Na_pv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Na': 1.0, 'Fe': 1.0, 'As': 1.0}",GGA,mp-22152,"['mp-906352', 'mp-920130', 'mp-919102', 'mp-22152', 'mp-1413190', 'mp-1704688', 'mp-1797758', 'mp-1594769']",0.0693226,"{'Na': 2.0, 'Fe': 2.0, 'As': 2.0}",106.5178694490858,[],FM,True,129,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.0]",0.0013016144682303,0.0693226,2,0.1386452,MP,data/source/MP/cleaned/cifs/MP-mp-22152.cif,True,,data/final/MP/graphs/As1Co0.075Fe0.925Na1-MP-mp-22152-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B2C1Cu0.2Ni1.8Y1,3,0.0666666666666666,1.0,True,B2C1Cu0.2Ni1.8Y1,B2C1Ni2Y1,11.55,Other,True,B33.333C16.667Cu3.333Ni30Y16.667,B-C-Cu-Ni-Y,5,Supercon,Y1Ni1.8Cu0.2B2C1,MP-mp-6576,Y1Ni2B2C1,B-C-Ni-Y,B33.333C16.667Ni33.333Y16.667,I 4/m m m,tetragonal,3.548790000501972,3.548790000501972,5.76144136,data/final/MP/cifs/B2C1Cu0.2Ni1.8Y1-MP-mp-6576-synth_doped.cif,data/source/MP/raw/cifs/mp-6576.cif,mp-6576,0.0,,2011-05-13 05:21:43,6.099730998852292,10.17188/1281366,"@misc{osti_1281366,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281366"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688230'}},0.0,6.81083016,520.0,-43.677878,-7.279646333333333,{'tags': []},-43.677878,-7.279646333333333,-0.5109282141666659,"['xas', 'bandstructure']",True,"[75816, 89142, 83231, 79574, 41549]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6576,,YNi2B2C,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6576,"['mp-6576', 'mp-1007054', 'mp-1000583', 'mp-1439516', 'mp-1688230', 'mp-1794280', 'mp-1011792', 'mp-1597064']",0.0006603,"{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.3152437079014,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",1.010943177297096e-05,0.0006603,0,0.0006603,MP,data/source/MP/cleaned/cifs/MP-mp-6576.cif,True,,data/final/MP/graphs/B2C1Cu0.2Ni1.8Y1-MP-mp-6576-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Al1Pt1,1,0.0,4.0,False,Al4Pt4,Al4Pt4,0.0,Other,True,Al50Pt50,Al-Pt,2,Supercon,Al1Pt1,MP-mp-10904,Al4Pt4,Al-Pt,Al50Pt50,P 21 3,cubic,4.917449,4.917449,4.917449,data/final/MP/cifs/Al1Pt1-MP-mp-10904.cif,data/source/MP/raw/cifs/mp-10904.cif,mp-10904,0.0,,2011-05-28 06:07:18,12.4042543511047,10.17188/1187447,"@misc{osti_1187447,
    author = ""Persson, Kristin"",
    title = ""Materials Data on AlPt (SG:198) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187447"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699924'}},0.0,8.42863197,520.0,-47.59722495,-5.94965311875,"{'tags': ['Aluminium platinum (1/1)', 'Platinum aluminide (1/1)']}",-47.59722495,-5.94965311875,-1.0414113487499996,"['xas', 'elasticity', 'bandstructure']",True,"[609146, 58129, 609140]",True,2021-05-12 10:56:10.715000,NM,8,12,mp-10904,,AlPt,"{'functional': 'PBE', 'labels': ['Al', 'Pt'], 'pot_type': 'paw'}","{'Al': 1.0, 'Pt': 1.0}",GGA,mp-10904,"['mp-10904', 'mp-911600', 'mp-927471', 'mp-927926', 'mp-1114821', 'mp-1115654', 'mp-1252747', 'mp-1252854', 'mp-1429081', 'mp-1699924', 'mp-1804008', 'mp-1590152']",2.275e-06,"{'Al': 4.0, 'Pt': 4.0}",118.91033245638992,[],NM,False,198,0,"[0, 0, 0, 0, 0, 0, 0, 0]",7.652825294502817e-08,2.275e-06,0,9.1e-06,MP,data/source/MP/cleaned/cifs/MP-mp-10904.cif,False,,data/final/MP/graphs/Al1Pt1-MP-mp-10904.json,0,True,23,1,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba0.9Rb0.1Sb2Ti2O1,2,0.0333333333333333,1.0,True,Ba0.9Rb0.1Sb2Ti2O1,Ba1Sb2Ti2O1,5.33,Oxide,True,Ba15Rb1.667Sb33.333Ti33.333O16.666666666666668,Ba-Rb-Sb-Ti-O,5,Supercon,Ba0.9Rb0.1Ti2Sb2O1,MP-mp-1070806,Ba1Ti2Sb2O1,Ba-Sb-Ti-O,Ba16.667Sb33.333Ti33.333O16.666666666666668,P 4/m m m,tetragonal,4.113474,4.113474,8.312382,data/final/MP/cifs/Ba0.9Rb0.1Sb2Ti2O1-MP-mp-1070806-synth_doped.cif,data/source/MP/raw/cifs/mp-1070806.cif,mp-1070806,0.0,,2018-03-22 04:02:04,5.8154485533321445,,,{'GGA': {'task_id': 'mp-1702174'}},0.0,5.89751533,520.0,-39.14932631,-6.524887718333333,{'tags': []},-39.14932631,-6.524887718333333,-1.5507346602777776,['bandstructure'],True,"[430061, 237789, 430060]",True,2021-05-12 10:58:14.654000,NM,6,16,mp-1070806,oxide,BaTi2Sb2O,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ti_pv', 'Sb', 'O'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Ti': 2.0, 'Sb': 2.0, 'O': 1.0}",GGA,mp-1070806,"['mp-1071055', 'mp-1071068', 'mp-1071083', 'mp-1071088', 'mp-1070806', 'mp-1071124', 'mp-1070846', 'mp-1070900', 'mp-1071137', 'mp-1423542', 'mp-1702174', 'mp-1785425', 'mp-1588663', 'mp-1070899', 'mp-1071129', 'mp-1071119']",0.001055,"{'Ba': 1.0, 'Ti': 2.0, 'Sb': 2.0, 'O': 1.0}",140.65105900950408,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0]",7.500832254158225e-06,0.001055,0,0.001055,MP,data/source/MP/cleaned/cifs/MP-mp-1070806.cif,True,,data/final/MP/graphs/Ba0.9Rb0.1Sb2Ti2O1-MP-mp-1070806-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Au0.281Ga0.719,3,0.1046666666666666,3.0,False,Au0.843Ga2.157,Au1Ga2,1.587,Other,True,Au28.1Ga71.9,Au-Ga,2,Supercon,Au0.281Ga0.719,MP-mp-2776,Ga2Au1,Au-Ga,Au33.333Ga66.667,F m -3 m,cubic,4.40327555,4.40327555,4.40327555,data/final/MP/cifs/Au0.281Ga0.719-MP-mp-2776-synth_doped.cif,data/source/MP/raw/cifs/mp-2776.cif,mp-2776,0.0,,2011-05-12 21:57:19,9.253557284351938,10.17188/1201942,"@misc{osti_1201942,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ga2Au (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201942"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687524'}},0.0,3.58527429,520.0,-10.04441228,-3.3481374266666664,"{'tags': ['Gold gallium (1/2)', 'Gallium gold (2/1)']}",-10.04441228,-3.3481374266666664,-0.2381128983333328,"['xas', 'elasticity', 'bandstructure']",True,"[611874, 611864, 150958, 58458]",True,2021-05-12 10:56:18.721000,NM,3,8,mp-2776,,Ga2Au,"{'functional': 'PBE', 'labels': ['Ga_d', 'Au'], 'pot_type': 'paw'}","{'Ga': 2.0, 'Au': 1.0}",GGA,mp-2776,"['mp-991379', 'mp-2776', 'mp-993315', 'mp-1439079', 'mp-1687524', 'mp-1795480', 'mp-994626', 'mp-1589089']",0.000866,"{'Ga': 2.0, 'Au': 1.0}",60.36880695215696,[],NM,False,225,0,"[0, 0, 0]",1.4345156774198237e-05,0.000866,0,0.000866,MP,data/source/MP/cleaned/cifs/MP-mp-2776.cif,True,,data/final/MP/graphs/Au0.281Ga0.719-MP-mp-2776-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
As2Ba0.5Fe1.84K0.5Mn0.16,3,0.0639999999999999,2.0,False,As4Ba1Fe3.68K1Mn0.32,As4Ba1Fe4K1,0.0,Ferrite,True,As40Ba10Fe36.8K10Mn3.2,As-Ba-Fe-K-Mn,5,Supercon,Ba0.5K0.5Fe1.84Mn0.16As2,MP-mp-1223517,K1Ba1Fe4As4,As-Ba-Fe-K,As40Ba10Fe40K10,C m m m,orthorhombic,5.479027,5.480024002658328,7.13170472,data/final/MP/cifs/As2Ba0.5Fe1.84K0.5Mn0.16-MP-mp-1223517-synth_doped.cif,data/source/MP/raw/cifs/mp-1223517.cif,mp-1223517,0.0,,2019-01-12 23:54:03.876000,5.87534599912672,,,{'GGA': {'task_id': 'mp-1743010'}},0.0132513644999994,4.21185628,520.0,-59.66633886,-5.966633886,{'tags': []},-59.66633886,-5.966633886,-0.4120461663000007,[],False,[],True,2021-05-12 11:00:52.054000,FM,10,4,mp-1223517,,KBa(FeAs)4,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",GGA,mp-1223517,"['mp-1223517', 'mp-1396881', 'mp-1743010', 'mp-1827585']",0.9947188,"{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",197.6961518155852,[],FM,True,65,1,"[0.0, 0.0, 0.3, 0.3, 0.3, 0.3, 0.0, 0.0, 0.0, 0.0]",0.0050315536790412,0.9947188,4,0.9947188,MP,data/source/MP/cleaned/cifs/MP-mp-1223517.cif,True,,data/final/MP/graphs/As2Ba0.5Fe1.84K0.5Mn0.16-MP-mp-1223517-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Te3V2,3,0.1333333333333333,0.5,False,Te1.5V1,Te2V1,0.0,Chevrel,True,Te60V40,Te-V,2,Supercon,Te3V2,MP-mp-1008626,V1Te2,Te-V,Te66.667V33.333,P -3 m 1,trigonal,3.655837996402501,3.65583836,6.95375,data/final/MP/cifs/Te3V2-MP-mp-1008626-synth_doped.cif,data/source/MP/raw/cifs/mp-1008626.cif,mp-1008626,0.0,,2016-09-18 03:49:04,6.31608048509934,10.17188/1325086,"@misc{osti_1325086,
    author = ""Persson, Kristin"",
    title = ""Materials Data on VTe2 (SG:164) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1325086"",
    place = ""United States"",
    year = ""2016"",
    month = ""9"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702782'}},0.0184884588888882,6.01197147,520.0,-16.29441818,-5.431472726666667,{'tags': ['Vanadium(IV) telluride']},-16.29441818,-5.431472726666667,-0.5893034166666679,"['xas', 'bandstructure']",True,[603582],True,2021-05-12 10:56:51.169000,FM,3,12,mp-1008626,,VTe2,"{'functional': 'PBE', 'labels': ['V_pv', 'Te'], 'pot_type': 'paw'}","{'V': 1.0, 'Te': 2.0}",GGA,mp-1008626,"['mp-1008638', 'mp-1008643', 'mp-1008626', 'mp-1061891', 'mp-1061925', 'mp-1061975', 'mp-1412949', 'mp-1702782', 'mp-1799842', 'mp-1008652', 'mp-1587300', 'mp-1061955']",1.0422219,"{'V': 1.0, 'Te': 2.0}",80.48661220464615,[],FM,True,164,1,"[1.1, 0.0, 0.0]",0.0129490094246982,1.0422219,1,1.0422219,MP,data/source/MP/cleaned/cifs/MP-mp-1008626.cif,True,,data/final/MP/graphs/Te3V2-MP-mp-1008626-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Rh1Sn2,1,0.0,4.0,False,Rh4Sn8,Rh4Sn8,0.6,Other,True,Rh33.333Sn66.667,Rh-Sn,2,Supercon,Rh1Sn2,MP-mp-1103044,Sn8Rh4,Rh-Sn,Rh33.333Sn66.667,C m c a,orthorhombic,6.410295,6.416095997262674,6.9980858,data/final/MP/cifs/Rh1Sn2-MP-mp-1103044.cif,data/source/MP/raw/cifs/mp-1103044.cif,mp-1103044,0.0,,2018-07-18 16:48:23,8.836948231713144,,,{'GGA': {'task_id': 'mp-1676074'}},0.0,8.31917388,520.0,-66.50861465,-5.5423845541666665,{'tags': ['Rhodium stannide (1/2)']},-66.50861465,-5.5423845541666665,-0.4145673608333335,['bandstructure'],True,[650384],True,2021-05-12 10:58:20.361000,NM,12,5,mp-1103044,,Sn2Rh,"{'functional': 'PBE', 'labels': ['Sn_d', 'Rh_pv'], 'pot_type': 'paw'}","{'Sn': 2.0, 'Rh': 1.0}",GGA,mp-1103044,"['mp-1103044', 'mp-1381654', 'mp-1676074', 'mp-1776451', 'mp-1599229']",0.000299675,"{'Sn': 8.0, 'Rh': 4.0}",255.80042942069943,[],NM,False,64,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.686075010564469e-06,0.000299675,0,0.0011987,MP,data/source/MP/cleaned/cifs/MP-mp-1103044.cif,False,,data/final/MP/graphs/Rh1Sn2-MP-mp-1103044.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ge0.05Nb3Sn0.95,2,0.025,2.0,False,Ge0.1Nb6Sn1.9,Nb6Sn2,18.1,Other,True,Ge1.25Nb75Sn23.75,Ge-Nb-Sn,3,Supercon,Nb3Sn0.95Ge0.05,MP-mp-1326,Nb6Sn2,Nb-Sn,Nb75Sn25,P m -3 n,cubic,5.334611,5.334611,5.334611,data/final/MP/cifs/Ge0.05Nb3Sn0.95-MP-mp-1326-synth_doped.cif,data/source/MP/raw/cifs/mp-1326.cif,mp-1326,0.0,,2011-05-14 09:51:48,8.694218121896231,10.17188/1189484,"@misc{osti_1189484,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Sn (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189484"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668415'}},0.0,6.59372491,520.0,-69.93787048,-8.74223381,{'tags': ['Niobium tin (3/1)']},-69.93787048,-8.74223381,-0.163862066250001,"['xas', 'elasticity', 'bandstructure']",True,"[105230, 645503, 645489, 105231, 645498, 645485, 645474, 645496, 645480, 645488, 645482, 645487, 645500, 645493, 645477, 645484, 645502, 645483, 150878, 645479, 645481, 645486, 645473]",True,2021-05-12 10:56:12.755000,NM,8,9,mp-1326,,Nb3Sn,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Sn_d'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Sn': 1.0}",GGA,mp-1326,"['mp-930046', 'mp-913770', 'mp-930577', 'mp-1326', 'mp-1440651', 'mp-1668415', 'mp-1880085', 'mp-1594093', 'mp-1594507']",0.62023085,"{'Nb': 6.0, 'Sn': 2.0}",151.81275738025872,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0081709977567491,0.62023085,0,1.2404617,MP,data/source/MP/cleaned/cifs/MP-mp-1326.cif,True,,data/final/MP/graphs/Ge0.05Nb3Sn0.95-MP-mp-1326-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ga0.3In0.7La3,3,0.15,1.0,True,Ga0.3In0.7La3,In1La3,9.25,Other,True,Ga7.5In17.5La75,Ga-In-La,3,Supercon,La3In0.7Ga0.3,MP-mp-20909,La3In1,In-La,In25La75,P m -3 m,cubic,5.076766,5.076766,5.076766,data/final/MP/cifs/Ga0.3In0.7La3-MP-mp-20909-synth_doped.cif,data/source/MP/raw/cifs/mp-20909.cif,mp-20909,0.0,,2014-02-21 06:52:52,6.7455760598452565,10.17188/1196104,"@misc{osti_1196104,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La3In (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196104"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671685'}},0.0,8.16935076,520.0,-18.73796121,-4.6844903025,"{'tags': ['Indium lanthanum (1/3)', 'Lanthanum indium (3/1)']}",-18.73796121,-4.6844903025,-0.2945640412500001,"['xas', 'bandstructure']",True,"[639844, 51950, 639851, 639840, 603208, 107019]",True,2021-05-12 10:56:57.051000,NM,4,8,mp-20909,,La3In,"{'functional': 'PBE', 'labels': ['La', 'In_d'], 'pot_type': 'paw'}","{'La': 3.0, 'In': 1.0}",GGA,mp-20909,"['mp-906743', 'mp-921394', 'mp-920373', 'mp-20909', 'mp-1476042', 'mp-1671685', 'mp-1778647', 'mp-1590323']",0.0489742,"{'La': 3.0, 'In': 1.0}",130.84629766481785,[],NM,False,221,0,"[0, 0, 0, 0]",0.0003742880071811,0.0489742,0,0.0489742,MP,data/source/MP/cleaned/cifs/MP-mp-20909.cif,True,,data/final/MP/graphs/Ga0.3In0.7La3-MP-mp-20909-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
As3Mo2,1,0.0,2.0,False,As6Mo4,As6Mo4,0.0,Other,True,As60Mo40,As-Mo,2,Supercon,As3Mo2,MP-mp-542454,Mo4As6,As-Mo,As60Mo40,C 1 2/m 1,monoclinic,3.265442001288567,6.943408279999999,8.268446322828515,data/final/MP/cifs/As3Mo2-MP-mp-542454.cif,data/source/MP/raw/cifs/mp-542454.cif,mp-542454,0.0,,2014-02-26 08:52:44,7.838075176943638,10.17188/1266536,"@misc{osti_1266536,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Mo2As3 (SG:12) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1266536"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704836'}},0.0,6.92070738,520.0,-74.0525149,-7.40525149,{'tags': ['Molybdenum arsenide (2/3)']},-74.0525149,-7.40525149,-0.2715232350000008,"['xas', 'bandstructure']",True,"[43184, 41015]",True,2021-05-12 10:57:15.388000,NM,10,8,mp-542454,,Mo2As3,"{'functional': 'PBE', 'labels': ['Mo_pv', 'As'], 'pot_type': 'paw'}","{'Mo': 2.0, 'As': 3.0}",GGA,mp-542454,"['mp-929614', 'mp-913006', 'mp-930089', 'mp-542454', 'mp-1435361', 'mp-1704836', 'mp-1831917', 'mp-1602359']",3e-07,"{'Mo': 4.0, 'As': 6.0}",176.53695624938467,[],NM,False,12,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.398721790311207e-09,3e-07,0,6e-07,MP,data/source/MP/cleaned/cifs/MP-mp-542454.cif,False,,data/final/MP/graphs/As3Mo2-MP-mp-542454.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
B2Li0.11Mg0.89,3,0.0733333333333333,1.0,True,B2Li0.11Mg0.89,B2Mg1,35.3,Other,True,B66.667Li3.667Mg29.667,B-Li-Mg,3,Supercon,Mg0.89Li0.11B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B2Li0.11Mg0.89-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B2Li0.11Mg0.89-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
La5Si3,1,0.0,2.0,False,La10Si6,La10Si6,1.6,Other,True,La62.5Si37.5,La-Si,2,Supercon,La5Si3,MP-mp-10961,La10Si6,La-Si,La62.5Si37.5,I 4/m c m,tetragonal,8.008022003716071,8.96411704,8.008022003716071,data/final/MP/cifs/La5Si3-MP-mp-10961.cif,data/source/MP/raw/cifs/mp-10961.cif,mp-10961,0.0,,2011-06-04 18:48:05,5.803788514326534,10.17188/1187483,"@misc{osti_1187483,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La5Si3 (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187483"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1673860'}},0.0,8.30087813,520.0,-91.60083493,-5.725052183125,{'tags': ['Lanthanum silicide (5/3)']},-91.60083493,-5.725052183125,-0.5789299850000003,"['xas', 'bandstructure']",True,"[641980, 657898, 641964, 95073, 641952]",True,2021-05-12 10:56:51.169000,NM,16,14,mp-10961,,La5Si3,"{'functional': 'PBE', 'labels': ['La', 'Si'], 'pot_type': 'paw'}","{'La': 5.0, 'Si': 3.0}",GGA,mp-10961,"['mp-10961', 'mp-917664', 'mp-927601', 'mp-928442', 'mp-1138570', 'mp-1146253', 'mp-1188438', 'mp-1188592', 'mp-1188720', 'mp-1190099', 'mp-1431983', 'mp-1673860', 'mp-1818531', 'mp-1583925']",0.1047587,"{'La': 10.0, 'Si': 6.0}",445.6402931188529,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0004701491387452,0.1047587,0,0.2095174,MP,data/source/MP/cleaned/cifs/MP-mp-10961.cif,False,,data/final/MP/graphs/La5Si3-MP-mp-10961.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B4Co4Tb1,1,0.0,2.0,False,B8Co8Tb2,B8Co8Tb2,0.0,Other,True,B44.444Co44.444Tb11.111,B-Co-Tb,3,Supercon,Tb1Co4B4,MP-mp-1106036,Tb2Co8B8,B-Co-Tb,B44.444Co44.444Tb11.111,P 42/n m c,tetragonal,5.000441,5.000441,6.978172,data/final/MP/cifs/B4Co4Tb1-MP-mp-1106036.cif,data/source/MP/raw/cifs/mp-1106036.cif,mp-1106036,0.0,,2018-07-19 07:31:36,8.334851491610632,,,,0.0,6.3534448,520.0,-128.50962646,-7.139423692222222,{'tags': ['Terbium cobalt boride (1/4/4)']},-128.50962646,-7.139423692222222,-0.4966232074074068,[],False,[613345],True,2021-05-12 10:59:33.162000,NM,18,3,mp-1106036,,Tb(CoB)4,"{'functional': 'PBE', 'labels': ['Tb_3', 'Co', 'B'], 'pot_type': 'paw'}","{'Tb': 1.0, 'Co': 4.0, 'B': 4.0}",GGA,mp-1106036,"['mp-1106036', 'mp-1831337', 'mp-1982830']",0.00775165,"{'Tb': 2.0, 'Co': 8.0, 'B': 8.0}",174.4850750956419,[],NM,False,137,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",8.885172552152127e-05,0.00775165,0,0.0155033,MP,data/source/MP/cleaned/cifs/MP-mp-1106036.cif,False,,data/final/MP/graphs/B4Co4Tb1-MP-mp-1106036.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B1Nb2,3,0.1333333333333334,3.0,False,B3Nb6,B4Nb6,0.0,Other,True,B33.333Nb66.667,B-Nb,2,Supercon,B1Nb2,MP-mp-20689,Nb6B4,B-Nb,B40Nb60,P 4/m b m,tetragonal,3.309354,6.235205,6.235205,data/final/MP/cifs/B1Nb2-MP-mp-20689-synth_doped.cif,data/source/MP/raw/cifs/mp-20689.cif,mp-20689,0.0,,2014-02-21 15:27:12,7.752632878200033,10.17188/1195846,"@misc{osti_1195846,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3B2 (SG:127) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195846"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701947'}},0.0,5.9543375,520.0,-93.64133852,-9.364133852,{'tags': ['Niobium boride (3/2)']},-93.64133852,-9.364133852,-0.6315941196666671,"['xas', 'elasticity', 'bandstructure']",True,"[191898, 614907, 614897, 107319]",True,2021-05-12 10:56:14.760000,NM,10,9,mp-20689,,Nb3B2,"{'functional': 'PBE', 'labels': ['Nb_pv', 'B'], 'pot_type': 'paw'}","{'Nb': 3.0, 'B': 2.0}",GGA,mp-20689,"['mp-906797', 'mp-921440', 'mp-920419', 'mp-20689', 'mp-1078550', 'mp-1433211', 'mp-1701947', 'mp-1788171', 'mp-1593918']",0.0002436,"{'Nb': 6.0, 'B': 4.0}",128.66034136082348,[],NM,False,127,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.786714653847097e-06,0.0002436,0,0.0004872,MP,data/source/MP/cleaned/cifs/MP-mp-20689.cif,True,,data/final/MP/graphs/B1Nb2-MP-mp-20689-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ca0.47Cu3Pb2Sr2Y0.53O8,2,0.00375,2.0,False,Ca0.94Cu6Pb4Sr4Y1.06O16,Ca1Cu6Pb4Sr4Y1O16,76.0,Cuprate,True,Ca2.938Cu18.75Pb12.5Sr12.5Y3.312O50,Ca-Cu-Pb-Sr-Y-O,6,Supercon,Pb2Sr2Y0.53Ca0.47Cu3O8,MP-mp-1218734,Sr4Ca1Y1Cu6Pb4O16,Ca-Cu-Pb-Sr-Y-O,Ca3.125Cu18.75Pb12.5Sr12.5Y3.125O50,P -1,triclinic,5.409182,5.43484807,15.91871111,data/final/MP/cifs/Ca0.47Cu3Pb2Sr2Y0.53O8-MP-mp-1218734-synth_doped.cif,data/source/MP/raw/cifs/mp-1218734.cif,mp-1218734,0.0,,2019-01-12 19:51:15.257000,6.904106081290769,,,,0.0219881772737666,4.29183133,520.0,-186.6260121,-5.832062878125,{'tags': []},-186.6260121,-5.832062878125,-1.9929613410416671,[],False,[],True,2021-05-12 11:00:42.526000,NM,32,3,mp-1218734,oxide,Sr4CaYCu6(PbO4)4,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Y_sv', 'Cu_pv', 'Pb_d', 'O'], 'pot_type': 'paw'}","{'Sr': 4.0, 'Ca': 1.0, 'Y': 1.0, 'Cu': 6.0, 'Pb': 4.0, 'O': 16.0}",GGA,mp-1218734,"['mp-1218734', 'mp-1380819', 'mp-1821682']",0.002747,"{'Sr': 4.0, 'Ca': 1.0, 'Y': 1.0, 'Cu': 6.0, 'Pb': 4.0, 'O': 16.0}",467.9286423671341,[],NM,False,2,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.870553223892458e-06,0.002747,0,0.002747,MP,data/source/MP/cleaned/cifs/MP-mp-1218734.cif,True,,data/final/MP/graphs/Ca0.47Cu3Pb2Sr2Y0.53O8-MP-mp-1218734-synth_doped.json,0,True,-1,0,0,0,0,0,2,0,1,0,0,0,1.0,False
Pd1Sb1Te1,1,0.0,4.0,False,Pd4Sb4Te4,Pd4Sb4Te4,1.2,Other,True,Pd33.333Sb33.333Te33.333,Pd-Sb-Te,3,Supercon,Pd1Sb1Te1,MP-mp-10850,Sb4Te4Pd4,Pd-Sb-Te,Pd33.333Sb33.333Te33.333,P 21 3,cubic,6.641364,6.641364,6.641364,data/final/MP/cifs/Pd1Sb1Te1-MP-mp-10850.cif,data/source/MP/raw/cifs/mp-10850.cif,mp-10850,0.0,,2011-05-29 16:45:01,8.067124666712955,10.17188/1187396,"@misc{osti_1187396,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SbTePd (SG:198) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187396"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1669950'}},0.0,7.19142558,520.0,-54.28452847,-4.5237107058333335,"{'tags': ['Palladium antimonide telluride (1/1/1)', 'Testibiopalladite']}",-54.28452847,-4.5237107058333335,-0.5776493791666665,"['bandstructure', 'elasticity']",True,[93906],True,2021-05-12 10:56:10.715000,NM,12,9,mp-10850,,SbTePd,"{'functional': 'PBE', 'labels': ['Sb', 'Te', 'Pd'], 'pot_type': 'paw'}","{'Sb': 1.0, 'Te': 1.0, 'Pd': 1.0}",GGA,mp-10850,"['mp-927863', 'mp-927423', 'mp-911479', 'mp-10850', 'mp-1115653', 'mp-1422522', 'mp-1669950', 'mp-1807760', 'mp-1603647']",0.001690625,"{'Sb': 4.0, 'Te': 4.0, 'Pd': 4.0}",292.93539570681804,[],NM,False,198,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.308529491181118e-05,0.001690625,0,0.0067625,MP,data/source/MP/cleaned/cifs/MP-mp-10850.cif,False,,data/final/MP/graphs/Pd1Sb1Te1-MP-mp-10850.json,0,True,23,1,0,0,0,0,0,0,1,0,0,0,1.0,False
K0.9Re1O3,3,0.108843537414966,2.0,False,K1.8Re2O6,K2Re2O8,0.0,Oxide,True,K18.367Re20.408O61.224489795918366,K-Re-O,3,Supercon,K0.9O3Re1,MP-mp-4757,K2Re2O8,K-Re-O,K16.667Re16.667O66.66666666666667,I 41/a,tetragonal,5.829231997816049,5.829231997816049,7.68772256,data/final/MP/cifs/K0.9Re1O3-MP-mp-4757-synth_doped.cif,data/source/MP/raw/cifs/mp-4757.cif,mp-4757,4.031700000000001,,2011-05-14 18:01:42,4.357233952059477,10.17188/1208381,"@misc{osti_1208381,
    author = ""Persson, Kristin"",
    title = ""Materials Data on KReO4 (SG:88) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208381"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695752'}},0.0,-1.68844065,520.0,-89.43592284,-7.45299357,"{'tags': ['Potassium rhenium oxide (1/1/4)', 'Potassium rhenate(VII)']}",-89.43592284,-7.45299357,-2.353198544666667,"['xas', 'bandstructure']",True,"[62, 72502, 1921, 72503, 72501, 25832]",True,2021-05-12 10:57:08.928000,NM,12,5,mp-4757,oxide,KReO4,"{'functional': 'PBE', 'labels': ['K_sv', 'Re_pv', 'O'], 'pot_type': 'paw'}","{'K': 1.0, 'Re': 1.0, 'O': 4.0}",GGA,mp-4757,"['mp-4757', 'mp-1425756', 'mp-1695752', 'mp-1827807', 'mp-1601170']",0.0,"{'K': 2.0, 'Re': 2.0, 'O': 8.0}",220.5062995543809,[],NM,False,88,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0,0.0,0,0.0,MP,data/source/MP/cleaned/cifs/MP-mp-4757.cif,True,,data/final/MP/graphs/K0.9Re1O3-MP-mp-4757-synth_doped.json,0,True,4/m,0,0,0,0,3,0,0,0,0,1,0,1.0,False
Ba2Cu1Tl2O6.16,2,0.0130335614206581,1.9480129870129868,False,Ba3.896Cu1.948Tl3.896O12,Ba4Cu2Tl4O12,64.9,Cuprate,True,Ba17.921Cu8.961Tl17.921O55.19713261648746,Ba-Cu-Tl-O,4,Supercon,Tl2Ba2Cu1O6.16,MP-mp-6027,Ba4Tl4Cu2O12,Ba-Cu-Tl-O,Ba18.182Cu9.091Tl18.182O54.54545454545455,C m c a,orthorhombic,5.504110002693673,5.585743,12.28312762,data/final/MP/cifs/Ba2Cu1Tl2O6.16-MP-mp-6027-synth_doped.cif,data/source/MP/raw/cifs/mp-6027.cif,mp-6027,0.0,,2011-05-19 00:05:23,7.606665315628389,10.17188/1277350,"@misc{osti_1277350,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Tl2CuO6 (SG:64) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277350"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1673478'}},0.0059215576010052,4.10961464,520.0,-115.75418737,-5.261553971363636,"{'tags': ['Dithallium dibarium cuprate', 'Dithallium(III) dibarium copper oxide']}",-115.75418737,-5.261553971363636,-1.7862630028787878,"['xas', 'bandstructure']",True,"[202723, 202724, 202722]",True,2021-05-12 10:57:28.836000,NM,22,8,mp-6027,oxide,Ba2Tl2CuO6,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Tl_d', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Tl': 2.0, 'Cu': 1.0, 'O': 6.0}",GGA,mp-6027,"['mp-925246', 'mp-909581', 'mp-924678', 'mp-6027', 'mp-1504634', 'mp-1673478', 'mp-1837163', 'mp-1605186']",2.9e-05,"{'Ba': 4.0, 'Tl': 4.0, 'Cu': 2.0, 'O': 12.0}",368.0385386017736,[],NM,False,64,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.5759219189476614e-07,2.9e-05,0,5.8e-05,MP,data/source/MP/cleaned/cifs/MP-mp-6027.cif,True,,data/final/MP/graphs/Ba2Cu1Tl2O6.16-MP-mp-6027-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Sb2Tl7,1,0.0,3.0,False,Sb6Tl21,Sb6Tl21,5.2,Other,True,Sb22.222Tl77.778,Sb-Tl,2,Supercon,Sb2Tl7,MP-mp-621624,Tl21Sb6,Sb-Tl,Sb22.222Tl77.778,I m -3 m,cubic,10.36311286229734,10.36311286,10.36311286,data/final/MP/cifs/Sb2Tl7-MP-mp-621624.cif,data/source/MP/raw/cifs/mp-621624.cif,mp-621624,0.0,,2014-02-15 20:26:39,9.734859791652626,10.17188/1278053,"@misc{osti_1278053,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Tl7Sb2 (SG:229) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278053"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1738018'}},0.0,5.80199672,520.0,-74.83021433,-2.7714894196296296,{'tags': ['Thallium antimonide (7/2)']},-74.83021433,-2.7714894196296296,-0.0589889188888887,"['xas', 'bandstructure']",True,"[41816, 52288]",True,2021-05-12 10:57:28.836000,NM,27,7,mp-621624,,Tl7Sb2,"{'functional': 'PBE', 'labels': ['Tl_d', 'Sb'], 'pot_type': 'paw'}","{'Tl': 7.0, 'Sb': 2.0}",GGA,mp-621624,"['mp-942304', 'mp-917007', 'mp-942725', 'mp-621624', 'mp-1398384', 'mp-1738018', 'mp-1898002']",0.0289879,"{'Tl': 21.0, 'Sb': 6.0}",856.7395049767439,[],NM,False,229,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0001015054161677,0.0289879,0,0.0869637,MP,data/source/MP/cleaned/cifs/MP-mp-621624.cif,False,,data/final/MP/graphs/Sb2Tl7-MP-mp-621624.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,1,0,1.0,False
Nb0.65Pd0.35,2,0.0333333333333332,3.0,False,Nb1.95Pd1.05,Nb2Pd1,1.84,Other,True,Nb65Pd35,Nb-Pd,2,Supercon,Nb0.65Pd0.35,MP-mp-1220678,Nb2Pd1,Nb-Pd,Nb66.667Pd33.333,F m m m,orthorhombic,2.8240621319204884,2.82406213,6.78333523,data/final/MP/cifs/Nb0.65Pd0.35-MP-mp-1220678-synth_doped.cif,data/source/MP/raw/cifs/mp-1220678.cif,mp-1220678,0.0,,2019-01-12 21:29:16.302000,9.433924184220336,,,{'GGA': {'task_id': 'mp-1764792'}},0.0,5.1760297,520.0,-26.07874005,-8.69291335,{'tags': []},-26.07874005,-8.69291335,-0.2320827199999998,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,3,5,mp-1220678,,Nb2Pd,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Pd'], 'pot_type': 'paw'}","{'Nb': 2.0, 'Pd': 1.0}",GGA,mp-1220678,"['mp-1220678', 'mp-1427348', 'mp-1764792', 'mp-1792829', 'mp-1612674']",0.0072664,"{'Nb': 2.0, 'Pd': 1.0}",51.43818256797303,[],NM,False,69,0,"[0, 0, 0]",0.0001412647111005,0.0072664,0,0.0072664,MP,data/source/MP/cleaned/cifs/MP-mp-1220678.cif,True,,data/final/MP/graphs/Nb0.65Pd0.35-MP-mp-1220678-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,0,0,1,1.0,False
Ga1P1,1,0.0,1.0,True,Ga1P1,Ga1P1,8.25,Other,True,Ga50P50,Ga-P,2,Supercon,Ga1P1,MP-mp-2490,Ga1P1,Ga-P,Ga50P50,F -4 3 m,cubic,3.89354207,3.89354207,3.89354207,data/final/MP/cifs/Ga1P1-MP-mp-2490.cif,data/source/MP/raw/cifs/mp-2490.cif,mp-2490,1.6843000000000004,,2011-05-12 18:22:57,4.006314014532294,10.17188/1200314,"@misc{osti_1200314,
    author = ""Persson, Kristin"",
    title = ""Materials Data on GaP (SG:216) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1200314"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686780'}},0.0,3.38832024,520.0,-9.26107588,-4.63053794,{'tags': ['Gallium phosphide']},-9.26107588,-4.63053794,-0.4098386754166663,"['piezo', 'eos', 'xas', 'bandstructure', 'diel', 'phonons', 'elasticity']",True,"[635041, 41676, 77087, 635034, 57305, 600511, 635032, 67785, 635035, 635030, 635036, 77088, 635040, 103795, 190413, 635033, 53963, 635039]",True,2021-05-12 10:56:16.728000,NM,2,15,mp-2490,,GaP,"{'functional': 'PBE', 'labels': ['Ga_d', 'P'], 'pot_type': 'paw'}","{'Ga': 1.0, 'P': 1.0}",GGA,mp-2490,"['mp-655277', 'mp-655271', 'mp-655273', 'mp-2490', 'mp-1060661', 'mp-1060686', 'mp-1060697', 'mp-1140509', 'mp-1114997', 'mp-1441014', 'mp-1686780', 'mp-1795009', 'mp-1591866', 'mp-1596829', 'mp-1060699']",0.0017444,"{'Ga': 1.0, 'P': 1.0}",41.73684503376176,[],NM,False,216,0,"[0, 0]",4.179520513802421e-05,0.0017444,0,0.0017444,MP,data/source/MP/cleaned/cifs/MP-mp-2490.cif,False,,data/final/MP/graphs/Ga1P1-MP-mp-2490.json,0,True,-43m,5,0,0,0,0,0,0,0,0,0,1,1.0,False
H0.7Nb0.3,3,0.0666666666666666,3.0,False,H2.1Nb0.9,H2Nb1,0.0,Other,True,H70Nb30,H-Nb,2,Supercon,H0.7Nb0.3,MP-mp-24154,Nb1H2,H-Nb,H66.667Nb33.333,F m -3 m,cubic,3.23503615,3.23503615,3.23503615,data/final/MP/cifs/H0.7Nb0.3-MP-mp-24154-synth_doped.cif,data/source/MP/raw/cifs/mp-24154.cif,mp-24154,0.0,,2014-02-25 12:38:12,6.584074711740193,10.17188/1199946,"@misc{osti_1199946,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbH2 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199946"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672000'}},0.0,5.17898952,520.0,-17.54938372,-5.849794573333334,"{'tags': ['Niobium dihydride', 'Niobium hydride (1/2)']}",-17.54938372,-5.849794573333334,-0.3402088633333342,"['xas', 'elasticity', 'bandstructure']",True,"[164606, 56074]",True,2021-05-12 10:56:16.728000,NM,3,8,mp-24154,,NbH2,"{'functional': 'PBE', 'labels': ['Nb_pv', 'H'], 'pot_type': 'paw'}","{'Nb': 1.0, 'H': 2.0}",GGA,mp-24154,"['mp-1002289', 'mp-1008536', 'mp-24154', 'mp-1439072', 'mp-1672000', 'mp-1794964', 'mp-1012743', 'mp-1592532']",0.002957,"{'Nb': 1.0, 'H': 2.0}",23.939904682263613,[],NM,False,225,0,"[0, 0, 0]",0.0001235176179373,0.002957,0,0.002957,MP,data/source/MP/cleaned/cifs/MP-mp-24154.cif,True,,data/final/MP/graphs/H0.7Nb0.3-MP-mp-24154-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ir1Si1,1,0.0,4.0,False,Ir4Si4,Ir4Si4,0.0,Other,True,Ir50Si50,Ir-Si,2,Supercon,Ir1Si1,MP-mp-1128,Si4Ir4,Ir-Si,Ir50Si50,P n m a,orthorhombic,3.220024,5.596382,6.388155,data/final/MP/cifs/Ir1Si1-MP-mp-1128.cif,data/source/MP/raw/cifs/mp-1128.cif,mp-1128,0.0,,2011-05-13 04:25:48,12.711201680855805,10.17188/1187702,"@misc{osti_1187702,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SiIr (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187702"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695194'}},0.0,9.66268783,520.0,-62.64292939,-7.83036617375,"{'tags': ['Iridium(IV) silicide', 'Iridium silicide (1/1)']}",-62.64292939,-7.83036617375,-0.66299395375,"['xas', 'elasticity', 'bandstructure']",True,"[640988, 15693, 57397, 79236]",True,2021-05-12 10:56:10.715000,NM,8,10,mp-1128,,SiIr,"{'functional': 'PBE', 'labels': ['Si', 'Ir'], 'pot_type': 'paw'}","{'Si': 1.0, 'Ir': 1.0}",GGA,mp-1128,"['mp-1128', 'mp-908824', 'mp-923833', 'mp-924431', 'mp-1138679', 'mp-1146473', 'mp-1434151', 'mp-1695194', 'mp-1805398', 'mp-1595336']",0.000363625,"{'Si': 4.0, 'Ir': 4.0}",115.11764722311192,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.2634900339658636e-05,0.000363625,0,0.0014545,MP,data/source/MP/cleaned/cifs/MP-mp-1128.cif,False,,data/final/MP/graphs/Ir1Si1-MP-mp-1128.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Bi1V3,1,0.0,2.0,False,Bi2V6,Bi2V6,0.0,Other,True,Bi25V75,Bi-V,2,Supercon,Bi1V3,MP-mp-1120717,V6Bi2,Bi-V,Bi25V75,P m -3 n,cubic,5.026607,5.026607,5.026607,data/final/MP/cifs/Bi1V3-MP-mp-1120717.cif,data/source/MP/raw/cifs/mp-1120717.cif,mp-1120717,0.1071999999999997,,2018-10-29 18:17:14,9.460819185223912,,,,0.1583159112499998,7.7850863,520.0,-61.01697775,-7.62712221875,{'tags': ['MPComplete']},-61.01697775,-7.62712221875,0.1583159112499998,[],False,[],True,2021-05-12 10:59:35.257000,NM,8,2,mp-1120717,,V3Bi,"{'functional': 'PBE', 'labels': ['V_pv', 'Bi'], 'pot_type': 'paw'}","{'V': 3.0, 'Bi': 1.0}",GGA,mp-1120717,"['mp-1120717', 'mp-1921738']",0.0003878,"{'V': 6.0, 'Bi': 2.0}",127.0061628226937,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",6.1067902750732846e-06,0.0003878,0,0.0007756,MP,data/source/MP/cleaned/cifs/MP-mp-1120717.cif,False,,data/final/MP/graphs/Bi1V3-MP-mp-1120717.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Na0.2W1O3,3,0.0586080586080585,3.0,False,Na0.6W3O9,Na1W3O9,1.7999999999999998,Oxide,True,Na4.762W23.81O71.42857142857143,Na-W-O,3,Supercon,Na0.2W1O3,MP-mp-1221403,Na1W3O9,Na-W-O,Na7.692W23.077O69.23076923076923,P -3 m 1,trigonal,5.507389995326316,5.5073903,6.742919,data/final/MP/cifs/Na0.2W1O3-MP-mp-1221403-synth_doped.cif,data/source/MP/raw/cifs/mp-1221403.cif,mp-1221403,0.0,,2019-01-12 22:06:05.901000,6.736095585172406,,,{'GGA+U': {'task_id': 'mp-1743310'}},0.0076796096029791,2.826287,520.0,-93.73276137,-7.210212413076923,{'tags': []},-93.73276137,-7.210212413076923,-2.192400586273211,[],False,[],True,2021-05-12 11:00:47.244000,FM,13,4,mp-1221403,oxide,Na(WO3)3,"{'functional': 'PBE', 'labels': ['Na_pv', 'W_pv', 'O'], 'pot_type': 'paw'}","{'Na': 1.0, 'W': 3.0, 'O': 9.0}",GGA+U,mp-1221403,"['mp-1221403', 'mp-1390704', 'mp-1743310', 'mp-1828967']",0.9993041,"{'Na': 1.0, 'W': 3.0, 'O': 9.0}",177.12108737567684,[],FM,True,164,2,"[0.0, 0.5, 0.4, 0.4, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0056419261805933,0.9993041,3,0.9993041,MP,data/source/MP/cleaned/cifs/MP-mp-1221403.cif,True,,data/final/MP/graphs/Na0.2W1O3-MP-mp-1221403-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Pb1Zr3,1,0.0,1.0,True,Pb1Zr3,Pb1Zr3,0.76,Other,True,Pb25Zr75,Pb-Zr,2,Supercon,Pb1Zr3,MP-mp-1187844,Zr3Pb1,Pb-Zr,Pb25Zr75,I 4/m m m,tetragonal,4.401062003336818,4.401062003336818,5.749353200000001,data/final/MP/cifs/Pb1Zr3-MP-mp-1187844.cif,data/source/MP/raw/cifs/mp-1187844.cif,mp-1187844,0.0,,2019-01-11 15:23:42.212000,8.527675088724052,,,{'GGA': {'task_id': 'mp-1731108'}},0.0,5.88530311,520.0,-29.91192345,-7.4779808625,{'tags': []},-29.91192345,-7.4779808625,-0.1390436225000009,['bandstructure'],True,[],True,2021-05-12 10:58:31.620000,NM,4,5,mp-1187844,,Zr3Pb,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Pb_d'], 'pot_type': 'paw'}","{'Zr': 3.0, 'Pb': 1.0}",GGA,mp-1187844,"['mp-1187844', 'mp-1420658', 'mp-1731108', 'mp-1797603', 'mp-1617471']",0.0022143,"{'Zr': 3.0, 'Pb': 1.0}",93.63709730098913,[],NM,False,139,0,"[0, 0, 0, 0]",2.364767879211704e-05,0.0022143,0,0.0022143,MP,data/source/MP/cleaned/cifs/MP-mp-1187844.cif,False,,data/final/MP/graphs/Pb1Zr3-MP-mp-1187844.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Se2Ti1,1,0.0,1.0,True,Se2Ti1,Se2Ti1,0.45,Other,True,Se66.667Ti33.333,Se-Ti,2,Supercon,Ti1Se2,MP-mp-2194,Ti1Se2,Se-Ti,Se66.667Ti33.333,P -3 m 1,trigonal,3.5442619989284867,3.544262059999999,6.693806,data/final/MP/cifs/Se2Ti1-MP-mp-2194.cif,data/source/MP/raw/cifs/mp-2194.cif,mp-2194,0.0,,2011-05-12 19:40:09,4.69257943971707,10.17188/1197256,"@misc{osti_1197256,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TiSe2 (SG:164) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197256"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668778'}},0.0,3.11442249,520.0,-18.22234986,-6.074116620000001,"{'tags': ['Titanium selenide (1/2)', 'Titanium selenide']}",-18.22234986,-6.074116620000001,-1.4263449626736115,"['xas', 'elasticity', 'bandstructure']",True,"[652045, 26862, 108739, 56010, 603599, 173923, 652037, 652052, 43617, 652040, 80091, 652047]",True,2021-05-12 10:56:16.728000,NM,3,9,mp-2194,,TiSe2,"{'functional': 'PBE', 'labels': ['Ti_pv', 'Se'], 'pot_type': 'paw'}","{'Ti': 1.0, 'Se': 2.0}",GGA,mp-2194,"['mp-928825', 'mp-928308', 'mp-912253', 'mp-2194', 'mp-1440638', 'mp-1668778', 'mp-1801254', 'mp-1586347', 'mp-1594404']",0.0014271,"{'Ti': 1.0, 'Se': 2.0}",72.8207923357004,[],NM,False,164,0,"[0, 0, 0]",1.959742477699414e-05,0.0014271,0,0.0014271,MP,data/source/MP/cleaned/cifs/MP-mp-2194.cif,False,,data/final/MP/graphs/Se2Ti1-MP-mp-2194.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ge1La1Ni2P1,1,0.0,1.0,True,Ge1La1Ni2P1,Ge1La1Ni2P1,0.0,Ferrite,True,Ge20La20Ni40P20,Ge-La-Ni-P,4,Supercon,La1Ni2Ge1P1,MP-mp-1223012,La1Ni2Ge1P1,Ge-La-Ni-P,Ge20La20Ni40P20,I 4 m m,tetragonal,4.097483998083701,4.097483998083701,5.73006553,data/final/MP/cifs/Ge1La1Ni2P1-MP-mp-1223012.cif,data/source/MP/raw/cifs/mp-1223012.cif,mp-1223012,0.0,,2019-01-12 23:27:55.850000,7.200494106584125,,,{'GGA': {'task_id': 'mp-1756880'}},0.0,8.83112452,520.0,-30.79887787,-6.159775573999999,{'tags': []},-30.79887787,-6.159775573999999,-0.8532534086666665,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,5,5,mp-1223012,,LaNi2GeP,"{'functional': 'PBE', 'labels': ['La', 'Ni_pv', 'Ge_d', 'P'], 'pot_type': 'paw'}","{'La': 1.0, 'Ni': 2.0, 'Ge': 1.0, 'P': 1.0}",GGA,mp-1223012,"['mp-1223012', 'mp-1398197', 'mp-1756880', 'mp-1798871', 'mp-1585707']",0.0072095,"{'La': 1.0, 'Ni': 2.0, 'Ge': 1.0, 'P': 1.0}",82.99958552768068,[],NM,False,107,0,"[0.0, -0.0, -0.0, 0.0, 0.0]",8.686187954029726e-05,0.0072095,0,0.0072095,MP,data/source/MP/cleaned/cifs/MP-mp-1223012.cif,False,,data/final/MP/graphs/Ge1La1Ni2P1-MP-mp-1223012.json,0,True,4mm,0,0,0,0,5,0,0,0,0,1,0,1.0,False
As2Ba1Rh2,1,0.0,1.0,True,As2Ba1Rh2,As2Ba1Rh2,0.0,Other,True,As40Ba20Rh40,As-Ba-Rh,3,Supercon,Ba1Rh2As2,MP-mp-568113,Ba1As2Rh2,As-Ba-Rh,As40Ba20Rh40,I 4/m m m,tetragonal,4.098660001643282,4.098660001643281,7.14507315,data/final/MP/cifs/As2Ba1Rh2-MP-mp-568113.cif,data/source/MP/raw/cifs/mp-568113.cif,mp-568113,0.0,,2014-02-16 11:03:43,7.461447711427047,10.17188/1274251,"@misc{osti_1274251,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba(AsRh)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1274251"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704989'}},0.0,5.28562138,520.0,-30.04544575,-6.009089149999999,"{'tags': ['Barium dirhodium diarsenide', 'Barium dirhodium(II) arsenide']}",-30.04544575,-6.009089149999999,-0.8159244739999998,"['xas', 'elasticity', 'bandstructure']",True,"[165121, 416983]",True,2021-05-12 10:56:22.739000,NM,5,5,mp-568113,,Ba(AsRh)2,"{'functional': 'PBE', 'labels': ['Ba_sv', 'As', 'Rh_pv'], 'pot_type': 'paw'}","{'Ba': 1.0, 'As': 2.0, 'Rh': 2.0}",GGA,mp-568113,"['mp-568113', 'mp-1441804', 'mp-1704989', 'mp-1803355', 'mp-1592587']",0.0168059,"{'Ba': 1.0, 'As': 2.0, 'Rh': 2.0}",109.71256160458744,[],NM,False,139,0,"[0, 0, 0, 0, 0]",0.0001531811832137,0.0168059,0,0.0168059,MP,data/source/MP/cleaned/cifs/MP-mp-568113.cif,False,,data/final/MP/graphs/As2Ba1Rh2-MP-mp-568113.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Fe0.2Ni0.8Zr2,3,0.1333333333333333,2.0,False,Fe0.4Ni1.6Zr4,Ni2Zr4,2.13,Other,True,Fe6.667Ni26.667Zr66.667,Fe-Ni-Zr,3,Supercon,Fe0.2Ni0.8Zr2,MP-mp-328,Zr4Ni2,Ni-Zr,Ni33.333Zr66.667,I 4/m c m,tetragonal,5.262569995425936,5.300086679397286,5.30008668,data/final/MP/cifs/Fe0.2Ni0.8Zr2-MP-mp-328-synth_doped.cif,data/source/MP/raw/cifs/mp-328.cif,mp-328,0.0,,2011-05-13 23:00:52,7.189329355994663,10.17188/1206385,"@misc{osti_1206385,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Zr2Ni (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1206385"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704571'}},0.0,5.05377097,520.0,-47.68946569,-7.948244281666667,{'tags': ['Nickel zirconium (1/2)']},-47.68946569,-7.948244281666667,-0.3230649683333328,"['xas', 'elasticity', 'bandstructure']",True,"[656070, 647167, 102805, 105479]",True,2021-05-12 10:56:20.740000,NM,6,11,mp-328,,Zr2Ni,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Ni_pv'], 'pot_type': 'paw'}","{'Zr': 2.0, 'Ni': 1.0}",GGA,mp-328,"['mp-918996', 'mp-919988', 'mp-906163', 'mp-604722', 'mp-328', 'mp-1076983', 'mp-1205320', 'mp-1413019', 'mp-1704571', 'mp-1802467', 'mp-1592827']",0.00134705,"{'Zr': 4.0, 'Ni': 2.0}",111.39417752247834,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0]",2.4185285621920005e-05,0.00134705,0,0.0026941,MP,data/source/MP/cleaned/cifs/MP-mp-328.cif,True,,data/final/MP/graphs/Fe0.2Ni0.8Zr2-MP-mp-328-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ba2Cu3Pr0.9Sm0.1O7,2,0.0153846153846153,1.0,True,Ba2Cu3Pr0.9Sm0.1O7,Ba2Cu3Pr1O7,0.0,Cuprate,True,Ba15.385Cu23.077Pr6.923Sm0.769O53.84615384615385,Ba-Cu-Pr-Sm-O,5,Supercon,Sm0.1Pr0.9Ba2Cu3O7,MP-mp-20936,Ba2Pr1Cu3O7,Ba-Cu-Pr-O,Ba15.385Cu23.077Pr7.692O53.84615384615385,P m m m,orthorhombic,3.903923,3.95568,11.916432,data/final/MP/cifs/Ba2Cu3Pr0.9Sm0.1O7-MP-mp-20936-synth_doped.cif,data/source/MP/raw/cifs/mp-20936.cif,mp-20936,0.0,,2014-02-22 14:41:55,6.480717836004672,10.17188/1196129,"@misc{osti_1196129,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2PrCu3O7 (SG:47) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196129"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698257'}},0.0256000172756332,3.18514576,520.0,-78.62827906,-6.048329158461538,"{'tags': ['Dibarium praseodymium tricopper heptaoxide', 'Praseodymium dibarium dicopper copper(III) oxide', 'Praseodymium dibarium tricopper heptaoxide', 'Praseodymium dibarium copper(III) dicopper oxide']}",-78.62827906,-6.048329158461538,-2.145007016153845,"['xas', 'bandstructure']",True,"[41452, 94377, 81168, 173910, 89221]",True,2021-05-12 10:56:57.051000,NM,13,8,mp-20936,oxide,Ba2PrCu3O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Pr_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Pr': 1.0, 'Cu': 3.0, 'O': 7.0}",GGA,mp-20936,"['mp-988090', 'mp-987725', 'mp-20936', 'mp-1417367', 'mp-1698257', 'mp-1833655', 'mp-988324', 'mp-1602318']",0.0007234,"{'Ba': 2.0, 'Pr': 1.0, 'Cu': 3.0, 'O': 7.0}",184.02152853403555,[],NM,False,47,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.931061793491212e-06,0.0007234,0,0.0007234,MP,data/source/MP/cleaned/cifs/MP-mp-20936.cif,True,,data/final/MP/graphs/Ba2Cu3Pr0.9Sm0.1O7-MP-mp-20936-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Al0.9Ca1Ga0.1Si1,3,0.0666666666666666,1.0,True,Al0.9Ca1Ga0.1Si1,Al1Ca1Si1,6.54,Other,True,Al30Ca33.333Ga3.333Si33.333,Al-Ca-Ga-Si,4,Supercon,Ca1Al0.9Ga0.1Si1,MP-mp-3173,Ca1Al1Si1,Al-Ca-Si,Al33.333Ca33.333Si33.333,P -6 m 2,hexagonal,4.204102004380959,4.20410189,4.381114,data/final/MP/cifs/Al0.9Ca1Ga0.1Si1-MP-mp-3173-synth_doped.cif,data/source/MP/raw/cifs/mp-3173.cif,mp-3173,0.0,,2011-05-12 18:07:21,2.3559907742364445,10.17188/1205871,"@misc{osti_1205871,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CaAlSi (SG:187) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1205871"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688380'}},0.0042011372222221,5.20030027,520.0,-12.33105355,-4.110351183333333,"{'tags': ['Calcium aluminium silicide (1/1/1) - 1H', 'Calcium aluminium silicide (1/1/1) - (SrPtSb)-type']}",-12.33105355,-4.110351183333333,-0.36118794,"['xas', 'elasticity', 'bandstructure']",True,"[162864, 155853]",True,2021-05-12 10:56:20.740000,NM,3,12,mp-3173,,CaAlSi,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Al', 'Si'], 'pot_type': 'paw'}","{'Ca': 1.0, 'Al': 1.0, 'Si': 1.0}",GGA,mp-3173,"['mp-3173', 'mp-1000446', 'mp-1006914', 'mp-1170858', 'mp-1252945', 'mp-1258722', 'mp-1259938', 'mp-1439603', 'mp-1688380', 'mp-1781727', 'mp-1011629', 'mp-1597142']",0.0033294,"{'Ca': 1.0, 'Al': 1.0, 'Si': 1.0}",67.05970809230726,[],NM,False,187,0,"[0, 0, 0]",4.964829246523266e-05,0.0033294,0,0.0033294,MP,data/source/MP/cleaned/cifs/MP-mp-3173.cif,True,,data/final/MP/graphs/Al0.9Ca1Ga0.1Si1-MP-mp-3173-synth_doped.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Ce0.9La0.1Ru2,3,0.0666666666666666,2.0,False,Ce1.8La0.2Ru4,Ce2Ru4,7.194,Heavy_fermion,True,Ce30La3.333Ru66.667,Ce-La-Ru,3,Supercon,La0.1Ce0.9Ru2,MP-mp-607,Ce2Ru4,Ce-Ru,Ce33.333Ru66.667,F d -3 m,cubic,5.35903077,5.35903077,5.35903077,data/final/MP/cifs/Ce0.9La0.1Ru2-MP-mp-607-synth_doped.cif,data/source/MP/raw/cifs/mp-607.cif,mp-607,0.0,,2011-05-13 22:34:26,10.444470046690055,10.17188/1277529,"@misc{osti_1277529,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeRu2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277529"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686879'}},0.0,8.61419203,520.0,-50.66413619,-8.444022698333333,"{'tags': ['Cerium ruthenium (1/2)', 'Cerium ruthenium hydride (1/2/4)']}",-50.66413619,-8.444022698333333,-0.2833998766666663,"['xas', 'elasticity', 'bandstructure']",True,"[621326, 656077, 621978, 621973, 621980, 621984, 102277, 621972, 621976, 621979, 604113, 621977, 621982, 621983, 102276, 656078]",True,2021-05-12 10:56:27.046000,NM,6,14,mp-607,,CeRu2,"{'functional': 'PBE', 'labels': ['Ce', 'Ru_pv'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Ru': 2.0}",GGA,mp-607,"['mp-928203', 'mp-912221', 'mp-928809', 'mp-607', 'mp-1071462', 'mp-1071593', 'mp-1071613', 'mp-1077792', 'mp-1440763', 'mp-1686879', 'mp-1803198', 'mp-1591928', 'mp-1591642', 'mp-1071635']",1.005e-05,"{'Ce': 2.0, 'Ru': 4.0}",108.82877852828122,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",1.846937939745105e-07,1.005e-05,0,2.01e-05,MP,data/source/MP/cleaned/cifs/MP-mp-607.cif,True,,data/final/MP/graphs/Ce0.9La0.1Ru2-MP-mp-607-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
B4Ru4Tm1,1,0.0,4.0,False,B16Ru16Tm4,B16Ru16Tm4,0.0,Other,True,B44.444Ru44.444Tm11.111,B-Ru-Tm,3,Supercon,Tm1Ru4B4,MP-mp-1197448,Tm4B16Ru16,B-Ru-Tm,B44.444Ru44.444Tm11.111,I 41/a c d,tetragonal,7.470901996822087,7.470901996822087,9.19485621,data/final/MP/cifs/B4Ru4Tm1-MP-mp-1197448.cif,data/source/MP/raw/cifs/mp-1197448.cif,mp-1197448,0.0,,2019-01-12 02:25:24.284000,9.747920041077345,,,{'GGA': {'task_id': 'mp-1730951'}},0.0,6.87660248,520.0,-291.21350852,-8.089264125555555,{'tags': ['Thulium ruthenium boride (1/4/4)']},-291.21350852,-8.089264125555555,-0.5013795559259253,[],False,[615387],True,2021-05-12 11:00:01.375000,NM,36,4,mp-1197448,,Tm(BRu)4,"{'functional': 'PBE', 'labels': ['Tm_3', 'B', 'Ru_pv'], 'pot_type': 'paw'}","{'Tm': 1.0, 'B': 4.0, 'Ru': 4.0}",GGA,mp-1197448,"['mp-1197448', 'mp-1405526', 'mp-1730951', 'mp-1822908']",0.000428475,"{'Tm': 4.0, 'B': 16.0, 'Ru': 16.0}",420.0497896239092,[],NM,False,142,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.080230587746603e-06,0.000428475,0,0.0017139,MP,data/source/MP/cleaned/cifs/MP-mp-1197448.cif,False,,data/final/MP/graphs/B4Ru4Tm1-MP-mp-1197448.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B2C1Ni1.9Pt0.1Y1,2,0.0333333333333333,1.0,True,B2C1Ni1.9Pt0.1Y1,B2C1Ni2Y1,13.7,Other,True,B33.333C16.667Ni31.667Pt1.667Y16.667,B-C-Ni-Pt-Y,5,Supercon,Y1Ni1.9Pt0.1B2C1,MP-mp-6576,Y1Ni2B2C1,B-C-Ni-Y,B33.333C16.667Ni33.333Y16.667,I 4/m m m,tetragonal,3.548790000501972,3.548790000501972,5.76144136,data/final/MP/cifs/B2C1Ni1.9Pt0.1Y1-MP-mp-6576-synth_doped.cif,data/source/MP/raw/cifs/mp-6576.cif,mp-6576,0.0,,2011-05-13 05:21:43,6.099730998852292,10.17188/1281366,"@misc{osti_1281366,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281366"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688230'}},0.0,6.81083016,520.0,-43.677878,-7.279646333333333,{'tags': []},-43.677878,-7.279646333333333,-0.5109282141666659,"['xas', 'bandstructure']",True,"[75816, 89142, 83231, 79574, 41549]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6576,,YNi2B2C,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6576,"['mp-6576', 'mp-1007054', 'mp-1000583', 'mp-1439516', 'mp-1688230', 'mp-1794280', 'mp-1011792', 'mp-1597064']",0.0006603,"{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.3152437079014,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",1.010943177297096e-05,0.0006603,0,0.0006603,MP,data/source/MP/cleaned/cifs/MP-mp-6576.cif,True,,data/final/MP/graphs/B2C1Ni1.9Pt0.1Y1-MP-mp-6576-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B4Ir4Lu0.7Y0.3,3,0.0444444444444444,2.0,False,B8Ir8Lu1.4Y0.6,B8Ir8Lu1Y1,2.98,Other,True,B44.444Ir44.444Lu7.778Y3.333,B-Ir-Lu-Y,4,Supercon,Y0.3Lu0.7Ir4B4,MP-mp-1215947,Y1Lu1B8Ir8,B-Ir-Lu-Y,B44.444Ir44.444Lu5.556Y5.556,P -4 m 2,tetragonal,5.397527,5.397527,7.454301,data/final/MP/cifs/B4Ir4Lu0.7Y0.3-MP-mp-1215947-synth_doped.cif,data/source/MP/raw/cifs/mp-1215947.cif,mp-1215947,0.0,,2019-01-12 17:32:34.719000,14.436994561781765,,,,0.0267232327777815,8.34985726,520.0,-144.25774255,-8.014319030555555,{'tags': []},-144.25774255,-8.014319030555555,-0.5070968549999988,[],False,[],True,2021-05-12 11:00:37.845000,NM,18,3,mp-1215947,,YLu(BIr)8,"{'functional': 'PBE', 'labels': ['Y_sv', 'Lu_3', 'B', 'Ir'], 'pot_type': 'paw'}","{'Y': 1.0, 'Lu': 1.0, 'B': 8.0, 'Ir': 8.0}",GGA,mp-1215947,"['mp-1215947', 'mp-1367845', 'mp-1830201']",5.13e-05,"{'Y': 1.0, 'Lu': 1.0, 'B': 8.0, 'Ir': 8.0}",217.1683702956564,[],NM,False,115,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.3622224511865785e-07,5.13e-05,0,5.13e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1215947.cif,True,,data/final/MP/graphs/B4Ir4Lu0.7Y0.3-MP-mp-1215947-synth_doped.json,0,True,-42m,0,0,0,0,6,0,0,1,0,0,0,1.0,False
Ba2Cu4Gd1O8,1,0.0,1.0,True,Ba2Cu4Gd1O8,Ba2Cu4Gd1O8,72.66666667,Cuprate,True,Ba13.333Cu26.667Gd6.667O53.333333333333336,Ba-Cu-Gd-O,4,Supercon,Gd1Ba2Cu4O8,MP-mp-1214720,Ba2Gd1Cu4O8,Ba-Cu-Gd-O,Ba13.333Cu26.667Gd6.667O53.333333333333336,C m m m,orthorhombic,3.899565,3.914795998374347,13.83769943,data/final/MP/cifs/Ba2Cu4Gd1O8-MP-mp-1214720.cif,data/source/MP/raw/cifs/mp-1214720.cif,mp-1214720,0.0,,2019-01-12 16:30:57.742000,6.464243473418578,,,{'GGA': {'task_id': 'mp-1738624'}},0.0,3.23160584,520.0,-99.06735497,-6.604490331333333,"{'tags': ['Ba2Cu4YO8', 'high-Tc cuprate family', 'Ba2Cu4GdO8']}",-99.06735497,-6.604490331333333,-2.044585089999999,[],False,[],True,2021-05-12 11:00:37.845000,FM,15,4,mp-1214720,oxide,Ba2Gd(CuO2)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Gd', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Gd': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-1214720,"['mp-1214720', 'mp-1376184', 'mp-1738624', 'mp-1882861']",6.9490048,"{'Ba': 2.0, 'Gd': 1.0, 'Cu': 4.0, 'O': 8.0}",209.1222217451288,[],FM,True,65,1,"[0.0, 0.0, 6.9, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0332293944756823,6.9490048,1,6.9490048,MP,data/source/MP/cleaned/cifs/MP-mp-1214720.cif,False,,data/final/MP/graphs/Ba2Cu4Gd1O8-MP-mp-1214720.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
As0.2Ba1Fe2P1.8,3,0.0799999999999999,1.0,True,As0.2Ba1Fe2P1.8,Ba1Fe2P2,0.0,Ferrite,True,As4Ba20Fe40P36,As-Ba-Fe-P,4,Supercon,Ba1Fe2As0.2P1.8,MP-mp-4883,Ba1Fe2P2,Ba-Fe-P,Ba20Fe40P40,I 4/m m m,tetragonal,3.830012000763089,3.8300120007630896,6.74067204,data/final/MP/cifs/As0.2Ba1Fe2P1.8-MP-mp-4883-synth_doped.cif,data/source/MP/raw/cifs/mp-4883.cif,mp-4883,0.0,,2011-05-13 03:10:48,5.70275685867356,10.17188/1208463,"@misc{osti_1208463,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba(FeP)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208463"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701405'}},0.0,5.61193621,520.0,-33.7431906,-6.74863812,"{'tags': ['Barium diiron diphosphide', 'Barium diiron phosphide']}",-33.7431906,-6.74863812,-0.8115195713333335,"['xas', 'elasticity', 'bandstructure']",True,"[169745, 54408, 10468]",True,2021-05-12 10:56:20.740000,NM,5,8,mp-4883,,Ba(FeP)2,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Fe_pv', 'P'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Fe': 2.0, 'P': 2.0}",GGA,mp-4883,"['mp-922604', 'mp-908191', 'mp-923388', 'mp-4883', 'mp-1412902', 'mp-1701405', 'mp-1797053', 'mp-1595119']",5.49e-05,"{'Ba': 1.0, 'Fe': 2.0, 'P': 2.0}",90.54721308051326,[],NM,False,139,0,"[0, 0, 0, 0, 0]",6.063135256430667e-07,5.49e-05,0,5.49e-05,MP,data/source/MP/cleaned/cifs/MP-mp-4883.cif,True,,data/final/MP/graphs/As0.2Ba1Fe2P1.8-MP-mp-4883-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ca0.2Cu2Sr2Tl1Y0.8O7,3,0.0307692307692307,1.0,True,Ca0.2Cu2Sr2Tl1Y0.8O7,Cu2Sr2Tl1Y1O7,0.0,Cuprate,True,Ca1.538Cu15.385Sr15.385Tl7.692Y6.154O53.84615384615385,Ca-Cu-Sr-Tl-Y-O,6,Supercon,Tl1Sr2Ca0.2Y0.8Cu2O7,MP-mp-1218486,Sr2Y1Tl1Cu2O7,Cu-Sr-Tl-Y-O,Cu15.385Sr15.385Tl7.692Y7.692O53.84615384615385,P m m 2,orthorhombic,3.833755,3.847365,12.191786,data/final/MP/cifs/Ca0.2Cu2Sr2Tl1Y0.8O7-MP-mp-1218486-synth_doped.cif,data/source/MP/raw/cifs/mp-1218486.cif,mp-1218486,0.0,,2019-01-12 19:38:46.138000,6.534197370649527,,,{'GGA': {'task_id': 'mp-1720367'}},0.009972801490389,4.15074017,520.0,-79.46882872,-6.112986824615385,{'tags': []},-79.46882872,-6.112986824615385,-2.248891321410256,[],False,[],True,2021-05-12 11:00:42.526000,NM,13,4,mp-1218486,oxide,Sr2YTlCu2O7,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Y_sv', 'Tl_d', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Y': 1.0, 'Tl': 1.0, 'Cu': 2.0, 'O': 7.0}",GGA,mp-1218486,"['mp-1218486', 'mp-1405926', 'mp-1720367', 'mp-1833368']",0.0003878,"{'Sr': 2.0, 'Y': 1.0, 'Tl': 1.0, 'Cu': 2.0, 'O': 7.0}",179.827073320642,[],NM,False,25,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.156516217713949e-06,0.0003878,0,0.0003878,MP,data/source/MP/cleaned/cifs/MP-mp-1218486.cif,True,,data/final/MP/graphs/Ca0.2Cu2Sr2Tl1Y0.8O7-MP-mp-1218486-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,1,0,0,0,1.0,False
La0.92Nd0.08Pt1Si1,3,0.0533333333333333,2.0,False,La1.84Nd0.16Pt2Si2,La2Pt2Si2,2.04,Other,True,La30.667Nd2.667Pt33.333Si33.333,La-Nd-Pt-Si,4,Supercon,La0.92Nd0.08Pt1Si1,MP-mp-1206485,La2Si2Pt2,La-Pt-Si,La33.333Pt33.333Si33.333,I 41 m d,tetragonal,4.277808001286174,4.277808001286175,7.94541446,data/final/MP/cifs/La0.92Nd0.08Pt1Si1-MP-mp-1206485-synth_doped.cif,data/source/MP/raw/cifs/mp-1206485.cif,mp-1206485,0.0,,2019-01-12 09:47:13.211000,8.943745313538361,,,{'GGA': {'task_id': 'mp-1734531'}},0.0,7.90579938,520.0,-39.77896993,-6.629828321666667,{'tags': ['LaPtSi']},-39.77896993,-6.629828321666667,-1.1287520433333331,['bandstructure'],True,[],True,2021-05-12 10:58:37.524000,NM,6,5,mp-1206485,,LaSiPt,"{'functional': 'PBE', 'labels': ['La', 'Si', 'Pt'], 'pot_type': 'paw'}","{'La': 1.0, 'Si': 1.0, 'Pt': 1.0}",GGA,mp-1206485,"['mp-1206485', 'mp-1387492', 'mp-1734531', 'mp-1788111', 'mp-1628393']",1.825e-05,"{'La': 2.0, 'Si': 2.0, 'Pt': 2.0}",134.4491846861766,[],NM,False,109,0,"[0, 0, 0, 0, 0, 0]",2.714780315343388e-07,1.825e-05,0,3.65e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1206485.cif,True,,data/final/MP/graphs/La0.92Nd0.08Pt1Si1-MP-mp-1206485-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,0,0,1,0,1.0,False
As2Ba0.1Fe2K0.9,2,0.0399999999999999,1.0,True,As2Ba0.1Fe2K0.9,As2Fe2K1,6.93,Ferrite,True,As40Ba2Fe40K18,As-Ba-Fe-K,4,Supercon,Ba0.1K0.9Fe2As2,MP-mp-35276,K1Fe2As2,As-Fe-K,As40Fe40K20,I 4/m m m,tetragonal,3.773663997645024,3.773663997645024,7.55368275,data/final/MP/cifs/As2Ba0.1Fe2K0.9-MP-mp-35276-synth_doped.cif,data/source/MP/raw/cifs/mp-35276.cif,mp-35276,0.0,,2013-11-11 09:13:53,4.960691158678031,,,{'GGA': {'task_id': 'mp-1695961'}},0.0,3.49619278,520.0,-28.80228941,-5.760457882,"{'tags': ['Potassium iron arsenide (1/2/2)', 'Potassium iron iron(III) arsenide']}",-28.80228941,-5.760457882,-0.2867273506000004,"['xas', 'elasticity', 'bandstructure']",True,"[189036, 31473]",True,2021-05-12 10:56:27.046000,FM,5,13,mp-35276,,K(FeAs)2,"{'functional': 'PBE', 'labels': ['K_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'K': 1.0, 'Fe': 2.0, 'As': 2.0}",GGA,mp-35276,"['mp-675576', 'mp-936897', 'mp-947308', 'mp-947894', 'mp-1068571', 'mp-1068449', 'mp-1068488', 'mp-35276', 'mp-1441920', 'mp-1695961', 'mp-1796098', 'mp-1593314', 'mp-1068554']",1.3381583,"{'K': 1.0, 'Fe': 2.0, 'As': 2.0}",100.63322517614498,[],FM,True,139,1,"[0.0, 0.8, 0.8, 0.0, 0.0]",0.0132973806380321,1.3381583,2,1.3381583,MP,data/source/MP/cleaned/cifs/MP-mp-35276.cif,True,,data/final/MP/graphs/As2Ba0.1Fe2K0.9-MP-mp-35276-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Nb1Pt1Si1,1,0.0,4.0,False,Nb4Pt4Si4,Nb4Pt4Si4,1.24,Other,True,Nb33.333Pt33.333Si33.333,Nb-Pt-Si,3,Supercon,Nb1Pt1Si1,MP-mp-10469,Nb4Si4Pt4,Nb-Pt-Si,Nb33.333Pt33.333Si33.333,P n m a,orthorhombic,3.857903,6.485923,7.432338,data/final/MP/cifs/Nb1Pt1Si1-MP-mp-10469.cif,data/source/MP/raw/cifs/mp-10469.cif,mp-10469,0.0,,2011-06-01 21:31:00,11.288907132181736,10.17188/1187141,"@misc{osti_1187141,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbSiPt (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187141"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704116'}},0.0,8.26215087,520.0,-95.96887933,-7.997406610833333,{'tags': ['Niobium platinum silicide (1/1/1)']},-95.96887933,-7.997406610833333,-0.774564354166665,"['xas', 'elasticity', 'bandstructure']",True,[90433],True,2021-05-12 10:56:10.715000,NM,12,10,mp-10469,,NbSiPt,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Si', 'Pt'], 'pot_type': 'paw'}","{'Nb': 1.0, 'Si': 1.0, 'Pt': 1.0}",GGA,mp-10469,"['mp-910793', 'mp-10469', 'mp-926492', 'mp-927020', 'mp-1125210', 'mp-1133305', 'mp-1424544', 'mp-1704116', 'mp-1835444', 'mp-1586366']",0.000666325,"{'Nb': 4.0, 'Si': 4.0, 'Pt': 4.0}",185.9724207505418,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.4331694932202656e-05,0.000666325,0,0.0026653,MP,data/source/MP/cleaned/cifs/MP-mp-10469.cif,False,,data/final/MP/graphs/Nb1Pt1Si1-MP-mp-10469.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ba2Ca0.1Cu4Ho0.9O8,2,0.0133333333333333,1.0,True,Ba2Ca0.1Cu4Ho0.9O8,Ba2Cu4Ho1O8,87.0,Cuprate,True,Ba13.333Ca0.667Cu26.667Ho6O53.333333333333336,Ba-Ca-Cu-Ho-O,5,Supercon,Ho0.9Ca0.1Ba2Cu4O8,MP-mp-6205,Ba2Ho1Cu4O8,Ba-Cu-Ho-O,Ba13.333Cu26.667Ho6.667O53.333333333333336,C m m m,orthorhombic,3.87946,3.894348001774656,13.87398175,data/final/MP/cifs/Ba2Ca0.1Cu4Ho0.9O8-MP-mp-6205-synth_doped.cif,data/source/MP/raw/cifs/mp-6205.cif,mp-6205,0.0,,2011-05-16 02:52:11,6.575196061130729,10.17188/1278028,"@misc{osti_1278028,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Ho(CuO2)4 (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278028"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678300'}},0.0,3.29099269,520.0,-89.84060384,-5.989373589333334,"{'tags': ['Holmium dibarium tricopper copper(III) oxide', 'Holmium dibarium tetracopper octaoxide', 'Holmium barium copper oxide (1/2/4/8)']}",-89.84060384,-5.989373589333334,-2.0623825726666665,"['xas', 'bandstructure']",True,"[67638, 75688, 74126, 78624, 67639]",True,2021-05-12 10:57:28.836000,NM,15,7,mp-6205,oxide,Ba2Ho(CuO2)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ho_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Ho': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-6205,"['mp-1001291', 'mp-1007620', 'mp-6205', 'mp-1381302', 'mp-1678300', 'mp-1832236', 'mp-1599331']",0.0019325,"{'Ba': 2.0, 'Ho': 1.0, 'Cu': 4.0, 'O': 8.0}",207.53304019835824,[],NM,False,65,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",9.31177030005889e-06,0.0019325,0,0.0019325,MP,data/source/MP/cleaned/cifs/MP-mp-6205.cif,True,,data/final/MP/graphs/Ba2Ca0.1Cu4Ho0.9O8-MP-mp-6205-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Co0.3Ni0.7V3,3,0.15,2.0,False,Co0.6Ni1.4V6,Ni2V6,0.0,Other,True,Co7.5Ni17.5V75,Co-Ni-V,3,Supercon,Co0.3Ni0.7V3,MP-mp-7226,V6Ni2,Ni-V,Ni25V75,P m -3 n,cubic,4.669659,4.669659,4.669659,data/final/MP/cifs/Co0.3Ni0.7V3-MP-mp-7226-synth_doped.cif,data/source/MP/raw/cifs/mp-7226.cif,mp-7226,0.0,,2011-06-01 02:03:46,6.8987549160690005,10.17188/1287488,"@misc{osti_1287488,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Ni (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1287488"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699417'}},0.0,6.68305039,520.0,-67.31355729,-8.41419466125,{'tags': ['Nickel vanadium (1/3)']},-67.31355729,-8.41419466125,-0.1562309387500011,"['bandstructure', 'elasticity']",True,[647028],True,2021-05-12 10:56:29.056000,NM,8,8,mp-7226,,V3Ni,"{'functional': 'PBE', 'labels': ['V_pv', 'Ni_pv'], 'pot_type': 'paw'}","{'V': 3.0, 'Ni': 1.0}",GGA,mp-7226,"['mp-930575', 'mp-930062', 'mp-913800', 'mp-7226', 'mp-1427876', 'mp-1699417', 'mp-1796237', 'mp-1587127']",0.00106075,"{'V': 6.0, 'Ni': 2.0}",101.82525412435716,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",2.08347135319599e-05,0.00106075,0,0.0021215,MP,data/source/MP/cleaned/cifs/MP-mp-7226.cif,True,,data/final/MP/graphs/Co0.3Ni0.7V3-MP-mp-7226-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Nb3Pb1,1,0.0,2.0,False,Nb6Pb2,Nb6Pb2,0.0,Other,True,Nb75Pb25,Nb-Pb,2,Supercon,Nb3Pb1,MP-mp-22068,Nb6Pb2,Nb-Pb,Nb75Pb25,P m -3 n,cubic,5.387071,5.387071,5.387071,data/final/MP/cifs/Nb3Pb1-MP-mp-22068.cif,data/source/MP/raw/cifs/mp-22068.cif,mp-22068,0.0,,2014-02-22 08:09:11,10.32250259445563,10.17188/1197330,"@misc{osti_1197330,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Pb (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197330"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701287'}},0.1206930325000001,6.50839799,520.0,-67.06758012,-8.383447515,{'tags': ['Niobium lead (3/1)']},-67.06758012,-8.383447515,0.1206930325000001,"['xas', 'bandstructure']",True,"[645180, 105188, 105189]",True,2021-05-12 10:56:59.077000,NM,8,8,mp-22068,,Nb3Pb,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Pb_d'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Pb': 1.0}",GGA,mp-22068,"['mp-929428', 'mp-912672', 'mp-929033', 'mp-22068', 'mp-1426828', 'mp-1701287', 'mp-1779757', 'mp-1592861']",0.5587044,"{'Nb': 6.0, 'Pb': 2.0}",156.33567689526492,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0071474971176834,0.5587044,0,1.1174088,MP,data/source/MP/cleaned/cifs/MP-mp-22068.cif,False,,data/final/MP/graphs/Nb3Pb1-MP-mp-22068.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
La0.95Pr0.05Se1,2,0.05,1.0,True,La0.95Pr0.05Se1,La1Se1,0.7,Other,True,La47.5Pr2.5Se50,La-Pr-Se,3,Supercon,La0.95Pr0.05Se1,MP-mp-1161,La1Se1,La-Se,La50Se50,F m -3 m,cubic,4.31451102,4.314511019999999,4.31451102,data/final/MP/cifs/La0.95Pr0.05Se1-MP-mp-1161-synth_doped.cif,data/source/MP/raw/cifs/mp-1161.cif,mp-1161,0.0,,2011-05-12 18:01:53,6.370268690982408,10.17188/1188105,"@misc{osti_1188105,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaSe (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188105"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668729'}},0.0,7.8532263,520.0,-12.42054673,-6.210273365,"{'tags': ['Lanthanum(II) selenide', 'Lanthanum selenide (1/1)']}",-12.42054673,-6.210273365,-2.2303140736718747,"['xas', 'bandstructure']",True,"[183943, 641921, 29395, 641924, 641930, 641926, 27104]",True,2021-05-12 10:56:51.169000,NM,2,13,mp-1161,,LaSe,"{'functional': 'PBE', 'labels': ['La', 'Se'], 'pot_type': 'paw'}","{'La': 1.0, 'Se': 1.0}",GGA,mp-1161,"['mp-1000461', 'mp-1006939', 'mp-1161', 'mp-1056965', 'mp-1056977', 'mp-1056998', 'mp-1442026', 'mp-1668729', 'mp-1792555', 'mp-1011660', 'mp-1591521', 'mp-1595264', 'mp-1057003']",0.0004867,"{'La': 1.0, 'Se': 1.0}",56.79103060602274,[],NM,False,225,0,"[0, 0]",8.570015278933591e-06,0.0004867,0,0.0004867,MP,data/source/MP/cleaned/cifs/MP-mp-1161.cif,True,,data/final/MP/graphs/La0.95Pr0.05Se1-MP-mp-1161-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
As1Nb1Si1,1,0.0,2.0,False,As2Nb2Si2,As2Nb2Si2,8.2,Other,True,As33.333Nb33.333Si33.333,As-Nb-Si,3,Supercon,Nb1Si1As1,MP-mp-21907,Nb2Si2As2,As-Nb-Si,As33.333Nb33.333Si33.333,P 4/n m m,tetragonal,3.516515,3.516515,7.970486,data/final/MP/cifs/As1Nb1Si1-MP-mp-21907.cif,data/source/MP/raw/cifs/mp-21907.cif,mp-21907,0.0,,2014-02-21 07:44:20,6.6013636939969045,10.17188/1197245,"@misc{osti_1197245,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbSiAs (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197245"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704380'}},0.0,7.55044183,520.0,-43.92705031,-7.321175051666667,{'tags': ['Niobium silicide arsenide (1/1/1)']},-43.92705031,-7.321175051666667,-0.5689292299999996,"['xas', 'elasticity', 'bandstructure']",True,"[16320, 187693]",True,2021-05-12 10:56:16.728000,NM,6,12,mp-21907,,NbSiAs,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Si', 'As'], 'pot_type': 'paw'}","{'Nb': 1.0, 'Si': 1.0, 'As': 1.0}",GGA,mp-21907,"['mp-909147', 'mp-924180', 'mp-924974', 'mp-21907', 'mp-1077500', 'mp-1124885', 'mp-1136253', 'mp-1266438', 'mp-1423162', 'mp-1704380', 'mp-1797746', 'mp-1594136']",1.65e-06,"{'Nb': 2.0, 'Si': 2.0, 'As': 2.0}",98.56205544602744,[],NM,False,129,0,"[0, 0, 0, 0, 0, 0]",3.3481444609351515e-08,1.65e-06,0,3.3e-06,MP,data/source/MP/cleaned/cifs/MP-mp-21907.cif,False,,data/final/MP/graphs/As1Nb1Si1-MP-mp-21907.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
C1Mo0.9Re0.1,3,0.0999999999999999,1.0,True,C1Mo0.9Re0.1,C1Mo1,13.85,Other,True,C50Mo45Re5,C-Mo-Re,3,Supercon,C1Mo0.9Re0.1,MP-mp-2305,Mo1C1,C-Mo,C50Mo50,P -6 m 2,hexagonal,2.835086,2.92410600478411,2.92410507,data/final/MP/cifs/C1Mo0.9Re0.1-MP-mp-2305-synth_doped.cif,data/source/MP/raw/cifs/mp-2305.cif,mp-2305,0.0,,2011-05-12 17:49:42,8.538697979393088,10.17188/1199194,"@misc{osti_1199194,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MoC (SG:187) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199194"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668222'}},0.0010243049999996,8.62658168,520.0,-20.24014809,-10.120074045,{'tags': ['Molybdenum carbide (1/1)']},-20.24014809,-10.120074045,-0.0838621800000005,"['xas', 'elasticity', 'bandstructure']",True,"[77156, 618300]",True,2021-05-12 10:56:16.728000,NM,2,9,mp-2305,,MoC,"{'functional': 'PBE', 'labels': ['Mo_pv', 'C'], 'pot_type': 'paw'}","{'Mo': 1.0, 'C': 1.0}",GGA,mp-2305,"['mp-927633', 'mp-927239', 'mp-911174', 'mp-2305', 'mp-1116092', 'mp-1440368', 'mp-1668222', 'mp-1791400', 'mp-1638434']",0.0001977,"{'Mo': 1.0, 'C': 1.0}",20.99340614335182,[],NM,False,187,0,"[0, 0]",9.417242664197564e-06,0.0001977,0,0.0001977,MP,data/source/MP/cleaned/cifs/MP-mp-2305.cif,True,,data/final/MP/graphs/C1Mo0.9Re0.1-MP-mp-2305-synth_doped.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Co1Ge0.9Si0.1U1,3,0.0666666666666666,4.0,False,Co4Ge3.6Si0.4U4,Co4Ge4U4,0.153,Heavy_fermion,True,Co33.333Ge30Si3.333U33.333,Co-Ge-Si-U,4,Supercon,U1Co1Ge0.9Si0.1,MP-mp-20671,U4Co4Ge4,Co-Ge-U,Co33.333Ge33.333U33.333,P n m a,orthorhombic,4.28722,6.693007,7.099451,data/final/MP/cifs/Co1Ge0.9Si0.1U1-MP-mp-20671-synth_doped.cif,data/source/MP/raw/cifs/mp-20671.cif,mp-20671,0.0,,2014-02-22 17:09:25,12.050961791187769,10.17188/1195831,"@misc{osti_1195831,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UCoGe (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195831"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696056'}},0.0092126219444441,8.81618313,520.0,-96.12146646,-8.010122205,"{'tags': ['Uranium nickel germanium (1/1/1)', 'Uranium cobalt germanium (1/1/1)', 'Uranium cobalt germanide (1/1/1)', 'Uranium cobalt germanium hydride (1/1/1/0.1)']}",-96.12146646,-8.010122205,-0.3358703183333335,"['xas', 'bandstructure']",True,"[55538, 184392, 184389, 184388]",True,2021-05-12 10:56:57.051000,NM,12,11,mp-20671,,UCoGe,"{'functional': 'PBE', 'labels': ['U', 'Co', 'Ge_d'], 'pot_type': 'paw'}","{'U': 1.0, 'Co': 1.0, 'Ge': 1.0}",GGA,mp-20671,"['mp-921572', 'mp-906970', 'mp-920534', 'mp-20671', 'mp-1102081', 'mp-1102694', 'mp-1103716', 'mp-1433082', 'mp-1696056', 'mp-1832133', 'mp-1602688']",0.006528975,"{'U': 4.0, 'Co': 4.0, 'Ge': 4.0}",203.71444041881864,[],NM,False,62,0,"[0.0, 0.0, 0.0, 0.0, -0.0, -0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0]",0.0001281985702452,0.006528975,0,0.0261159,MP,data/source/MP/cleaned/cifs/MP-mp-20671.cif,True,,data/final/MP/graphs/Co1Ge0.9Si0.1U1-MP-mp-20671-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ba2Cu3Eu0.2Y0.8O7,3,0.0307692307692307,1.0,True,Ba2Cu3Eu0.2Y0.8O7,Ba2Cu3Y1O7,0.0,Cuprate,True,Ba15.385Cu23.077Eu1.538Y6.154O53.84615384615385,Ba-Cu-Eu-Y-O,5,Supercon,Y0.8Eu0.2Ba2Cu3O7,MP-mp-20674,Ba2Y1Cu3O7,Ba-Cu-Y-O,Ba15.385Cu23.077Y7.692O53.84615384615385,P m m m,orthorhombic,3.844668,3.926152,11.823664,data/final/MP/cifs/Ba2Cu3Eu0.2Y0.8O7-MP-mp-20674-synth_doped.cif,data/source/MP/raw/cifs/mp-20674.cif,mp-20674,0.0,,2014-02-22 18:23:22,6.198285186087997,10.17188/1195834,"@misc{osti_1195834,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2YCu3O7 (SG:47) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195834"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686609'}},0.0313759126602519,3.28295453,520.0,-80.7708035,-6.213138730769231,"{'tags': ['Yttrium barium copper oxide (1/2/3/7)', 'Dibarium yttrium dicopper copper(III) oxide', 'Yttrium barium copper oxide (1/2/3/6.93)', 'Dibarium yttrium copper(III) dicopper oxide', 'High pressure experimental phase', 'Yttrium dibarium dicopper copper(III) oxide']}",-80.7708035,-6.213138730769231,-2.180157206282052,"['xas', 'elasticity', 'bandstructure']",True,"[196266, 196264, 196265, 71423, 66620, 63483, 66621, 164530, 56507, 63487, 66602, 66601, 68394, 63486, 63485, 202774, 62466, 62465, 41646, 65224, 202773, 66600, 63335, 66611, 78598, 66617, 81175, 66610, 66619, 66615, 63484, 86958, 262809, 66609, 184677, 202775, 66616, 63488, 66618, 66623, 202771, 66622, 202772, 77737, 202770, 62928, 77745]",True,2021-05-12 10:56:14.760000,NM,13,14,mp-20674,oxide,Ba2YCu3O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Cu': 3.0, 'O': 7.0}",GGA,mp-20674,"['mp-923155', 'mp-917354', 'mp-922372', 'mp-20674', 'mp-1103385', 'mp-1103741', 'mp-1103748', 'mp-1104329', 'mp-1104589', 'mp-1440689', 'mp-1686609', 'mp-1832558', 'mp-1596594', 'mp-1592890']",0.0001806,"{'Ba': 2.0, 'Y': 1.0, 'Cu': 3.0, 'O': 7.0}",178.47526348558395,[],NM,False,47,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.0119049355799813e-06,0.0001806,0,0.0001806,MP,data/source/MP/cleaned/cifs/MP-mp-20674.cif,True,,data/final/MP/graphs/Ba2Cu3Eu0.2Y0.8O7-MP-mp-20674-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Li1.2Ti1.8O4,3,0.0571428571428571,2.0,False,Li2.4Ti3.6O8,Li2Ti4O8,0.0,Oxide,True,Li17.143Ti25.714O57.142857142857146,Li-Ti-O,3,Supercon,Li1.2Ti1.8O4,MP-mp-5670,Li2Ti4O8,Li-Ti-O,Li14.286Ti28.571O57.142857142857146,F d -3 m,cubic,5.986032260000001,5.98603226,5.98603226,data/final/MP/cifs/Li1.2Ti1.8O4-MP-mp-5670-synth_doped.cif,data/source/MP/raw/cifs/mp-5670.cif,mp-5670,0.0,,2011-05-14 11:10:22,3.649565337909552,10.17188/1273637,"@misc{osti_1273637,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LiTi2O4 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1273637"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699404'}},0.0,5.03116805,520.0,-114.93444733,-8.209603380714286,"{'tags': ['Lithium titanium oxide (1/2/4)', 'Lithium titanium(III) titanium(IV) oxide', 'Lithium titanium(III) titanium oxide', 'Lithium titanium titanium(III) oxide', 'Lithium titano(III)titanate', 'Spinel-(Li,Ti)']}",-114.93444733,-8.209603380714286,-3.2462103921428564,"['bandstructure', 'elasticity']",True,"[72859, 78482, 154982, 81329, 15789, 48127]",True,2021-05-12 10:56:22.739000,NM,14,7,mp-5670,oxide,LiTi2O4,"{'functional': 'PBE', 'labels': ['Li_sv', 'Ti_pv', 'O'], 'pot_type': 'paw'}","{'Li': 1.0, 'Ti': 2.0, 'O': 4.0}",GGA,mp-5670,"['mp-923613', 'mp-922835', 'mp-908534', 'mp-5670', 'mp-1418091', 'mp-1699404', 'mp-1787951']",0.0521081,"{'Li': 2.0, 'Ti': 4.0, 'O': 8.0}",151.67086379131675,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0006871207652868,0.0521081,0,0.1042162,MP,data/source/MP/cleaned/cifs/MP-mp-5670.cif,True,,data/final/MP/graphs/Li1.2Ti1.8O4-MP-mp-5670-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
B2C1Ni2Tb0.4Y0.6,2,0.0333333333333333,2.0,False,B4C2Ni4Tb0.8Y1.2,B4C2Ni4Tb1Y1,2.346666667,Other,True,B33.333C16.667Ni33.333Tb6.667Y10,B-C-Ni-Tb-Y,5,Supercon,Y0.6Tb0.4Ni2B2C1,MP-mp-1217431,Tb1Y1Ni4B4C2,B-C-Ni-Tb-Y,B33.333C16.667Ni33.333Tb8.333Y8.333,P 4/m m m,tetragonal,3.539436,3.539436,10.45541,data/final/MP/cifs/B2C1Ni2Tb0.4Y0.6-MP-mp-1217431-synth_doped.cif,data/source/MP/raw/cifs/mp-1217431.cif,mp-1217431,0.0,,2019-01-12 18:46:06.865000,6.97108030500507,,,,0.0041270833333326,6.7890327,520.0,-85.48190522,-7.123492101666667,{'tags': []},-85.48190522,-7.123492101666667,-0.5074494002777771,[],False,[],True,2021-05-12 11:00:40.103000,NM,12,2,mp-1217431,,TbYNi4(B2C)2,"{'functional': 'PBE', 'labels': ['Tb_3', 'Y_sv', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Tb': 1.0, 'Y': 1.0, 'Ni': 4.0, 'B': 4.0, 'C': 2.0}",GGA,mp-1217431,"['mp-1217431', 'mp-1878575']",0.0057348,"{'Tb': 1.0, 'Y': 1.0, 'Ni': 4.0, 'B': 4.0, 'C': 2.0}",130.98126957504488,[],NM,False,123,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",4.37833593963928e-05,0.0057348,0,0.0057348,MP,data/source/MP/cleaned/cifs/MP-mp-1217431.cif,True,,data/final/MP/graphs/B2C1Ni2Tb0.4Y0.6-MP-mp-1217431-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Bi2Ca0.2Cu2Sr2Y0.8O8,3,0.0266666666666666,2.0,False,Bi4Ca0.4Cu4Sr4Y1.6O16,Bi4Cu4Sr4Y2O16,0.0,Cuprate,True,Bi13.333Ca1.333Cu13.333Sr13.333Y5.333O53.333333333333336,Bi-Ca-Cu-Sr-Y-O,6,Supercon,Bi2Sr2Ca0.2Y0.8Cu2O8,MP-mp-1208863,Sr4Y2Cu4Bi4O16,Bi-Cu-Sr-Y-O,Bi13.333Cu13.333Sr13.333Y6.667O53.333333333333336,C c c m,orthorhombic,5.350205,5.505885998177413,15.59802851,data/final/MP/cifs/Bi2Ca0.2Cu2Sr2Y0.8O8-MP-mp-1208863-synth_doped.cif,data/source/MP/raw/cifs/mp-1208863.cif,mp-1208863,0.0,,2019-01-12 11:41:58.514000,6.881971262733002,,,{'GGA': {'task_id': 'mp-1680775'}},0.0913935707916726,5.2812548,520.0,-185.05210166,-6.1684033886666665,"{'tags': ['high-Tc cuprate family', 'Sr2(Sr0.4Y0.6)Cu2Bi2O8.7', 'Sr2.4Cu2Y0.6Bi2O8.7']}",-185.05210166,-6.1684033886666665,-2.174294854,[],False,[],True,2021-05-12 11:00:21.818000,FM,30,4,mp-1208863,oxide,Sr2YCu2(BiO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Y_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Y': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",GGA,mp-1208863,"['mp-1208863', 'mp-1359079', 'mp-1680775', 'mp-1819085']",0.1409948,"{'Sr': 4.0, 'Y': 2.0, 'Cu': 4.0, 'Bi': 4.0, 'O': 16.0}",452.2677998757687,[],FM,True,66,1,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.1, 0.1, 0.1, 0.1, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0006235013858547,0.1409948,4,0.2819896,MP,data/source/MP/cleaned/cifs/MP-mp-1208863.cif,True,,data/final/MP/graphs/Bi2Ca0.2Cu2Sr2Y0.8O8-MP-mp-1208863-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Fe1Nb4Si1,1,0.0,2.0,False,Fe2Nb8Si2,Fe2Nb8Si2,6.8,Other,True,Fe16.667Nb66.667Si16.667,Fe-Nb-Si,3,Supercon,Nb4Fe1Si1,MP-mp-22312,Nb8Fe2Si2,Fe-Nb-Si,Fe16.667Nb66.667Si16.667,P 4/m c c,tetragonal,5.096232,6.194827,6.194827,data/final/MP/cifs/Fe1Nb4Si1-MP-mp-22312.cif,data/source/MP/raw/cifs/mp-22312.cif,mp-22312,0.0,,2014-02-22 14:38:36,7.7359441835625695,10.17188/1197546,"@misc{osti_1197546,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb4FeSi (SG:124) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197546"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703660'}},0.0479189629700869,5.79290469,520.0,-112.08140028,-9.34011669,{'tags': ['Iron niobium silicon (1/4/1)']},-112.08140028,-9.34011669,-0.278192918333333,"['xas', 'elasticity', 'bandstructure']",True,"[53511, 632825]",True,2021-05-12 10:56:16.728000,NM,12,7,mp-22312,,Nb4FeSi,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Fe_pv', 'Si'], 'pot_type': 'paw'}","{'Nb': 4.0, 'Fe': 1.0, 'Si': 1.0}",GGA,mp-22312,"['mp-22312', 'mp-990704', 'mp-1143973', 'mp-1475477', 'mp-1703660', 'mp-1832044', 'mp-1597878']",0.0002809,"{'Nb': 8.0, 'Fe': 2.0, 'Si': 2.0}",195.57239563392008,[],NM,False,124,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.872593538464389e-06,0.0002809,0,0.0005618,MP,data/source/MP/cleaned/cifs/MP-mp-22312.cif,False,,data/final/MP/graphs/Fe1Nb4Si1-MP-mp-22312.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Hg2Os2O7,1,0.0,2.0,False,Hg4Os4O14,Hg4Os4O14,0.0,Oxide,True,Hg18.182Os18.182O63.63636363636364,Hg-Os-O,3,Supercon,Hg2Os2O7,MP-mp-22089,Hg4Os4O14,Hg-Os-O,Hg18.182Os18.182O63.63636363636364,F d -3 m,cubic,7.35438853,7.354388529999999,7.354388529999999,data/final/MP/cifs/Hg2Os2O7-MP-mp-22089.cif,data/source/MP/raw/cifs/mp-22089.cif,mp-22089,0.0,,2014-02-17 00:31:44,10.551517914911758,10.17188/1197343,"@misc{osti_1197343,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Hg2Os2O7 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197343"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698226'}},0.0343868338636337,3.42163271,520.0,-131.97725902,-5.998966319090909,{'tags': ['Dimercury diosmate(V)']},-131.97725902,-5.998966319090909,-1.1908917486363633,"['xas', 'bandstructure']",True,"[159798, 159799, 159803, 159796, 159800, 159804, 159801, 159805, 159809, 159808, 159794, 159802, 159797, 159806, 159795, 159807]",True,2021-05-12 10:56:59.077000,NM,22,9,mp-22089,oxide,Hg2Os2O7,"{'functional': 'PBE', 'labels': ['Hg', 'Os_pv', 'O'], 'pot_type': 'paw'}","{'Hg': 2.0, 'Os': 2.0, 'O': 7.0}",GGA,mp-22089,"['mp-992317', 'mp-914974', 'mp-991809', 'mp-22089', 'mp-1416175', 'mp-1698226', 'mp-1881216', 'mp-993933', 'mp-1597903']",0.0368857,"{'Hg': 4.0, 'Os': 4.0, 'O': 14.0}",281.2708406844901,[],NM,False,227,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0002622788761909,0.0368857,0,0.0737714,MP,data/source/MP/cleaned/cifs/MP-mp-22089.cif,False,,data/final/MP/graphs/Hg2Os2O7-MP-mp-22089.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ce0.875Co1In5Yb0.125,2,0.0357142857142857,1.0,True,Ce0.875Co1In5Yb0.125,Ce1Co1In5,1.97,Heavy_fermion,True,Ce12.5Co14.286In71.429Yb1.786,Ce-Co-In-Yb,4,Supercon,Ce0.875Yb0.125Co1In5,MP-mp-19961,Ce1In5Co1,Ce-Co-In,Ce14.286Co14.286In71.429,P 4/m m m,tetragonal,4.635989,4.635989,7.564124,data/final/MP/cifs/Ce0.875Co1In5Yb0.125-MP-mp-19961-synth_doped.cif,data/source/MP/raw/cifs/mp-19961.cif,mp-19961,0.0,,2014-02-21 14:08:25,7.897022127398995,10.17188/1195145,"@misc{osti_1195145,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeIn5Co (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195145"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701944'}},0.0,7.80626318,520.0,-28.52795357,-4.075421938571429,{'tags': ['Cerium cobalt indium (1/1/5)']},-28.52795357,-4.075421938571429,-0.2468754242857146,"['xas', 'bandstructure']",True,[102108],True,2021-05-12 10:56:57.051000,FM,7,8,mp-19961,,CeIn5Co,"{'functional': 'PBE', 'labels': ['Ce', 'In_d', 'Co'], 'pot_type': 'paw'}","{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",GGA,mp-19961,"['mp-928775', 'mp-912209', 'mp-928270', 'mp-19961', 'mp-1504062', 'mp-1701944', 'mp-1785253', 'mp-1593180']",0.9310323,"{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",162.57113333428427,[],FM,True,123,1,"[0.7, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0057269226147644,0.9310323,1,0.9310323,MP,data/source/MP/cleaned/cifs/MP-mp-19961.cif,True,,data/final/MP/graphs/Ce0.875Co1In5Yb0.125-MP-mp-19961-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ir5Th1,1,0.0,1.0,True,Ir5Th1,Ir5Th1,3.93,Other,True,Ir83.333Th16.667,Ir-Th,2,Supercon,Ir5Th1,MP-mp-312,Th1Ir5,Ir-Th,Ir83.333Th16.667,P 6/m m m,hexagonal,4.36614,5.33968999702114,5.3396907,data/final/MP/cifs/Ir5Th1-MP-mp-312.cif,data/source/MP/raw/cifs/mp-312.cif,mp-312,0.0,,2011-05-13 06:57:02,18.37696901221904,10.17188/1205500,"@misc{osti_1205500,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ThIr5 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1205500"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701620'}},0.0,8.34055677,520.0,-54.28029008,-9.046715013333332,{'tags': ['Iridium thorium (5/1)']},-54.28029008,-9.046715013333332,-0.4457132883333337,"['xas', 'bandstructure']",True,"[641095, 641108, 104573, 104574]",True,2021-05-12 10:57:04.957000,NM,6,8,mp-312,,ThIr5,"{'functional': 'PBE', 'labels': ['Th', 'Ir'], 'pot_type': 'paw'}","{'Th': 1.0, 'Ir': 5.0}",GGA,mp-312,"['mp-312', 'mp-993723', 'mp-992023', 'mp-1476160', 'mp-1701620', 'mp-1921146', 'mp-995020', 'mp-1593236']",0.0012359,"{'Th': 1.0, 'Ir': 5.0}",107.81034952358014,[],NM,False,191,0,"[0, 0, 0, 0, 0, 0]",1.1463648948932176e-05,0.0012359,0,0.0012359,MP,data/source/MP/cleaned/cifs/MP-mp-312.cif,False,,data/final/MP/graphs/Ir5Th1-MP-mp-312.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Re0.25W0.75,1,0.0,8.0,False,Re2W6,Re2W6,4.6,Other,True,Re25W75,Re-W,2,Supercon,Re0.25W0.75,MP-mp-1206445,Re2W6,Re-W,Re25W75,P m -3 n,cubic,5.054812,5.054812,5.054812,data/final/MP/cifs/Re0.25W0.75-MP-mp-1206445.cif,data/source/MP/raw/cifs/mp-1206445.cif,mp-1206445,0.0,,2019-01-12 09:45:17.652000,18.969668786751097,,,{'GGA': {'task_id': 'mp-1722774'}},0.0191499462499997,7.19659016,520.0,-102.48461362,-12.8105767025,"{'tags': ['Cr3Si', 'W3Re', 'Frank-Kasper phase']}",-102.48461362,-12.8105767025,0.0191499462499997,['bandstructure'],True,[],True,2021-05-12 10:58:37.524000,NM,8,5,mp-1206445,,ReW3,"{'functional': 'PBE', 'labels': ['Re_pv', 'W_pv'], 'pot_type': 'paw'}","{'Re': 1.0, 'W': 3.0}",GGA,mp-1206445,"['mp-1206445', 'mp-1387317', 'mp-1722774', 'mp-1863618', 'mp-1620672']",0.0005141,"{'Re': 2.0, 'W': 6.0}",129.1561300048851,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",7.960907468821728e-06,0.0005141,0,0.0010282,MP,data/source/MP/cleaned/cifs/MP-mp-1206445.cif,False,,data/final/MP/graphs/Re0.25W0.75-MP-mp-1206445.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
In3Y1,1,0.0,1.0,True,In3Y1,In3Y1,0.87,Other,True,In75Y25,In-Y,2,Supercon,In3Y1,MP-mp-20131,Y1In3,In-Y,In75Y25,P m -3 m,cubic,4.654699,4.654699,4.654699,data/final/MP/cifs/In3Y1-MP-mp-20131.cif,data/source/MP/raw/cifs/mp-20131.cif,mp-20131,0.0,,2014-02-21 08:36:36,7.13547621937221,10.17188/1195276,"@misc{osti_1195276,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YIn3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195276"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686520'}},0.0,7.12925687,520.0,-16.39544616,-4.09886154,{'tags': ['Indium yttrium (3/1)']},-16.39544616,-4.09886154,-0.4184809641666662,"['xas', 'elasticity', 'bandstructure']",True,"[640686, 640697, 603831, 59568, 640698, 59569, 640693]",True,2021-05-12 10:56:14.760000,NM,4,8,mp-20131,,YIn3,"{'functional': 'PBE', 'labels': ['Y_sv', 'In_d'], 'pot_type': 'paw'}","{'Y': 1.0, 'In': 3.0}",GGA,mp-20131,"['mp-930033', 'mp-930507', 'mp-913760', 'mp-20131', 'mp-1440372', 'mp-1686520', 'mp-1796724', 'mp-1597167']",7.7e-06,"{'Y': 1.0, 'In': 3.0}",100.84974551064067,[],NM,False,221,0,"[0, 0, 0, 0]",7.635120902895657e-08,7.7e-06,0,7.7e-06,MP,data/source/MP/cleaned/cifs/MP-mp-20131.cif,False,,data/final/MP/graphs/In3Y1-MP-mp-20131.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba0.099Cu1La1.901O4,2,0.0282857142857142,1.0,True,Ba0.099Cu1La1.901O4,Cu1La2O4,12.3,Cuprate,True,Ba1.414Cu14.286La27.157O57.142857142857146,Ba-Cu-La-O,4,Supercon,La1.901Ba0.099Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ba0.099Cu1La1.901O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ba0.099Cu1La1.901O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
La1Pb2.76Tl0.24,3,0.12,1.0,True,La1Pb2.76Tl0.24,La1Pb3,4.46,Other,True,La25Pb69Tl6,La-Pb-Tl,3,Supercon,La1Tl0.24Pb2.76,MP-mp-21432,La1Pb3,La-Pb,La25Pb75,P m -3 m,cubic,4.968277,4.968277,4.968277,data/final/MP/cifs/La1Pb2.76Tl0.24-MP-mp-21432-synth_doped.cif,data/source/MP/raw/cifs/mp-21432.cif,mp-21432,0.0,,2014-02-21 08:53:02,10.297552988886016,10.17188/1196890,"@misc{osti_1196890,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaPb3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196890"",
    place = ""United States"",
    year = ""2016"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687535'}},0.0,7.94036935,520.0,-17.86283558,-4.465708895,{'tags': ['Lanthanum lead (1/3)']},-17.86283558,-4.465708895,-0.447221816249999,"['xas', 'elasticity', 'bandstructure']",True,"[641644, 104691, 641647, 641640, 104692, 151360]",True,2021-05-12 10:56:16.728000,NM,4,8,mp-21432,,LaPb3,"{'functional': 'PBE', 'labels': ['La', 'Pb_d'], 'pot_type': 'paw'}","{'La': 1.0, 'Pb': 3.0}",GGA,mp-21432,"['mp-993074', 'mp-991107', 'mp-21432', 'mp-1439281', 'mp-1687535', 'mp-1784789', 'mp-994394', 'mp-1589043']",0.0017048,"{'La': 1.0, 'Pb': 3.0}",122.63583830653424,[],NM,False,221,0,"[0, 0, 0, 0]",1.3901319740961604e-05,0.0017048,0,0.0017048,MP,data/source/MP/cleaned/cifs/MP-mp-21432.cif,True,,data/final/MP/graphs/La1Pb2.76Tl0.24-MP-mp-21432-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ru0.465V0.535,3,0.07,2.0,False,Ru0.93V1.07,Ru1V1,5.8,Other,True,Ru46.5V53.5,Ru-V,2,Supercon,Ru0.465V0.535,MP-mp-1395,V1Ru1,Ru-V,Ru50V50,P m -3 m,cubic,3.014694,3.014694,3.014694,data/final/MP/cifs/Ru0.465V0.535-MP-mp-1395-synth_doped.cif,data/source/MP/raw/cifs/mp-1395.cif,mp-1395,0.0,,2011-05-12 19:37:14,9.21288886283982,10.17188/1189837,"@misc{osti_1189837,
    author = ""Persson, Kristin"",
    title = ""Materials Data on VRu (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189837"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688485'}},0.0,7.72767567,520.0,-18.82570789,-9.412853945,"{'tags': ['Ruthenium vanadium (1/1)', 'Ruthenium vanadium (1/1) - HT']}",-18.82570789,-9.412853945,-0.2337060825000012,"['xas', 'elasticity', 'bandstructure']",True,"[106010, 106011]",True,2021-05-12 10:56:12.755000,FiM,2,17,mp-1395,,VRu,"{'functional': 'PBE', 'labels': ['V_pv', 'Ru_pv'], 'pot_type': 'paw'}","{'V': 1.0, 'Ru': 1.0}",GGA,mp-1395,"['mp-991544', 'mp-993492', 'mp-2829', 'mp-1395', 'mp-1059722', 'mp-1059669', 'mp-1059766', 'mp-1059703', 'mp-1059619', 'mp-1059801', 'mp-1442257', 'mp-1688485', 'mp-1792970', 'mp-994797', 'mp-1591529', 'mp-1059798', 'mp-1059699']",0.647887,"{'V': 1.0, 'Ru': 1.0}",27.39868439535897,[],FiM,True,221,2,"[0.7, -0.1]",0.023646646337141,0.647887,2,0.647887,MP,data/source/MP/cleaned/cifs/MP-mp-1395.cif,True,,data/final/MP/graphs/Ru0.465V0.535-MP-mp-1395-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Lu1Pb1Pd2,1,0.0,1.0,True,Lu1Pb1Pd2,Lu1Pb1Pd2,2.4,Other,True,Lu25Pb25Pd50,Lu-Pb-Pd,3,Supercon,Pd2Lu1Pb1,MP-mp-1206796,Lu1Pd2Pb1,Lu-Pb-Pd,Lu25Pb25Pd50,F m -3 m,cubic,4.82628521,4.82628521,4.82628521,data/final/MP/cifs/Lu1Pb1Pd2-MP-mp-1206796.cif,data/source/MP/raw/cifs/mp-1206796.cif,mp-1206796,0.0,,2019-01-12 10:02:04.562000,12.429315762002972,,,{'GGA': {'task_id': 'mp-1767776'}},0.0214248053124963,6.05904563,520.0,-21.43715406,-5.359288515,"{'tags': ['b.c.c. atom arrangement', 'Cu2MnAl', 'LuPd2Pb']}",-21.43715406,-5.359288515,-0.7109482125,['bandstructure'],True,[],True,2021-05-12 10:58:39.488000,NM,4,5,mp-1206796,,LuPd2Pb,"{'functional': 'PBE', 'labels': ['Lu_3', 'Pd', 'Pb_d'], 'pot_type': 'paw'}","{'Lu': 1.0, 'Pd': 2.0, 'Pb': 1.0}",GGA,mp-1206796,"['mp-1206796', 'mp-1433014', 'mp-1767776', 'mp-1781736', 'mp-1614139']",0.0032734,"{'Lu': 1.0, 'Pd': 2.0, 'Pb': 1.0}",79.49209653365872,[],NM,False,225,0,"[0, 0, 0, 0]",4.117893655772394e-05,0.0032734,0,0.0032734,MP,data/source/MP/cleaned/cifs/MP-mp-1206796.cif,False,,data/final/MP/graphs/Lu1Pb1Pd2-MP-mp-1206796.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Al0.3In0.7La3,3,0.15,1.0,True,Al0.3In0.7La3,In1La3,9.42,Other,True,Al7.5In17.5La75,Al-In-La,3,Supercon,La3In0.7Al0.3,MP-mp-20909,La3In1,In-La,In25La75,P m -3 m,cubic,5.076766,5.076766,5.076766,data/final/MP/cifs/Al0.3In0.7La3-MP-mp-20909-synth_doped.cif,data/source/MP/raw/cifs/mp-20909.cif,mp-20909,0.0,,2014-02-21 06:52:52,6.7455760598452565,10.17188/1196104,"@misc{osti_1196104,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La3In (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196104"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671685'}},0.0,8.16935076,520.0,-18.73796121,-4.6844903025,"{'tags': ['Indium lanthanum (1/3)', 'Lanthanum indium (3/1)']}",-18.73796121,-4.6844903025,-0.2945640412500001,"['xas', 'bandstructure']",True,"[639844, 51950, 639851, 639840, 603208, 107019]",True,2021-05-12 10:56:57.051000,NM,4,8,mp-20909,,La3In,"{'functional': 'PBE', 'labels': ['La', 'In_d'], 'pot_type': 'paw'}","{'La': 3.0, 'In': 1.0}",GGA,mp-20909,"['mp-906743', 'mp-921394', 'mp-920373', 'mp-20909', 'mp-1476042', 'mp-1671685', 'mp-1778647', 'mp-1590323']",0.0489742,"{'La': 3.0, 'In': 1.0}",130.84629766481785,[],NM,False,221,0,"[0, 0, 0, 0]",0.0003742880071811,0.0489742,0,0.0489742,MP,data/source/MP/cleaned/cifs/MP-mp-20909.cif,True,,data/final/MP/graphs/Al0.3In0.7La3-MP-mp-20909-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Al0.67Ga0.33Nb3,3,0.085,2.0,False,Al1.34Ga0.66Nb6,Al1Ga1Nb6,18.7,Other,True,Al16.75Ga8.25Nb75,Al-Ga-Nb,3,Supercon,Nb3Al0.67Ga0.33,MP-mp-1220348,Nb6Al1Ga1,Al-Ga-Nb,Al12.5Ga12.5Nb75,P m -3,cubic,5.200229,5.200229,5.200229,data/final/MP/cifs/Al0.67Ga0.33Nb3-MP-mp-1220348-synth_doped.cif,data/source/MP/raw/cifs/mp-1220348.cif,mp-1220348,0.0,,2019-01-12 21:12:34.707000,7.724213490019127,,,{'GGA': {'task_id': 'mp-1752644'}},0.0490749666875007,5.24232507,520.0,-68.77635789,-8.59704473625,{'tags': []},-68.77635789,-8.59704473625,-0.1743569746875,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,8,5,mp-1220348,,Nb6AlGa,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al', 'Ga_d'], 'pot_type': 'paw'}","{'Nb': 6.0, 'Al': 1.0, 'Ga': 1.0}",GGA,mp-1220348,"['mp-1220348', 'mp-1411514', 'mp-1752644', 'mp-1787843', 'mp-1619126']",0.0457429,"{'Nb': 6.0, 'Al': 1.0, 'Ga': 1.0}",140.62657729809163,[],NM,False,200,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0003252791960017,0.0457429,0,0.0457429,MP,data/source/MP/cleaned/cifs/MP-mp-1220348.cif,True,,data/final/MP/graphs/Al0.67Ga0.33Nb3-MP-mp-1220348-synth_doped.json,0,True,m-3,2,0,0,0,0,0,0,1,0,0,0,1.0,False
Ta1,1,0.0,30.0,False,Ta30,Ta30,4.3769,Other,True,Ta100,Ta,1,Supercon,Ta1,MP-mp-42,Ta30,Ta,Ta100,P -4 21 m,tetragonal,5.346795,10.247595,10.247595,data/final/MP/cifs/Ta1-MP-mp-42.cif,data/source/MP/raw/cifs/mp-42.cif,mp-42,0.0,,2011-05-24 03:30:05,16.05411656414693,10.17188/1207953,"@misc{osti_1207953,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ta (SG:113) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207953"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1758913'}},0.0069996423333318,5.26608119,520.0,-355.52333963,-11.850777987666667,"{'tags': ['Tantalum - beta', 'Tantalum - beta, RT-II', 'Tantalum - beta, RT-I', 'Tantalum (30) - beta']}",-355.52333963,-11.850777987666667,0.0069996423333331,"['xas', 'elasticity', 'bandstructure']",True,"[250214, 96595, 54208, 96594, 280872]",True,2021-05-12 10:56:20.740000,NM,30,9,mp-42,,Ta,"{'functional': 'PBE', 'labels': ['Ta_pv'], 'pot_type': 'paw'}",{'Ta': 1.0},GGA,mp-42,"['mp-926569', 'mp-910921', 'mp-927166', 'mp-42', 'mp-1116343', 'mp-1390622', 'mp-1758913', 'mp-1883539', 'mp-1624296']",0.0001458466666666,{'Ta': 30.0},561.4840702530086,[],NM,False,113,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",7.792563016130475e-06,0.0001458466666666,0,0.0043754,MP,data/source/MP/cleaned/cifs/MP-mp-42.cif,False,,data/final/MP/graphs/Ta1-MP-mp-42.json,0,True,-42m,0,0,0,0,6,0,0,1,0,0,0,1.0,False
Ce1Co0.03Ru1.97,2,0.02,2.0,False,Ce2Co0.06Ru3.94,Ce2Ru4,3.5,Heavy_fermion,True,Ce33.333Co1Ru65.667,Ce-Co-Ru,3,Supercon,Ce1Ru1.97Co0.03,MP-mp-607,Ce2Ru4,Ce-Ru,Ce33.333Ru66.667,F d -3 m,cubic,5.35903077,5.35903077,5.35903077,data/final/MP/cifs/Ce1Co0.03Ru1.97-MP-mp-607-synth_doped.cif,data/source/MP/raw/cifs/mp-607.cif,mp-607,0.0,,2011-05-13 22:34:26,10.444470046690055,10.17188/1277529,"@misc{osti_1277529,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeRu2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277529"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686879'}},0.0,8.61419203,520.0,-50.66413619,-8.444022698333333,"{'tags': ['Cerium ruthenium (1/2)', 'Cerium ruthenium hydride (1/2/4)']}",-50.66413619,-8.444022698333333,-0.2833998766666663,"['xas', 'elasticity', 'bandstructure']",True,"[621326, 656077, 621978, 621973, 621980, 621984, 102277, 621972, 621976, 621979, 604113, 621977, 621982, 621983, 102276, 656078]",True,2021-05-12 10:56:27.046000,NM,6,14,mp-607,,CeRu2,"{'functional': 'PBE', 'labels': ['Ce', 'Ru_pv'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Ru': 2.0}",GGA,mp-607,"['mp-928203', 'mp-912221', 'mp-928809', 'mp-607', 'mp-1071462', 'mp-1071593', 'mp-1071613', 'mp-1077792', 'mp-1440763', 'mp-1686879', 'mp-1803198', 'mp-1591928', 'mp-1591642', 'mp-1071635']",1.005e-05,"{'Ce': 2.0, 'Ru': 4.0}",108.82877852828122,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",1.846937939745105e-07,1.005e-05,0,2.01e-05,MP,data/source/MP/cleaned/cifs/MP-mp-607.cif,True,,data/final/MP/graphs/Ce1Co0.03Ru1.97-MP-mp-607-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Au0.25Cu0.75,1,0.0,4.0,False,Au1Cu3,Au1Cu3,0.0,Other,True,Au25Cu75,Au-Cu,2,Supercon,Au0.25Cu0.75,MP-mp-2258,Cu3Au1,Au-Cu,Au25Cu75,P m -3 m,cubic,3.773915,3.773915,3.773915,data/final/MP/cifs/Au0.25Cu0.75-MP-mp-2258.cif,data/source/MP/raw/cifs/mp-2258.cif,mp-2258,0.0,,2011-05-13 09:17:48,11.974617292696903,10.17188/1198800,"@misc{osti_1198800,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Cu3Au (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198800"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1673089'}},0.0,6.42795626,520.0,-15.71691505,-3.9292287625,"{'tags': ['Gold cupride (1/3) - HT', 'Copper gold (3/1)', 'Gold copper (1/3)']}",-15.71691505,-3.9292287625,-0.0363533750000004,"['xas', 'elasticity', 'bandstructure']",True,"[655034, 150666, 611743, 42587, 151364, 40351]",True,2021-05-12 10:56:16.728000,NM,4,8,mp-2258,,Cu3Au,"{'functional': 'PBE', 'labels': ['Cu_pv', 'Au'], 'pot_type': 'paw'}","{'Cu': 3.0, 'Au': 1.0}",GGA,mp-2258,"['mp-917165', 'mp-918581', 'mp-919602', 'mp-2258', 'mp-1440380', 'mp-1673089', 'mp-1791719', 'mp-1594305']",1.04e-05,"{'Cu': 3.0, 'Au': 1.0}",53.74973692142084,[],NM,False,221,0,"[0, 0, 0, 0]",1.9348931912363085e-07,1.04e-05,0,1.04e-05,MP,data/source/MP/cleaned/cifs/MP-mp-2258.cif,False,,data/final/MP/graphs/Au0.25Cu0.75-MP-mp-2258.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ir1Lu3,1,0.0,4.0,False,Ir4Lu12,Ir4Lu12,0.0,Other,True,Ir25Lu75,Ir-Lu,2,Supercon,Ir1Lu3,MP-mp-1189562,Lu12Ir4,Ir-Lu,Ir25Lu75,P n m a,orthorhombic,6.235124,7.161365,9.030864,data/final/MP/cifs/Ir1Lu3-MP-mp-1189562.cif,data/source/MP/raw/cifs/mp-1189562.cif,mp-1189562,0.0,,2019-01-11 20:17:20.177000,11.812165034174727,,,,0.0,3.9049534,520.0,-100.11218184,-6.257011365,"{'tags': ['Lutetium iridium (3/1)', 'Fe3C', 'Lu3Ir']}",-100.11218184,-6.257011365,-0.6566908700000003,[],False,[640771],True,2021-05-12 10:59:54.607000,NM,16,3,mp-1189562,,Lu3Ir,"{'functional': 'PBE', 'labels': ['Lu_3', 'Ir'], 'pot_type': 'paw'}","{'Lu': 3.0, 'Ir': 1.0}",GGA,mp-1189562,"['mp-1189562', 'mp-1822683', 'mp-1986301']",0.0015735,"{'Lu': 12.0, 'Ir': 4.0}",403.24612834881736,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.560833336645341e-05,0.0015735,0,0.006294,MP,data/source/MP/cleaned/cifs/MP-mp-1189562.cif,False,,data/final/MP/graphs/Ir1Lu3-MP-mp-1189562.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ca0.18Cu1La1.82O4,3,0.0514285714285714,1.0,True,Ca0.18Cu1La1.82O4,Cu1La2O4,33.0,Cuprate,True,Ca2.571Cu14.286La26O57.142857142857146,Ca-Cu-La-O,4,Supercon,La1.82Ca0.18Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ca0.18Cu1La1.82O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ca0.18Cu1La1.82O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As1Fe1Pr0.9Sr0.1O1,2,0.0499999999999999,2.0,False,As2Fe2Pr1.8Sr0.2O2,As2Fe2Pr2O2,12.8,Ferrite,True,As25Fe25Pr22.5Sr2.5O25,As-Fe-Pr-Sr-O,5,Supercon,Pr0.9Sr0.1Fe1As1O1,MP-mp-22491,Pr2Fe2As2O2,As-Fe-Pr-O,As25Fe25Pr25O25,P 4/n m m,tetragonal,4.094889,4.094889,9.258722,data/final/MP/cifs/As1Fe1Pr0.9Sr0.1O1-MP-mp-22491-synth_doped.cif,data/source/MP/raw/cifs/mp-22491.cif,mp-22491,0.0,,2014-02-25 19:17:30,6.153806906111091,,,{'GGA+U': {'task_id': 'mp-1695715'}},0.3808778432291664,4.12348168,520.0,-51.7633941,-6.4704242625,{'tags': ['Praseodymium iron arsenic oxide (1/1/1/1)']},-51.7633941,-6.4704242625,-1.491677511249999,"['xas', 'bandstructure']",True,"[162830, 162833, 246832, 90316, 422000, 236649, 236648, 602491]",True,2021-05-12 10:57:10.838000,FM,8,8,mp-22491,oxide,PrFeAsO,"{'functional': 'PBE', 'labels': ['Pr_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Pr': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-22491,"['mp-510622', 'mp-1079608', 'mp-1079857', 'mp-22491', 'mp-1476145', 'mp-1695715', 'mp-1778524', 'mp-1596397']",3.7947681,"{'Pr': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",155.25132378854377,[],FM,True,129,1,"[0.0, 0.0, 3.5, 3.5, 0.0, 0.0, 0.0, 0.0]",0.0488854846116297,3.7947681,2,7.5895362,MP,data/source/MP/cleaned/cifs/MP-mp-22491.cif,True,,data/final/MP/graphs/As1Fe1Pr0.9Sr0.1O1-MP-mp-22491-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ce1Pd1Sb2,1,0.0,2.0,False,Ce2Pd2Sb4,Ce2Pd2Sb4,0.0,Heavy_fermion,True,Ce25Pd25Sb50,Ce-Pd-Sb,3,Supercon,Ce1Pd1Sb2,MP-mp-1079881,Ce2Sb4Pd2,Ce-Pd-Sb,Ce25Pd25Sb50,P 4/n m m,tetragonal,4.434943,4.434943,9.798965,data/final/MP/cifs/Ce1Pd1Sb2-MP-mp-1079881.cif,data/source/MP/raw/cifs/mp-1079881.cif,mp-1079881,0.0,,2018-04-16 16:03:12,8.444394469328731,,,{'GGA': {'task_id': 'mp-1673160'}},0.0,7.87232211,520.0,-45.45016194,-5.6812702425,{'tags': ['Cerium palladium antimonide (1/1/2)']},-45.45016194,-5.6812702425,-0.93452688125,['bandstructure'],True,[658218],True,2021-05-12 10:58:16.596000,FM,8,5,mp-1079881,,CeSb2Pd,"{'functional': 'PBE', 'labels': ['Ce', 'Sb', 'Pd'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Sb': 2.0, 'Pd': 1.0}",GGA,mp-1079881,"['mp-1079881', 'mp-1300928', 'mp-1673160', 'mp-1833418', 'mp-1602589']",0.24115115,"{'Ce': 2.0, 'Sb': 4.0, 'Pd': 2.0}",192.73309312524748,[],FM,True,129,1,"[0.2, 0.2, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0025024363599383,0.24115115,2,0.4823023,MP,data/source/MP/cleaned/cifs/MP-mp-1079881.cif,False,,data/final/MP/graphs/Ce1Pd1Sb2-MP-mp-1079881.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
As2Ba0.76Fe2K0.24,3,0.104,2.0,False,As4Ba1.52Fe4K0.48,As4Ba1Fe4K1,26.0,Ferrite,True,As40Ba15.2Fe40K4.8,As-Ba-Fe-K,4,Supercon,Ba0.76K0.24Fe2As2,MP-mp-1223517,K1Ba1Fe4As4,As-Ba-Fe-K,As40Ba10Fe40K10,C m m m,orthorhombic,5.479027,5.480024002658328,7.13170472,data/final/MP/cifs/As2Ba0.76Fe2K0.24-MP-mp-1223517-synth_doped.cif,data/source/MP/raw/cifs/mp-1223517.cif,mp-1223517,0.0,,2019-01-12 23:54:03.876000,5.87534599912672,,,{'GGA': {'task_id': 'mp-1743010'}},0.0132513644999994,4.21185628,520.0,-59.66633886,-5.966633886,{'tags': []},-59.66633886,-5.966633886,-0.4120461663000007,[],False,[],True,2021-05-12 11:00:52.054000,FM,10,4,mp-1223517,,KBa(FeAs)4,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",GGA,mp-1223517,"['mp-1223517', 'mp-1396881', 'mp-1743010', 'mp-1827585']",0.9947188,"{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",197.6961518155852,[],FM,True,65,1,"[0.0, 0.0, 0.3, 0.3, 0.3, 0.3, 0.0, 0.0, 0.0, 0.0]",0.0050315536790412,0.9947188,4,0.9947188,MP,data/source/MP/cleaned/cifs/MP-mp-1223517.cif,True,,data/final/MP/graphs/As2Ba0.76Fe2K0.24-MP-mp-1223517-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Al1Cu2Zr1,1,0.0,1.0,True,Al1Cu2Zr1,Al1Cu2Zr1,0.0,Other,True,Al25Cu50Zr25,Al-Cu-Zr,3,Supercon,Cu2Zr1Al1,MP-mp-3736,Zr1Al1Cu2,Al-Cu-Zr,Al25Cu50Zr25,F m -3 m,cubic,4.41931132,4.419311319999999,4.419311319999999,data/final/MP/cifs/Al1Cu2Zr1-MP-mp-3736.cif,data/source/MP/raw/cifs/mp-3736.cif,mp-3736,0.0,,2011-05-13 03:05:52,6.674112097098029,10.17188/1207352,"@misc{osti_1207352,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrAlCu2 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207352"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1674393'}},0.0031277009403662,6.89116214,520.0,-21.90347348,-5.47586837,"{'tags': ['Aluminum copper zirconium (1/2/1)', 'Aluminium copper zirconium (1/2/1)']}",-21.90347348,-5.47586837,-0.3529459199999998,"['xas', 'elasticity', 'bandstructure']",True,"[607205, 185282, 57732, 656062]",True,2021-05-12 10:56:20.740000,NM,4,14,mp-3736,,ZrAlCu2,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Al', 'Cu_pv'], 'pot_type': 'paw'}","{'Zr': 1.0, 'Al': 1.0, 'Cu': 2.0}",GGA,mp-3736,"['mp-993610', 'mp-991703', 'mp-3736', 'mp-510427', 'mp-1064352', 'mp-1064371', 'mp-1064400', 'mp-1267274', 'mp-1439141', 'mp-1674393', 'mp-1783412', 'mp-994917', 'mp-1592954', 'mp-1064404']",0.00014,"{'Zr': 1.0, 'Al': 1.0, 'Cu': 2.0}",61.03076182421792,[],NM,False,225,0,"[0, 0, 0, 0]",2.293925158647551e-06,0.00014,0,0.00014,MP,data/source/MP/cleaned/cifs/MP-mp-3736.cif,False,,data/final/MP/graphs/Al1Cu2Zr1-MP-mp-3736.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
N1Ti1,1,0.0,1.0,True,N1Ti1,N1Ti1,5.387499999999999,Other,True,N50Ti50,N-Ti,2,Supercon,Ti1N1,MP-mp-492,Ti1N1,N-Ti,N50Ti50,F m -3 m,cubic,3.00770274,3.00770274,3.00770274,data/final/MP/cifs/N1Ti1-MP-mp-492.cif,data/source/MP/raw/cifs/mp-492.cif,mp-492,0.0,,2011-05-12 17:28:04,5.340297482734746,10.17188/1208488,"@misc{osti_1208488,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TiN (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208488"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1674200'}},0.0,9.09773138,520.0,-19.66499517,-9.832497585,"{'tags': ['Titanium nitride', 'Titanium nitride (1/1)', 'Titanium(III) nitride', 'Titanium nitride - B1', 'Osbornite']}",-19.66499517,-9.832497585,-1.897004114166668,"['xas', 'elasticity', 'bandstructure']",True,"[26947, 192040, 181787, 644778, 64905, 64909, 183415, 236802, 105128, 184916, 644774, 644770, 644780, 644768, 644783, 186008, 152807, 187188, 644777, 644772, 644781, 64904, 656836, 604220, 236801, 644769, 644775, 644776, 186382, 658338, 601248, 644779, 64908, 64907]",True,2021-05-12 10:56:20.740000,NM,2,42,mp-492,,TiN,"{'functional': 'PBE', 'labels': ['Ti_pv', 'N'], 'pot_type': 'paw'}","{'Ti': 1.0, 'N': 1.0}",GGA,mp-492,"['mp-1000437', 'mp-1006912', 'mvc-13876', 'mp-492', 'mp-1057172', 'mp-1057185', 'mp-1057208', 'mp-1058302', 'mp-1058334', 'mp-1058311', 'mp-1058844', 'mp-1058812', 'mp-1058719', 'mp-1058731', 'mp-1058768', 'mp-1058795', 'mp-1059321', 'mp-1059405', 'mp-1059335', 'mp-1059364', 'mp-1059371', 'mp-1059381', 'mp-1060451', 'mp-1060512', 'mp-1060469', 'mp-1061088', 'mp-1061064', 'mp-1061129', 'mp-1440637', 'mp-1674200', 'mp-1793307', 'mp-1011627', 'mp-1595453', 'mp-1594449', 'mp-1058832', 'mp-1061120', 'mp-1057200', 'mp-1058325', 'mp-1059400', 'mp-1058755', 'mp-1060496', 'mp-1059351']",0.0002595,"{'Ti': 1.0, 'N': 1.0}",19.23932072646892,[],NM,False,225,0,"[0, 0]",1.3488002185180434e-05,0.0002595,0,0.0002595,MP,data/source/MP/cleaned/cifs/MP-mp-492.cif,False,,data/final/MP/graphs/N1Ti1-MP-mp-492.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Co0.021Si1V2.979,2,0.0104999999999999,2.0,False,Co0.042Si2V5.958,Si2V6,16.4,Other,True,Co0.525Si25V74.475,Co-Si-V,3,Supercon,V2.979Co0.021Si1,MP-mp-2567,V6Si2,Si-V,Si25V75,P m -3 n,cubic,4.702381,4.702381,4.702381,data/final/MP/cifs/Co0.021Si1V2.979-MP-mp-2567-synth_doped.cif,data/source/MP/raw/cifs/mp-2567.cif,mp-2567,0.0,,2011-05-13 19:15:43,5.778142190030859,10.17188/1200874,"@misc{osti_1200874,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Si (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1200874"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668672'}},0.0,7.30599425,520.0,-69.05773321,-8.63221665125,{'tags': ['Vanadium silicide (3/1)']},-69.05773321,-8.63221665125,-0.4452085937499994,"['xas', 'elasticity', 'bandstructure']",True,"[652491, 87328, 652522, 652502, 652510, 652520, 600518, 186003, 652507, 652513, 652497, 601150, 652514, 652487, 22412, 652509, 652529, 652532, 652499, 652539, 652537, 652533, 652512, 652538, 652490, 652493, 652494, 652511, 652519, 87329, 652526, 652500]",True,2021-05-12 10:56:18.721000,FM,8,13,mp-2567,,V3Si,"{'functional': 'PBE', 'labels': ['V_pv', 'Si'], 'pot_type': 'paw'}","{'V': 3.0, 'Si': 1.0}",GGA,mp-2567,"['mp-920081', 'mp-906309', 'mp-919083', 'mp-2567', 'mp-1078474', 'mp-1078852', 'mp-1138781', 'mp-1145907', 'mp-1440678', 'mp-1668672', 'mp-1795955', 'mp-1593554', 'mp-1596575']",0.8382519,"{'V': 6.0, 'Si': 2.0}",103.98086881866836,[],FM,True,131,1,"[0.2, 0.3, 0.3, 0.2, 0.3, 0.3, 0.0, 0.0]",0.0161231947669493,0.8382519,6,1.6765038,MP,data/source/MP/cleaned/cifs/MP-mp-2567.cif,True,,data/final/MP/graphs/Co0.021Si1V2.979-MP-mp-2567-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
B4Er0.79Ho0.21Rh4,3,0.0466666666666666,2.0,False,B8Er1.58Ho0.42Rh8,B8Er2Rh8,8.22,Other,True,B44.444Er8.778Ho2.333Rh44.444,B-Er-Ho-Rh,4,Supercon,Er0.79Ho0.21Rh4B4,MP-mp-8408,Er2B8Rh8,B-Er-Rh,B44.444Er11.111Rh44.444,P 42/n m c,tetragonal,5.336304,5.336304,7.44528,data/final/MP/cifs/B4Er0.79Ho0.21Rh4-MP-mp-8408-synth_doped.cif,data/source/MP/raw/cifs/mp-8408.cif,mp-8408,0.0,,2011-06-07 02:27:50,9.745285939793032,10.17188/1308086,"@misc{osti_1308086,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Er(BRh)4 (SG:137) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1308086"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1673724'}},0.0133402750000009,6.84272912,520.0,-131.92031901,-7.328906611666666,{'tags': ['Erbium rhodium boride (1/4/4)']},-131.92031901,-7.328906611666666,-0.5797380146296286,"['xas', 'bandstructure']",True,"[613809, 601530, 49631]",True,2021-05-12 10:57:51.871000,NM,18,8,mp-8408,,Er(BRh)4,"{'functional': 'PBE', 'labels': ['Er_3', 'B', 'Rh_pv'], 'pot_type': 'paw'}","{'Er': 1.0, 'B': 4.0, 'Rh': 4.0}",GGA,mp-8408,"['mp-932384', 'mp-931412', 'mp-8408', 'mp-915879', 'mp-1434188', 'mp-1673724', 'mp-1785064', 'mp-1597242']",7.985e-05,"{'Er': 2.0, 'B': 8.0, 'Rh': 8.0}",212.01283845150363,[],NM,False,137,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",7.532562705467018e-07,7.985e-05,0,0.0001597,MP,data/source/MP/cleaned/cifs/MP-mp-8408.cif,True,,data/final/MP/graphs/B4Er0.79Ho0.21Rh4-MP-mp-8408-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ga0.281V0.719,3,0.062,8.0,False,Ga2.248V5.752,Ga2V6,12.2,Other,True,Ga28.1V71.9,Ga-V,2,Supercon,Ga0.281V0.719,MP-mp-22568,V6Ga2,Ga-V,Ga25V75,P m -3 n,cubic,4.789645,4.789645,4.789645,data/final/MP/cifs/Ga0.281V0.719-MP-mp-22568-synth_doped.cif,data/source/MP/raw/cifs/mp-22568.cif,mp-22568,0.0,,2014-02-22 11:36:40,6.726541666276222,10.17188/1198793,"@misc{osti_1198793,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Ga (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198793"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686867'}},0.0,5.67452231,520.0,-61.95244347,-7.74405543375,{'tags': ['Gallium vanadium (1/3)']},-61.95244347,-7.74405543375,-0.1741018756249994,"['xas', 'elasticity', 'bandstructure']",True,"[635643, 635628, 635619, 635634, 104021, 635646, 635604, 635610, 635617, 635624, 635626, 635605, 635631, 635625, 635636, 635603, 104020, 635616, 635607]",True,2021-05-12 10:56:16.728000,FM,8,9,mp-22568,,V3Ga,"{'functional': 'PBE', 'labels': ['V_pv', 'Ga_d'], 'pot_type': 'paw'}","{'V': 3.0, 'Ga': 1.0}",GGA,mp-22568,"['mp-941343', 'mp-941663', 'mp-934924', 'mp-22568', 'mp-1440749', 'mp-1686867', 'mp-1804076', 'mp-1593784', 'mp-1595713']",0.09063635,"{'V': 6.0, 'Ga': 2.0}",109.87780534443452,[],FM,True,131,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.0, -0.0, -0.0]",0.0016497662965852,0.09063635,2,0.1812727,MP,data/source/MP/cleaned/cifs/MP-mp-22568.cif,True,,data/final/MP/graphs/Ga0.281V0.719-MP-mp-22568-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
As2Fe1.85Ni0.15Sr1,3,0.0599999999999999,1.0,True,As2Fe1.85Ni0.15Sr1,As2Fe2Sr1,8.93,Ferrite,True,As40Fe37Ni3Sr20,As-Fe-Ni-Sr,4,Supercon,Sr1Fe1.85Ni0.15As2,MP-mp-4488,Sr1Fe2As2,As-Fe-Sr,As40Fe40Sr20,I 4/m m m,tetragonal,3.9729799997357778,3.9729799997357778,6.45523327,data/final/MP/cifs/As2Fe1.85Ni0.15Sr1-MP-mp-4488-synth_doped.cif,data/source/MP/raw/cifs/mp-4488.cif,mp-4488,0.0,,2011-05-13 03:37:13,6.319998834487784,10.17188/1208187,"@misc{osti_1208187,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr(FeAs)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208187"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672865'}},0.0,5.13397273,520.0,-30.61898897,-6.123797794,"{'tags': ['Strontium diiron arsenide - HT', 'Strontium diiron arsenide', 'Strontium diiron diarsenide', 'Iron strontium arsenide (2/1/2)', 'Strontium diiron arsenide - LT']}",-30.61898897,-6.123797794,-0.5342483613333335,"['xas', 'elasticity', 'bandstructure']",True,"[182330, 181993, 610527, 163209, 163208, 163869]",True,2021-05-12 10:56:20.740000,NM,5,8,mp-4488,,Sr(FeAs)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Fe': 2.0, 'As': 2.0}",GGA,mp-4488,"['mp-906356', 'mp-920135', 'mp-919110', 'mp-4488', 'mp-1439153', 'mp-1672865', 'mp-1873948', 'mp-1592272']",0.0029206,"{'Sr': 1.0, 'Fe': 2.0, 'As': 2.0}",91.7377588211838,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",3.183640016422098e-05,0.0029206,0,0.0029206,MP,data/source/MP/cleaned/cifs/MP-mp-4488.cif,True,,data/final/MP/graphs/As2Fe1.85Ni0.15Sr1-MP-mp-4488-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Au1Th2,1,0.0,2.0,False,Au2Th4,Au2Th4,3.365,Other,True,Au33.333Th66.667,Au-Th,2,Supercon,Au1Th2,MP-mp-1629,Th4Au2,Au-Th,Au33.333Th66.667,I 4/m c m,tetragonal,6.062719997374048,6.090439071105218,6.09043907,data/final/MP/cifs/Au1Th2-MP-mp-1629.cif,data/source/MP/raw/cifs/mp-1629.cif,mp-1629,0.0,,2011-05-13 15:41:53,12.976867891649286,10.17188/1191757,"@misc{osti_1191757,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Th2Au (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191757"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699699'}},0.0,7.15378766,520.0,-38.72511285,-6.454185475,"{'tags': ['Thorium auride (2/1)', 'Gold thorium (1/2)']}",-38.72511285,-6.454185475,-0.4203194616666674,"['xas', 'elasticity', 'bandstructure']",True,"[150644, 601375, 58602, 612401]",True,2021-05-12 10:56:12.755000,NM,6,10,mp-1629,,Th2Au,"{'functional': 'PBE', 'labels': ['Th', 'Au'], 'pot_type': 'paw'}","{'Th': 2.0, 'Au': 1.0}",GGA,mp-1629,"['mp-919561', 'mp-905381', 'mp-918578', 'mp-1629', 'mp-1076984', 'mp-1077734', 'mp-1423085', 'mp-1699699', 'mp-1834929', 'mp-1588858']",0.0004068,"{'Th': 4.0, 'Au': 2.0}",169.1759859066122,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0]",4.809193193939003e-06,0.0004068,0,0.0008136,MP,data/source/MP/cleaned/cifs/MP-mp-1629.cif,False,,data/final/MP/graphs/Au1Th2-MP-mp-1629.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B0.14C0.86Cu1Sr2O5,2,0.0311111111111111,4.0,False,B0.56C3.44Cu4Sr8O20,C4Cu4Sr8O20,31.0,Cuprate,True,B1.556C9.556Cu11.111Sr22.222O55.55555555555556,B-C-Cu-Sr-O,5,Supercon,Sr2Cu1C0.86B0.14O5,MP-mp-1198030,Sr8Cu4C4O20,C-Cu-Sr-O,C11.111Cu11.111Sr22.222O55.55555555555556,I -4,tetragonal,7.877744002100394,7.877744002100395,9.46755054,data/final/MP/cifs/B0.14C0.86Cu1Sr2O5-MP-mp-1198030-synth_doped.cif,data/source/MP/raw/cifs/mp-1198030.cif,mp-1198030,0.0,,2019-01-12 02:53:33.853000,4.624821022244182,,,{'GGA': {'task_id': 'mp-1742814'}},0.0386187874999981,3.47889523,520.0,-237.90163358,-6.608378710555556,"{'tags': ['Distrontium copper dioxide carbonate - LT', 'Distrontium copper dioxide carbonate']}",-237.90163358,-6.608378710555556,-2.385069899259259,['bandstructure'],True,"[78650, 83095]",True,2021-05-12 10:58:37.524000,NM,36,6,mp-1198030,oxide,Sr2CuCO5,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Cu_pv', 'C', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Cu': 1.0, 'C': 1.0, 'O': 5.0}",GGA,mp-1198030,"['mp-1198030', 'mp-1200477', 'mp-1399692', 'mp-1742814', 'mp-1929945', 'mp-1655225']",0.000743875,"{'Sr': 8.0, 'Cu': 4.0, 'C': 4.0, 'O': 20.0}",475.08507610840775,[],NM,False,82,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.263088759540475e-06,0.000743875,0,0.0029755,MP,data/source/MP/cleaned/cifs/MP-mp-1198030.cif,True,,data/final/MP/graphs/B0.14C0.86Cu1Sr2O5-MP-mp-1198030-synth_doped.json,0,True,-4,0,0,0,0,2,0,0,0,0,1,0,1.0,False
Lu2Rh1,3,0.0833333333333333,5.0,False,Lu10Rh5,Lu10Rh6,0.0,Other,True,Lu66.667Rh33.333,Lu-Rh,2,Supercon,Lu2Rh1,MP-mp-865778,Lu10Rh6,Lu-Rh,Lu62.5Rh37.5,P 63/m c m,hexagonal,6.158231,8.11011599923849,8.11011558,data/final/MP/cifs/Lu2Rh1-MP-mp-865778-synth_doped.cif,data/source/MP/raw/cifs/mp-865778.cif,mp-865778,0.0,,2014-09-01 02:14:30,11.205353033415852,10.17188/1310978,"@misc{osti_1310978,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Lu5Rh3 (SG:193) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1310978"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1670990'}},0.0,4.17834066,520.0,-102.40174588,-6.4001091175,{'tags': ['Lutetium rhodide (5/3)']},-102.40174588,-6.4001091175,-0.8128995912500008,['bandstructure'],True,[642542],True,2021-05-12 10:59:07.834000,NM,16,9,mp-865778,,Lu5Rh3,"{'functional': 'PBE', 'labels': ['Lu_3', 'Rh_pv'], 'pot_type': 'paw'}","{'Lu': 5.0, 'Rh': 3.0}",GGA,mp-865778,"['mp-865778', 'mp-1053653', 'mp-1053884', 'mp-1189884', 'mp-1413074', 'mp-1670990', 'mp-1839975', 'mp-1584242', 'mp-1054026']",0.00068425,"{'Lu': 10.0, 'Rh': 6.0}",350.78475389791714,[],NM,False,193,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.901252790474044e-06,0.00068425,0,0.0013685,MP,data/source/MP/cleaned/cifs/MP-mp-865778.cif,True,,data/final/MP/graphs/Lu2Rh1-MP-mp-865778-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ba6C60,1,0.0,1.0,True,Ba6C60,Ba6C60,7.0,Carbon,True,Ba9.091C90.909,Ba-C,2,Supercon,Ba6C60,MP-mp-18027,Ba6C60,Ba-C,Ba9.091C90.909,I m -3,cubic,9.793148632170988,9.79314863,9.79314863,data/final/MP/cifs/Ba6C60-MP-mp-18027.cif,data/source/MP/raw/cifs/mp-18027.cif,mp-18027,0.1988000000000003,,2014-02-15 01:25:42,3.547489391670509,10.17188/1192841,"@misc{osti_1192841,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BaC10 (SG:204) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1192841"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-931814'}},0.2236516410606075,5.64797329,520.0,-553.94501339,-8.393106263484848,{'tags': ['Barium carbon (1/10)']},-553.94501339,-8.393106263484848,0.16932808469697,"['xas', 'bandstructure']",True,[70062],True,2021-05-12 10:56:55.092000,NM,66,6,mp-18027,,BaC10,"{'functional': 'PBE', 'labels': ['Ba_sv', 'C'], 'pot_type': 'paw'}","{'Ba': 1.0, 'C': 10.0}",GGA,mp-18027,"['mp-931814', 'mp-937286', 'mp-916557', 'mp-18027', 'mp-1357016', 'mp-1887474']",0.0001431666666666,"{'Ba': 6.0, 'C': 60.0}",723.0114036278567,[],NM,False,204,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.188086378291951e-06,0.0001431666666666,0,0.000859,MP,data/source/MP/cleaned/cifs/MP-mp-18027.cif,False,,data/final/MP/graphs/Ba6C60-MP-mp-18027.json,0,True,m-3,2,0,0,0,0,0,0,0,0,1,0,1.0,False
Cu2Ho2O5,1,0.0,4.0,False,Cu8Ho8O20,Cu8Ho8O20,0.0,Cuprate,True,Cu22.222Ho22.222O55.55555555555556,Cu-Ho-O,3,Supercon,Ho2Cu2O5,MP-mp-5029,Ho8Cu8O20,Cu-Ho-O,Cu22.222Ho22.222O55.55555555555556,P n a 21,orthorhombic,3.509629,10.881074,12.517264,data/final/MP/cifs/Cu2Ho2O5-MP-mp-5029.cif,data/source/MP/raw/cifs/mp-5029.cif,mp-5029,0.4991000000000003,,2011-05-24 03:54:48,7.46105529317365,10.17188/1208580,"@misc{osti_1208580,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ho2Cu2O5 (SG:33) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208580"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1754186'}},0.0456732523611052,3.36699651,520.0,-248.78598007,-6.910721668611111,{'tags': ['Diholmium dicopper oxide']},-248.78598007,-6.910721668611111,-2.6142732125,"['diel', 'xas', 'bandstructure', 'piezo']",True,"[79428, 1063, 69330]",True,2021-05-12 10:56:41.337000,FM,36,9,mp-5029,oxide,Ho2Cu2O5,"{'functional': 'PBE', 'labels': ['Ho_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ho': 2.0, 'Cu': 2.0, 'O': 5.0}",GGA,mp-5029,"['mp-683243', 'mp-703092', 'mp-713468', 'mp-5029', 'mp-1116366', 'mp-1396502', 'mp-1754186', 'mp-1821342', 'mp-1621076']",2.0007463,"{'Ho': 8.0, 'Cu': 8.0, 'O': 20.0}",478.0159476006468,[],FM,True,33,2,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.6, 0.6, 0.6, 0.6, 0.6, 0.6, 0.6, 0.6, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0167420882925981,2.0007463,8,8.0029852,MP,data/source/MP/cleaned/cifs/MP-mp-5029.cif,False,,data/final/MP/graphs/Cu2Ho2O5-MP-mp-5029.json,0,True,mm2,0,0,0,6,0,0,0,1,0,0,0,1.0,False
Mo6S8,1,0.0,1.0,True,Mo6S8,Mo6S8,1.8,Chevrel,True,Mo42.857S57.143,Mo-S,2,Supercon,Mo6S8,MP-mp-2164,Mo6S8,Mo-S,Mo42.857S57.143,R -3,trigonal,6.49357983,6.49357983,6.49357997,data/final/MP/cifs/Mo6S8-MP-mp-2164.cif,data/source/MP/raw/cifs/mp-2164.cif,mp-2164,0.0,,2011-05-15 06:01:36,5.050765740431783,10.17188/1197073,"@misc{osti_1197073,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Mo3S4 (SG:148) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197073"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700726'}},0.0648105707142852,5.22778611,520.0,-107.65280343,-7.689485959285714,"{'tags': ['Molybdenum sulfide (3/4)', 'Molydenum sulfide (3/4)', 'Molybdenum(II/III) sulfide (3/4)', 'Molybdenum sulfide (6/8)']}",-107.65280343,-7.689485959285714,-0.9650961653571428,"['xas', 'bandstructure']",True,"[252376, 42133, 600385, 76372, 644244, 644262, 644266, 603588, 201579]",True,2021-05-12 10:56:59.077000,NM,14,16,mp-2164,,Mo3S4,"{'functional': 'PBE', 'labels': ['Mo_pv', 'S'], 'pot_type': 'paw'}","{'Mo': 3.0, 'S': 4.0}",GGA,mp-2164,"['mp-925217', 'mp-850066', 'mp-870719', 'mp-909518', 'mp-871033', 'mp-924649', 'mp-2164', 'mp-1096550', 'mp-1103399', 'mp-1104098', 'mp-1104740', 'mp-1237039', 'mp-1475537', 'mp-1700726', 'mp-871212', 'mp-1600999']",5.605e-05,"{'Mo': 6.0, 'S': 8.0}",273.58904781509915,[],NM,False,148,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.09738624024749e-07,5.605e-05,0,0.0001121,MP,data/source/MP/cleaned/cifs/MP-mp-2164.cif,False,,data/final/MP/graphs/Mo6S8-MP-mp-2164.json,0,True,-3,0,0,0,0,0,0,2,1,0,0,0,1.0,False
Li1.035Ti1.965O4,2,0.0099999999999999,2.0,False,Li2.07Ti3.93O8,Li2Ti4O8,11.75,Oxide,True,Li14.786Ti28.071O57.142857142857146,Li-Ti-O,3,Supercon,Li1.035Ti1.965O4,MP-mp-5670,Li2Ti4O8,Li-Ti-O,Li14.286Ti28.571O57.142857142857146,F d -3 m,cubic,5.986032260000001,5.98603226,5.98603226,data/final/MP/cifs/Li1.035Ti1.965O4-MP-mp-5670-synth_doped.cif,data/source/MP/raw/cifs/mp-5670.cif,mp-5670,0.0,,2011-05-14 11:10:22,3.649565337909552,10.17188/1273637,"@misc{osti_1273637,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LiTi2O4 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1273637"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699404'}},0.0,5.03116805,520.0,-114.93444733,-8.209603380714286,"{'tags': ['Lithium titanium oxide (1/2/4)', 'Lithium titanium(III) titanium(IV) oxide', 'Lithium titanium(III) titanium oxide', 'Lithium titanium titanium(III) oxide', 'Lithium titano(III)titanate', 'Spinel-(Li,Ti)']}",-114.93444733,-8.209603380714286,-3.2462103921428564,"['bandstructure', 'elasticity']",True,"[72859, 78482, 154982, 81329, 15789, 48127]",True,2021-05-12 10:56:22.739000,NM,14,7,mp-5670,oxide,LiTi2O4,"{'functional': 'PBE', 'labels': ['Li_sv', 'Ti_pv', 'O'], 'pot_type': 'paw'}","{'Li': 1.0, 'Ti': 2.0, 'O': 4.0}",GGA,mp-5670,"['mp-923613', 'mp-922835', 'mp-908534', 'mp-5670', 'mp-1418091', 'mp-1699404', 'mp-1787951']",0.0521081,"{'Li': 2.0, 'Ti': 4.0, 'O': 8.0}",151.67086379131675,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0006871207652868,0.0521081,0,0.1042162,MP,data/source/MP/cleaned/cifs/MP-mp-5670.cif,True,,data/final/MP/graphs/Li1.035Ti1.965O4-MP-mp-5670-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Hg3Zr1,1,0.0,1.0,True,Hg3Zr1,Hg3Zr1,3.28,Other,True,Hg75Zr25,Hg-Zr,2,Supercon,Hg3Zr1,MP-mp-1608,Zr1Hg3,Hg-Zr,Hg75Zr25,P m -3 m,cubic,4.459485,4.459485,4.459485,data/final/MP/cifs/Hg3Zr1-MP-mp-1608.cif,data/source/MP/raw/cifs/mp-1608.cif,mp-1608,0.0,,2011-05-13 02:00:19,12.975510383240808,10.17188/1191551,"@misc{osti_1191551,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrHg3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191551"",
    place = ""United States"",
    year = ""2015"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677702'}},0.018704225,3.71267101,520.0,-9.72332533,-2.4308313325,{'tags': ['Mercury zirconium (3/1)']},-9.72332533,-2.4308313325,-0.06614590125,"['xas', 'elasticity', 'bandstructure']",True,"[639314, 104376]",True,2021-05-12 10:56:12.755000,NM,4,8,mp-1608,,ZrHg3,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Hg'], 'pot_type': 'paw'}","{'Zr': 1.0, 'Hg': 3.0}",GGA,mp-1608,"['mp-941865', 'mp-941715', 'mp-935018', 'mp-1608', 'mp-1437552', 'mp-1677702', 'mp-1799687', 'mp-1595454']",0.0038662,"{'Zr': 1.0, 'Hg': 3.0}",88.68580702657391,[],NM,False,221,0,"[0, 0, 0, 0]",4.3594348742200967e-05,0.0038662,0,0.0038662,MP,data/source/MP/cleaned/cifs/MP-mp-1608.cif,False,,data/final/MP/graphs/Hg3Zr1-MP-mp-1608.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Cd1O1,1,0.0,1.0,True,Cd1O1,Cd1O1,0.0,Oxide,True,Cd50O50,Cd-O,2,Supercon,Cd1O1,MP-mp-1132,Cd1O1,Cd-O,Cd50O50,F m -3 m,cubic,3.38258671,3.38258671,3.38258671,data/final/MP/cifs/Cd1O1-MP-mp-1132.cif,data/source/MP/raw/cifs/mp-1132.cif,mp-1132,0.0,,2011-05-12 18:13:54,7.791435499806187,10.17188/1187736,"@misc{osti_1187736,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CdO (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187736"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686745'}},0.0,1.51531362,520.0,-7.91327389,-3.956636945,"{'tags': ['Cadmium oxide', 'Cadmium oxide (1/1)', 'Monteponite', 'Monteponite (In-exchanged)']}",-7.91327389,-3.956636945,-1.3647115625,"['xas', 'elasticity', 'bandstructure']",True,"[29289, 29291, 29292, 181294, 181735, 620205, 620204, 31055, 620202, 29290, 620206, 24802, 61554, 181057]",True,2021-05-12 10:56:10.715000,NM,2,9,mp-1132,oxide,CdO,"{'functional': 'PBE', 'labels': ['Cd', 'O'], 'pot_type': 'paw'}","{'Cd': 1.0, 'O': 1.0}",GGA,mp-1132,"['mp-1132', 'mp-906513', 'mp-920224', 'mp-921227', 'mp-1440904', 'mp-1686745', 'mp-1790840', 'mp-1586162', 'mp-1591418']",4e-07,"{'Cd': 1.0, 'O': 1.0}",27.36729140131324,[],NM,False,225,0,"[0, 0]",1.4615987900826958e-08,4e-07,0,4e-07,MP,data/source/MP/cleaned/cifs/MP-mp-1132.cif,False,,data/final/MP/graphs/Cd1O1-MP-mp-1132.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
As1Fe1Sm1O1,1,0.0,2.0,False,As2Fe2Sm2O2,As2Fe2Sm2O2,0.0,Ferrite,True,As25Fe25Sm25O25,As-Fe-Sm-O,4,Supercon,Sm1Fe1As1O1,MP-mp-20349,Sm2Fe2As2O2,As-Fe-Sm-O,As25Fe25Sm25O25,P 4/n m m,tetragonal,4.026492,4.026492,9.046755,data/final/MP/cifs/As1Fe1Sm1O1-MP-mp-20349.cif,data/source/MP/raw/cifs/mp-20349.cif,mp-20349,0.0,,2014-02-19 11:24:42,6.727802583283198,,,{'GGA+U': {'task_id': 'mp-1695938'}},0.3015723809374986,3.77685593,520.0,-52.73407138,-6.5917589225,{'tags': ['Samarium iron arsenic oxide (1/1/1/1)']},-52.73407138,-6.5917589225,-1.6285904237499995,"['xas', 'elasticity', 'bandstructure']",True,"[236652, 236653, 422002, 163457, 163458]",True,2021-05-12 10:56:16.728000,FM,8,10,mp-20349,oxide,SmFeAsO,"{'functional': 'PBE', 'labels': ['Sm_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Sm': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-20349,"['mp-24944', 'mp-1078897', 'mp-1079866', 'mp-1173321', 'mp-20349', 'mp-1425472', 'mp-1695938', 'mp-1772503', 'mp-1789694', 'mp-1588381']",3.75729895,"{'Sm': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",146.67176231613362,[],FM,True,129,1,"[0.0, 0.0, 3.5, 3.5, -0.0, -0.0, -0.0, -0.0]",0.0512341147425717,3.75729895,2,7.5145979,MP,data/source/MP/cleaned/cifs/MP-mp-20349.cif,False,,data/final/MP/graphs/As1Fe1Sm1O1-MP-mp-20349.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Co0.85Cu0.15Zr2,3,0.1,2.0,False,Co1.7Cu0.3Zr4,Co2Zr4,5.88,Other,True,Co28.333Cu5Zr66.667,Co-Cu-Zr,3,Supercon,Zr2Co0.85Cu0.15,MP-mp-628,Zr4Co2,Co-Zr,Co33.333Zr66.667,I 4/m c m,tetragonal,5.27792884001752,5.27792884,5.277928840000001,data/final/MP/cifs/Co0.85Cu0.15Zr2-MP-mp-628-synth_doped.cif,data/source/MP/raw/cifs/mp-628.cif,mp-628,0.0,,2011-05-13 12:16:44,7.17077101131263,10.17188/1278899,"@misc{osti_1278899,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Zr2Co (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278899"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677545'}},0.0,4.51380976,520.0,-49.95120762,-8.325201269999999,"{'tags': ['Cobalt zirconium (1/2)', 'Zirconium cobalt (2/1)']}",-49.95120762,-8.325201269999999,-0.2572949183333328,"['xas', 'elasticity', 'bandstructure']",True,"[625671, 191386, 625688, 102740, 625665]",True,2021-05-12 10:56:27.046000,NM,6,20,mp-628,,Zr2Co,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Co'], 'pot_type': 'paw'}","{'Zr': 2.0, 'Co': 1.0}",GGA,mp-628,"['mp-928347', 'mp-912327', 'mp-928866', 'mp-628', 'mp-1071352', 'mp-1071381', 'mp-1071431', 'mp-1071762', 'mp-1071803', 'mp-1071859', 'mp-1071883', 'mp-1071742', 'mp-1071925', 'mp-1441633', 'mp-1677545', 'mp-1802810', 'mp-1591799', 'mp-1071792', 'mp-1071416', 'mp-1071915']",0.0001226,"{'Zr': 4.0, 'Co': 2.0}",111.79353060019714,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0]",2.1933290654975308e-06,0.0001226,0,0.0002452,MP,data/source/MP/cleaned/cifs/MP-mp-628.cif,True,,data/final/MP/graphs/Co0.85Cu0.15Zr2-MP-mp-628-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ba2Ca0.9Cu2Nd0.1Tl1O7,2,0.0153846153846153,1.0,True,Ba2Ca0.9Cu2Nd0.1Tl1O7,Ba2Ca1Cu2Tl1O7,90.8,Cuprate,True,Ba15.385Ca6.923Cu15.385Nd0.769Tl7.692O53.84615384615385,Ba-Ca-Cu-Nd-Tl-O,6,Supercon,Tl1Ba2Ca0.9Nd0.1Cu2O7,MP-mp-632802,Ba2Ca1Tl1Cu2O7,Ba-Ca-Cu-Tl-O,Ba15.385Ca7.692Cu15.385Tl7.692O53.84615384615385,P 4/m m m,tetragonal,3.840502,3.840502,13.048748,data/final/MP/cifs/Ba2Ca0.9Cu2Nd0.1Tl1O7-MP-mp-632802-synth_doped.cif,data/source/MP/raw/cifs/mp-632802.cif,mp-632802,0.0,,2013-06-21 12:28:47,6.541687864051921,10.17188/1279349,"@misc{osti_1279349,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2CaTlCu2O7 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1279349"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1742071'}},0.0444125982158123,2.89241018,520.0,-71.95529719,-5.535022860769231,{'tags': ['Thallium(III) calcium barium copper oxide (1/1/2/2/7)']},-71.95529719,-5.535022860769231,-1.978767086794871,"['xas', 'bandstructure']",True,[67128],True,2021-05-12 10:57:30.779000,NM,13,10,mp-632802,oxide,Ba2CaTlCu2O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ca_sv', 'Tl_d', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Ca': 1.0, 'Tl': 1.0, 'Cu': 2.0, 'O': 7.0}",GGA,mp-632802,"['mp-699409', 'mp-632802', 'mp-732256', 'mp-743134', 'mp-1182322', 'mp-1394572', 'mp-1742071', 'mp-1785618', 'mp-1654627', 'mp-749845']",0.0282595,"{'Ba': 2.0, 'Ca': 1.0, 'Tl': 1.0, 'Cu': 2.0, 'O': 7.0}",192.461929418226,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.000146831636186,0.0282595,0,0.0282595,MP,data/source/MP/cleaned/cifs/MP-mp-632802.cif,True,,data/final/MP/graphs/Ba2Ca0.9Cu2Nd0.1Tl1O7-MP-mp-632802-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ge12.5Si12.5V75,1,0.0,0.08,False,Ge1Si1V6,Ge1Si1V6,8.58,Other,True,Ge12.5Si12.5V75,Ge-Si-V,3,Supercon,V75Si12.5Ge12.5,MP-mp-1216453,V6Si1Ge1,Ge-Si-V,Ge12.5Si12.5V75,P m -3,cubic,4.734388,4.734388,4.734388,data/final/MP/cifs/Ge12.5Si12.5V75-MP-mp-1216453.cif,data/source/MP/raw/cifs/mp-1216453.cif,mp-1216453,0.0,,2019-01-12 17:57:35.454000,6.358929418376749,,,{'GGA': {'task_id': 'mp-1754998'}},0.0,7.11494476,520.0,-67.7541736,-8.4692717,{'tags': []},-67.7541736,-8.4692717,-0.4002994131249995,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,FM,8,5,mp-1216453,,V6SiGe,"{'functional': 'PBE', 'labels': ['V_pv', 'Si', 'Ge_d'], 'pot_type': 'paw'}","{'V': 6.0, 'Si': 1.0, 'Ge': 1.0}",GGA,mp-1216453,"['mp-1216453', 'mp-1400373', 'mp-1754998', 'mp-1939394', 'mp-1621955']",1.2825662,"{'V': 6.0, 'Si': 1.0, 'Ge': 1.0}",106.1186071620683,[],FM,True,47,1,"[0.1, 0.2, 0.2, 0.1, 0.2, 0.2, 0.0, 0.0]",0.0120861575014946,1.2825662,6,1.2825662,MP,data/source/MP/cleaned/cifs/MP-mp-1216453.cif,False,,data/final/MP/graphs/Ge12.5Si12.5V75-MP-mp-1216453.json,0,True,m-3,2,0,0,0,0,0,0,1,0,0,0,1.0,False
Os0.232Re0.768,2,0.036,8.0,False,Os1.856Re6.144,Os2Re6,1.67,Other,True,Os23.2Re76.8,Os-Re,2,Supercon,Os0.232Re0.768,MP-mp-867264,Re6Os2,Os-Re,Os25Re75,P 63/m m c,hexagonal,4.438103,5.564941999181245,5.56494101,data/final/MP/cifs/Os0.232Re0.768-MP-mp-867264-synth_doped.cif,data/source/MP/raw/cifs/mp-867264.cif,mp-867264,0.0,,2014-10-15 20:53:17,20.894179274689,10.17188/1311932,"@misc{osti_1311932,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Re3Os (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1311932"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1722178'}},0.0,7.53498815,520.0,-97.59450991,-12.19931373875,{'tags': []},-97.59450991,-12.19931373875,-0.0590767862499994,"['xas', 'bandstructure']",True,[],True,2021-05-12 10:57:53.781000,NM,8,8,mp-867264,,Re3Os,"{'functional': 'PBE', 'labels': ['Re_pv', 'Os_pv'], 'pot_type': 'paw'}","{'Re': 3.0, 'Os': 1.0}",GGA,mp-867264,"['mp-867264', 'mp-1055142', 'mp-1055120', 'mp-1401307', 'mp-1722178', 'mp-1803075', 'mp-1618512', 'mp-1055143']",5.15e-06,"{'Re': 6.0, 'Os': 2.0}",119.0280148566386,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",8.65342500452996e-08,5.15e-06,0,1.03e-05,MP,data/source/MP/cleaned/cifs/MP-mp-867264.cif,True,,data/final/MP/graphs/Os0.232Re0.768-MP-mp-867264-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Co0.975Mo0.025U1,2,0.025,4.0,False,Co3.9Mo0.1U4,Co4U4,0.0,Heavy_fermion,True,Co48.75Mo1.25U50,Co-Mo-U,3,Supercon,Co0.975Mo0.025U1,MP-mp-1080107,U4Co4,Co-U,Co50U50,I 21 3,cubic,5.46651343121184,5.466513429999999,5.466513429999999,data/final/MP/cifs/Co0.975Mo0.025U1-MP-mp-1080107-synth_doped.cif,data/source/MP/raw/cifs/mp-1080107.cif,mp-1080107,0.0,,2018-04-17 12:54:58,15.685586226920387,,,{'GGA': {'task_id': 'mp-1702457'}},0.0,11.55343047,520.0,-75.74461929,-9.46807741125,"{'tags': ['Uranium cobalt (1/1)', 'Cobalt uranium (1/1)', 'UCo', 'b.c.c. atom arrangement']}",-75.74461929,-9.46807741125,-0.2682135087500015,['bandstructure'],True,"[625521, 102712]",True,2021-05-12 10:58:16.596000,NM,8,6,mp-1080107,,UCo,"{'functional': 'PBE', 'labels': ['U', 'Co'], 'pot_type': 'paw'}","{'U': 1.0, 'Co': 1.0}",GGA,mp-1080107,"['mp-1080107', 'mp-1084836', 'mp-1432219', 'mp-1702457', 'mp-1785261', 'mp-1596640']",4.08e-05,"{'U': 4.0, 'Co': 4.0}",125.75039772653412,[],NM,False,199,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.297809016516246e-06,4.08e-05,0,0.0001632,MP,data/source/MP/cleaned/cifs/MP-mp-1080107.cif,True,,data/final/MP/graphs/Co0.975Mo0.025U1-MP-mp-1080107-synth_doped.json,0,True,23,1,0,0,0,0,0,0,0,0,1,0,1.0,False
Ba2Cu1Hg1O4.049,2,0.006087712759349,0.9879745616201532,True,Ba1.976Cu0.988Hg0.988O4,Ba2Cu1Hg1O4,70.0,Cuprate,True,Ba24.848Cu12.424Hg12.424O50.30438563796746,Ba-Cu-Hg-O,4,Supercon,Hg1Ba2Cu1O4.049,MP-mp-6562,Ba2Cu1Hg1O4,Ba-Cu-Hg-O,Ba25Cu12.5Hg12.5O50,P 4/m m m,tetragonal,3.933714,3.933714,9.827602,data/final/MP/cifs/Ba2Cu1Hg1O4.049-MP-mp-6562-synth_doped.cif,data/source/MP/raw/cifs/mp-6562.cif,mp-6562,0.0,,2011-05-13 18:18:06,6.582036471328142,10.17188/1281336,"@misc{osti_1281336,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2CuHgO4 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281336"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697135'}},0.0234340381250053,2.58068675,520.0,-40.91481298,-5.1143516225,"{'tags': ['Mercury dibarium copper oxide', 'High pressure experimental phase']}",-40.91481298,-5.1143516225,-1.953767533125,"['xas', 'bandstructure']",True,"[75722, 75720, 75724, 75721, 75723]",True,2021-05-12 10:57:32.679000,NM,8,8,mp-6562,oxide,Ba2CuHgO4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Cu_pv', 'Hg', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",GGA,mp-6562,"['mp-6562', 'mp-990899', 'mp-992892', 'mp-1435690', 'mp-1697135', 'mp-1878488', 'mp-994198', 'mp-1592659']",0.0003984,"{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",152.07335344042525,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0, 0, 0]",2.619788352047311e-06,0.0003984,0,0.0003984,MP,data/source/MP/cleaned/cifs/MP-mp-6562.cif,True,,data/final/MP/graphs/Ba2Cu1Hg1O4.049-MP-mp-6562-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ba1.926Ca0.074Cu4Y1O8,2,0.0098666666666666,1.0,True,Ba1.926Ca0.074Cu4Y1O8,Ba2Cu4Y1O8,83.3,Cuprate,True,Ba12.84Ca0.493Cu26.667Y6.667O53.333333333333336,Ba-Ca-Cu-Y-O,5,Supercon,Y1Ba1.926Ca0.074Cu4O8,MP-mp-6790,Ba2Y1Cu4O8,Ba-Cu-Y-O,Ba13.333Cu26.667Y6.667O53.333333333333336,C m m m,orthorhombic,3.889922,3.899603999537882,13.88942687,data/final/MP/cifs/Ba1.926Ca0.074Cu4Y1O8-MP-mp-6790-synth_doped.cif,data/source/MP/raw/cifs/mp-6790.cif,mp-6790,0.0,,2011-05-16 03:21:24,5.936250568336678,10.17188/1283441,"@misc{osti_1283441,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Y(CuO2)4 (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1283441"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686864'}},0.0,3.31391536,520.0,-91.58381472,-6.105587648,"{'tags': ['Yttrium barium copper oxide (1/2/4/8)', 'High pressure experimental phase']}",-91.58381472,-6.105587648,-2.0529924817777783,"['xas', 'bandstructure']",True,"[72261, 85273, 74251, 400273, 85277, 85275, 400280, 67632, 85272, 67631, 83920, 66613, 85279, 400277, 75689, 74259, 85278, 85280, 66603, 94265, 400276, 88873, 71417, 75712, 97052, 66605, 72258, 85281, 85274, 400279, 66604, 69698]",True,2021-05-12 10:57:34.594000,NM,15,10,mp-6790,oxide,Ba2Y(CuO2)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-6790,"['mp-1000664', 'mp-6790', 'mp-1007136', 'mp-1237713', 'mp-1440937', 'mp-1686864', 'mp-1834179', 'mp-1011883', 'mp-1590064', 'mp-1590433']",0.0004643,"{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",208.60454115924333,[],NM,False,65,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.225742533790601e-06,0.0004643,0,0.0004643,MP,data/source/MP/cleaned/cifs/MP-mp-6790.cif,True,,data/final/MP/graphs/Ba1.926Ca0.074Cu4Y1O8-MP-mp-6790-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Co1.98Cr0.02Cu1S4,2,0.0057142857142857,2.0,False,Co3.96Cr0.04Cu2S8,Co4Cu2S8,3.4,Other,True,Co28.286Cr0.286Cu14.286S57.143,Co-Cr-Cu-S,4,Supercon,Cu1Co1.98Cr0.02S4,MP-mp-3925,Co4Cu2S8,Co-Cu-S,Co28.571Cu14.286S57.143,F d -3 m,cubic,6.69987918,6.699879179999999,6.699879179999999,data/final/MP/cifs/Co1.98Cr0.02Cu1S4-MP-mp-3925-synth_doped.cif,data/source/MP/raw/cifs/mp-3925.cif,mp-3925,0.0,,2011-05-15 03:07:38,4.836104359598833,10.17188/1207634,"@misc{osti_1207634,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Co2CuS4 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207634"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698326'}},0.0,5.68331854,520.0,-75.59837827,-5.399884162142857,"{'tags': ['Cobalt copper sulfide (2/1/4)', 'Carrollite', 'Dicobalt(III) copper sulfide']}",-75.59837827,-5.399884162142857,-0.7070782010714284,"['xas', 'bandstructure']",True,"[622571, 31107, 52943]",True,2021-05-12 10:57:08.928000,NM,14,8,mp-3925,,Co2CuS4,"{'functional': 'PBE', 'labels': ['Co', 'Cu_pv', 'S'], 'pot_type': 'paw'}","{'Co': 2.0, 'Cu': 1.0, 'S': 4.0}",GGA,mp-3925,"['mp-931396', 'mp-915858', 'mp-932359', 'mp-3925', 'mp-1425952', 'mp-1698326', 'mp-1833413', 'mp-1599756']",0.00593025,"{'Co': 4.0, 'Cu': 2.0, 'S': 8.0}",212.6600516474575,[],NM,False,227,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",5.5772110972972206e-05,0.00593025,0,0.0118605,MP,data/source/MP/cleaned/cifs/MP-mp-3925.cif,True,,data/final/MP/graphs/Co1.98Cr0.02Cu1S4-MP-mp-3925-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Bi2Ca0.8Ce0.2Cu2Sr2O8,3,0.0266666666666666,2.0,False,Bi4Ca1.6Ce0.4Cu4Sr4O16,Bi4Ca2Cu4Sr4O16,17.0,Cuprate,True,Bi13.333Ca5.333Ce1.333Cu13.333Sr13.333O53.333333333333336,Bi-Ca-Ce-Cu-Sr-O,6,Supercon,Bi2Sr2Ca0.8Ce0.2Cu2O8,MP-mp-1218930,Sr4Ca2Cu4Bi4O16,Bi-Ca-Cu-Sr-O,Bi13.333Ca6.667Cu13.333Sr13.333O53.333333333333336,C c c 2,orthorhombic,5.417115,5.472898000129128,16.11398919,data/final/MP/cifs/Bi2Ca0.8Ce0.2Cu2Sr2O8-MP-mp-1218930-synth_doped.cif,data/source/MP/raw/cifs/mp-1218930.cif,mp-1218930,0.0,,2019-01-12 20:01:06.544000,6.266668983881059,,,,0.039252223722225,4.51768334,520.0,-173.15021002,-5.771673667333333,{'tags': []},-173.15021002,-5.771673667333333,-2.074956548222222,[],False,[],True,2021-05-12 11:00:42.526000,NM,30,3,mp-1218930,oxide,Sr2CaCu2(BiO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",GGA,mp-1218930,"['mp-1218930', 'mp-1359698', 'mp-1817714']",0.00011165,"{'Sr': 4.0, 'Ca': 2.0, 'Cu': 4.0, 'Bi': 4.0, 'O': 16.0}",470.7976286073367,[],NM,False,37,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.743014544498498e-07,0.00011165,0,0.0002233,MP,data/source/MP/cleaned/cifs/MP-mp-1218930.cif,True,,data/final/MP/graphs/Bi2Ca0.8Ce0.2Cu2Sr2O8-MP-mp-1218930-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Cu1La1,1,0.0,4.0,False,Cu4La4,Cu4La4,6.0,Other,True,Cu50La50,Cu-La,2,Supercon,Cu1La1,MP-mp-1078920,La4Cu4,Cu-La,Cu50La50,P n m a,orthorhombic,4.729398,5.697523,7.43787,data/final/MP/cifs/Cu1La1-MP-mp-1078920.cif,data/source/MP/raw/cifs/mp-1078920.cif,mp-1078920,0.0,,2018-04-13 12:02:04,6.70948968371372,,,{'GGA': {'task_id': 'mp-1677335'}},0.0,7.47094242,520.0,-37.48821612,-4.686027015,"{'tags': ['CuLa', 'FeB-b', 'Copper lanthanum (1/1)']}",-37.48821612,-4.686027015,-0.1684201275000001,['bandstructure'],True,[628213],True,2021-05-12 10:58:16.596000,NM,8,6,mp-1078920,,LaCu,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv'], 'pot_type': 'paw'}","{'La': 1.0, 'Cu': 1.0}",GGA,mp-1078920,"['mp-1078920', 'mp-1237013', 'mp-1300788', 'mp-1677335', 'mp-1830275', 'mp-1602020']",0.000238,"{'La': 4.0, 'Cu': 4.0}",200.4197582070189,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0]",4.750030678196178e-06,0.000238,0,0.000952,MP,data/source/MP/cleaned/cifs/MP-mp-1078920.cif,False,,data/final/MP/graphs/Cu1La1-MP-mp-1078920.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Sn1Y2,3,0.0833333333333333,5.0,False,Sn5Y10,Sn6Y10,0.0,Other,True,Sn33.333Y66.667,Sn-Y,2,Supercon,Sn1Y2,MP-mp-567412,Y10Sn6,Sn-Y,Sn37.5Y62.5,P 63/m c m,hexagonal,6.583425,8.983593997716387,8.98359346,data/final/MP/cifs/Sn1Y2-MP-mp-567412-synth_doped.cif,data/source/MP/raw/cifs/mp-567412.cif,mp-567412,0.0,,2014-02-24 18:25:12,5.778885589240009,10.17188/1273858,"@misc{osti_1273858,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Y5Sn3 (SG:193) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1273858"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1709092'}},0.0,5.08684958,520.0,-101.04302832,-6.31518927,"{'tags': ['Tin yttrium (3/5)', 'Yttrium stannide (5/3)']}",-101.04302832,-6.31518927,-0.7700553785416675,"['xas', 'elasticity', 'bandstructure']",True,"[106103, 652833, 652839]",True,2021-05-12 10:56:22.739000,NM,16,8,mp-567412,,Y5Sn3,"{'functional': 'PBE', 'labels': ['Y_sv', 'Sn_d'], 'pot_type': 'paw'}","{'Y': 5.0, 'Sn': 3.0}",GGA,mp-567412,"['mp-932842', 'mp-942105', 'mp-943110', 'mp-567412', 'mp-1430460', 'mp-1709092', 'mp-1815565', 'mp-1607422']",0.0074451,"{'Y': 10.0, 'Sn': 6.0}",460.1323016794676,[],NM,False,193,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.2360692665242724e-05,0.0074451,0,0.0148902,MP,data/source/MP/cleaned/cifs/MP-mp-567412.cif,True,,data/final/MP/graphs/Sn1Y2-MP-mp-567412-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
C1Hf0.5Mo0.5,1,0.0,2.0,False,C2Hf1Mo1,C2Hf1Mo1,3.4,Other,True,C50Hf25Mo25,C-Hf-Mo,3,Supercon,C1Hf0.5Mo0.5,MP-mp-1224308,Hf1Mo1C2,C-Hf-Mo,C50Hf25Mo25,P 4/m m m,tetragonal,3.191423,3.191423,4.485164,data/final/MP/cifs/C1Hf0.5Mo0.5-MP-mp-1224308.cif,data/source/MP/raw/cifs/mp-1224308.cif,mp-1224308,0.0,,2019-01-13 00:34:36.643000,10.8486487735023,,,{'GGA': {'task_id': 'mp-1731761'}},0.1645484250000013,8.0655483,520.0,-40.64760783,-10.1619019575,{'tags': []},-40.64760783,-10.1619019575,-0.3478036375000002,['bandstructure'],True,[],True,2021-05-12 10:58:45.495000,NM,4,5,mp-1224308,,HfMoC2,"{'functional': 'PBE', 'labels': ['Hf_pv', 'Mo_pv', 'C'], 'pot_type': 'paw'}","{'Hf': 1.0, 'Mo': 1.0, 'C': 2.0}",GGA,mp-1224308,"['mp-1224308', 'mp-1433245', 'mp-1731761', 'mp-1791876', 'mp-1612057']",7.69e-05,"{'Hf': 1.0, 'Mo': 1.0, 'C': 2.0}",45.68220610035201,[],NM,False,123,0,"[0, 0, 0, 0]",1.683368789831878e-06,7.69e-05,0,7.69e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1224308.cif,False,,data/final/MP/graphs/C1Hf0.5Mo0.5-MP-mp-1224308.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Hg1,1,0.0,2.0,False,Hg2,Hg2,4.1366,Other,True,Hg100,Hg,1,Supercon,Hg1,MP-mp-1184554,Hg2,Hg,Hg100,P 63/m m c,hexagonal,3.5798439963499664,3.57984413,5.73471,data/final/MP/cifs/Hg1-MP-mp-1184554.cif,data/source/MP/raw/cifs/mp-1184554.cif,mp-1184554,0.307,,2019-01-11 12:52:56.924000,10.466899494409136,,,{'GGA': {'task_id': 'mp-1764896'}},0.0,0.08174203,520.0,-0.60736073,-0.303680365,{'tags': []},-0.60736073,-0.303680365,0.0,"['bandstructure', 'surfaces']",True,[],True,2021-05-12 10:58:27.755000,NM,2,6,mp-1184554,,Hg,"{'functional': 'PBE', 'labels': ['Hg'], 'pot_type': 'paw'}",{'Hg': 1.0},GGA,mp-1184554,"['mp-1184554', 'mp-1430642', 'mp-1764896', 'mp-1782821', 'mp-1881189', 'mp-1630404']",0.0029249,{'Hg': 2.0},63.645883204899725,[],NM,False,194,0,"[0, 0]",9.191167920739384e-05,0.0029249,0,0.0058498,MP,data/source/MP/cleaned/cifs/MP-mp-1184554.cif,False,,data/final/MP/graphs/Hg1-MP-mp-1184554.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
B6La0.1Y0.9,2,0.0285714285714285,1.0,True,B6La0.1Y0.9,B6Y1,6.8,Other,True,B85.714La1.429Y12.857,B-La-Y,3,Supercon,Y0.9La0.1B6,MP-mp-2203,Y1B6,B-Y,B85.714Y14.286,P m -3 m,cubic,4.1021,4.1021,4.1021,data/final/MP/cifs/B6La0.1Y0.9-MP-mp-2203-synth_doped.cif,data/source/MP/raw/cifs/mp-2203.cif,mp-2203,0.0,,2011-05-12 20:11:15,3.699194842606093,10.17188/1197299,"@misc{osti_1197299,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YB6 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197299"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686414'}},0.0285229421428576,6.62579631,520.0,-49.33978236,-7.048540337142858,"{'tags': ['Yttrium boride (1/6)', 'Yttrium octahedro-hexaboride', 'Yttrium hexaboride']}",-49.33978236,-7.048540337142858,-0.3995658030952376,"['xas', 'elasticity', 'bandstructure']",True,"[194635, 615723, 54730, 615726, 615714, 659505, 76126, 615728, 615710]",True,2021-05-12 10:56:16.728000,NM,7,9,mp-2203,,YB6,"{'functional': 'PBE', 'labels': ['Y_sv', 'B'], 'pot_type': 'paw'}","{'Y': 1.0, 'B': 6.0}",GGA,mp-2203,"['mp-1000404', 'mp-1006875', 'mp-2203', 'mp-1077859', 'mp-1440131', 'mp-1686414', 'mp-1801281', 'mp-1011609', 'mp-1592923']",3.48e-05,"{'Y': 1.0, 'B': 6.0}",69.026957252261,[],NM,False,221,0,"[0, 0, 0, 0, 0, 0, 0]",5.041508620005138e-07,3.48e-05,0,3.48e-05,MP,data/source/MP/cleaned/cifs/MP-mp-2203.cif,True,,data/final/MP/graphs/B6La0.1Y0.9-MP-mp-2203-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
As1Fe1Nd0.8Th0.2O1,3,0.0999999999999999,2.0,False,As2Fe2Nd1.6Th0.4O2,As2Fe2Nd2O2,43.0,Ferrite,True,As25Fe25Nd20Th5O25,As-Fe-Nd-Th-O,5,Supercon,Nd0.8Th0.2Fe1As1O1,MP-mp-622621,Nd2Fe2As2O2,As-Fe-Nd-O,As25Fe25Nd25O25,P 4/n m m,tetragonal,4.074653,4.074653,9.170967,data/final/MP/cifs/As1Fe1Nd0.8Th0.2O1-MP-mp-622621-synth_doped.cif,data/source/MP/raw/cifs/mp-622621.cif,mp-622621,0.0,,2014-02-16 22:28:25,6.347279619112142,10.17188/1278150,"@misc{osti_1278150,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NdFeAsO (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278150"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-1677677'}},0.2809314202083302,3.74777613,520.0,-52.70842543,-6.58855317875,{'tags': ['Neodymium iron arsenic oxide (1/1/1/1)']},-52.70842543,-6.58855317875,-1.61299541125,"['xas', 'bandstructure']",True,"[163547, 164679, 422001, 163546, 236651, 236650, 602466, 164680, 164676]",True,2021-05-12 10:57:28.836000,FM,8,8,mp-622621,oxide,NdFeAsO,"{'functional': 'PBE', 'labels': ['Nd_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Nd': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-622621,"['mp-622621', 'mp-1079381', 'mp-1173401', 'mp-1438697', 'mp-1677677', 'mp-1772072', 'mp-1926310', 'mp-1592869']",3.83954265,"{'Nd': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",152.26370404041757,[],FM,True,129,1,"[0.0, 0.0, 3.6, 3.6, -0.0, -0.0, -0.0, -0.0]",0.0504328024094411,3.83954265,2,7.6790853,MP,data/source/MP/cleaned/cifs/MP-mp-622621.cif,True,,data/final/MP/graphs/As1Fe1Nd0.8Th0.2O1-MP-mp-622621-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ni0.02S2Ta1,3,0.1406011207335711,4.0,False,Ni0.08S8Ta4,Ni1S8Ta4,3.325,Ferrite,True,Ni0.662S66.225Ta33.113,Ni-S-Ta,3,Supercon,Ni0.02Ta1S2,MP-mp-1218136,Ta4Ni1S8,Ni-S-Ta,Ni7.692S61.538Ta30.769,P -3 m 1,trigonal,3.369069999250622,3.36906982,24.425977,data/final/MP/cifs/Ni0.02S2Ta1-MP-mp-1218136-synth_doped.cif,data/source/MP/raw/cifs/mp-1218136.cif,mp-1218136,0.0,,2019-01-12 19:21:19.076000,7.185617374365983,,,{'GGA': {'task_id': 'mp-1746242'}},0.0414952845607894,5.36411464,520.0,-98.60879648,-7.585292036923077,{'tags': []},-98.60879648,-7.585292036923077,-1.2561500265384615,[],False,[],True,2021-05-12 11:00:42.526000,FM,13,4,mp-1218136,,Ta4NiS8,"{'functional': 'PBE', 'labels': ['Ta_pv', 'Ni_pv', 'S'], 'pot_type': 'paw'}","{'Ta': 4.0, 'Ni': 1.0, 'S': 8.0}",GGA,mp-1218136,"['mp-1218136', 'mp-1395464', 'mp-1746242', 'mp-1876649']",0.5894077,"{'Ta': 4.0, 'Ni': 1.0, 'S': 8.0}",240.1057793870966,[],FM,True,164,1,"[0.0, 0.0, 0.0, 0.0, 0.5, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.002454783477118,0.5894077,1,0.5894077,MP,data/source/MP/cleaned/cifs/MP-mp-1218136.cif,True,,data/final/MP/graphs/Ni0.02S2Ta1-MP-mp-1218136-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ba2Ca0.7Cu2Gd0.3Tl1O7,3,0.0461538461538461,1.0,True,Ba2Ca0.7Cu2Gd0.3Tl1O7,Ba2Ca1Cu2Tl1O7,81.25,Cuprate,True,Ba15.385Ca5.385Cu15.385Gd2.308Tl7.692O53.84615384615385,Ba-Ca-Cu-Gd-Tl-O,6,Supercon,Tl1Ba2Ca0.7Gd0.3Cu2O7,MP-mp-632802,Ba2Ca1Tl1Cu2O7,Ba-Ca-Cu-Tl-O,Ba15.385Ca7.692Cu15.385Tl7.692O53.84615384615385,P 4/m m m,tetragonal,3.840502,3.840502,13.048748,data/final/MP/cifs/Ba2Ca0.7Cu2Gd0.3Tl1O7-MP-mp-632802-synth_doped.cif,data/source/MP/raw/cifs/mp-632802.cif,mp-632802,0.0,,2013-06-21 12:28:47,6.541687864051921,10.17188/1279349,"@misc{osti_1279349,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2CaTlCu2O7 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1279349"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1742071'}},0.0444125982158123,2.89241018,520.0,-71.95529719,-5.535022860769231,{'tags': ['Thallium(III) calcium barium copper oxide (1/1/2/2/7)']},-71.95529719,-5.535022860769231,-1.978767086794871,"['xas', 'bandstructure']",True,[67128],True,2021-05-12 10:57:30.779000,NM,13,10,mp-632802,oxide,Ba2CaTlCu2O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ca_sv', 'Tl_d', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Ca': 1.0, 'Tl': 1.0, 'Cu': 2.0, 'O': 7.0}",GGA,mp-632802,"['mp-699409', 'mp-632802', 'mp-732256', 'mp-743134', 'mp-1182322', 'mp-1394572', 'mp-1742071', 'mp-1785618', 'mp-1654627', 'mp-749845']",0.0282595,"{'Ba': 2.0, 'Ca': 1.0, 'Tl': 1.0, 'Cu': 2.0, 'O': 7.0}",192.461929418226,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.000146831636186,0.0282595,0,0.0282595,MP,data/source/MP/cleaned/cifs/MP-mp-632802.cif,True,,data/final/MP/graphs/Ba2Ca0.7Cu2Gd0.3Tl1O7-MP-mp-632802-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ru0.3Si1V2.7,3,0.1499999999999999,2.0,False,Ru0.6Si2V5.4,Si2V6,2.9,Other,True,Ru7.5Si25V67.5,Ru-Si-V,3,Supercon,Si1V2.7Ru0.3,MP-mp-2567,V6Si2,Si-V,Si25V75,P m -3 n,cubic,4.702381,4.702381,4.702381,data/final/MP/cifs/Ru0.3Si1V2.7-MP-mp-2567-synth_doped.cif,data/source/MP/raw/cifs/mp-2567.cif,mp-2567,0.0,,2011-05-13 19:15:43,5.778142190030859,10.17188/1200874,"@misc{osti_1200874,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Si (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1200874"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668672'}},0.0,7.30599425,520.0,-69.05773321,-8.63221665125,{'tags': ['Vanadium silicide (3/1)']},-69.05773321,-8.63221665125,-0.4452085937499994,"['xas', 'elasticity', 'bandstructure']",True,"[652491, 87328, 652522, 652502, 652510, 652520, 600518, 186003, 652507, 652513, 652497, 601150, 652514, 652487, 22412, 652509, 652529, 652532, 652499, 652539, 652537, 652533, 652512, 652538, 652490, 652493, 652494, 652511, 652519, 87329, 652526, 652500]",True,2021-05-12 10:56:18.721000,FM,8,13,mp-2567,,V3Si,"{'functional': 'PBE', 'labels': ['V_pv', 'Si'], 'pot_type': 'paw'}","{'V': 3.0, 'Si': 1.0}",GGA,mp-2567,"['mp-920081', 'mp-906309', 'mp-919083', 'mp-2567', 'mp-1078474', 'mp-1078852', 'mp-1138781', 'mp-1145907', 'mp-1440678', 'mp-1668672', 'mp-1795955', 'mp-1593554', 'mp-1596575']",0.8382519,"{'V': 6.0, 'Si': 2.0}",103.98086881866836,[],FM,True,131,1,"[0.2, 0.3, 0.3, 0.2, 0.3, 0.3, 0.0, 0.0]",0.0161231947669493,0.8382519,6,1.6765038,MP,data/source/MP/cleaned/cifs/MP-mp-2567.cif,True,,data/final/MP/graphs/Ru0.3Si1V2.7-MP-mp-2567-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Al0.98Nb3Se0.02,2,0.01,2.0,False,Al1.96Nb6Se0.04,Al2Nb6,18.4,Other,True,Al24.5Nb75Se0.5,Al-Nb-Se,3,Supercon,Nb3Al0.98Se0.02,MP-mp-796,Nb6Al2,Al-Nb,Al25Nb75,P m -3 n,cubic,5.215254,5.215254,5.215254,data/final/MP/cifs/Al0.98Nb3Se0.02-MP-mp-796-synth_doped.cif,data/source/MP/raw/cifs/mp-796.cif,mp-796,0.0,,2011-05-13 16:07:37,7.157298025966356,,,{'GGA': {'task_id': 'mp-1686893'}},0.0460773865000003,5.52947534,520.0,-69.48918494,-8.6861481175,"{'tags': ['Aluminium niobium (1/3)', 'Niobium aluminide (3/1)', 'Aluminum niobium (1/3)']}",-69.48918494,-8.6861481175,-0.1737753800000003,"['bandstructure', 'elasticity']",True,"[608675, 608654, 608688, 608668, 608669, 608685, 608676, 608683, 58014, 608657, 107856, 608655, 608666, 608691, 608656, 608665, 608673, 608653, 608661]",True,2021-05-12 10:56:31.128000,NM,8,10,mp-796,,Nb3Al,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Al': 1.0}",GGA,mp-796,"['mp-911586', 'mp-927906', 'mp-796', 'mp-927472', 'mp-1260512', 'mp-1440919', 'mp-1686893', 'mp-1927652', 'mp-1591599', 'mp-1587739']",0.16323955,"{'Nb': 6.0, 'Al': 2.0}",141.8490379078192,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0023015954483396,0.16323955,0,0.3264791,MP,data/source/MP/cleaned/cifs/MP-mp-796.cif,True,,data/final/MP/graphs/Al0.98Nb3Se0.02-MP-mp-796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ce1Co0.71In5Rh0.29,3,0.0828571428571428,1.0,True,Ce1Co0.71In5Rh0.29,Ce1Co1In5,1.56,Heavy_fermion,True,Ce14.286Co10.143In71.429Rh4.143,Ce-Co-In-Rh,4,Supercon,Ce1Rh0.29Co0.71In5,MP-mp-19961,Ce1In5Co1,Ce-Co-In,Ce14.286Co14.286In71.429,P 4/m m m,tetragonal,4.635989,4.635989,7.564124,data/final/MP/cifs/Ce1Co0.71In5Rh0.29-MP-mp-19961-synth_doped.cif,data/source/MP/raw/cifs/mp-19961.cif,mp-19961,0.0,,2014-02-21 14:08:25,7.897022127398995,10.17188/1195145,"@misc{osti_1195145,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeIn5Co (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195145"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701944'}},0.0,7.80626318,520.0,-28.52795357,-4.075421938571429,{'tags': ['Cerium cobalt indium (1/1/5)']},-28.52795357,-4.075421938571429,-0.2468754242857146,"['xas', 'bandstructure']",True,[102108],True,2021-05-12 10:56:57.051000,FM,7,8,mp-19961,,CeIn5Co,"{'functional': 'PBE', 'labels': ['Ce', 'In_d', 'Co'], 'pot_type': 'paw'}","{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",GGA,mp-19961,"['mp-928775', 'mp-912209', 'mp-928270', 'mp-19961', 'mp-1504062', 'mp-1701944', 'mp-1785253', 'mp-1593180']",0.9310323,"{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",162.57113333428427,[],FM,True,123,1,"[0.7, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0057269226147644,0.9310323,1,0.9310323,MP,data/source/MP/cleaned/cifs/MP-mp-19961.cif,True,,data/final/MP/graphs/Ce1Co0.71In5Rh0.29-MP-mp-19961-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Os0.432Re0.568,3,0.1359999999999999,2.0,False,Os0.864Re1.136,Os1Re1,1.18,Other,True,Os43.2Re56.8,Os-Re,2,Supercon,Os0.432Re0.568,MP-mp-1219509,Re1Os1,Os-Re,Os50Re50,P -6 m 2,hexagonal,2.778262001431816,2.77826246,4.398023,data/final/MP/cifs/Os0.432Re0.568-MP-mp-1219509-synth_doped.cif,data/source/MP/raw/cifs/mp-1219509.cif,mp-1219509,0.0,,2019-01-12 20:30:11.325000,21.26213052600672,,,{'GGA': {'task_id': 'mp-1674748'}},0.0,7.9544658,520.0,-23.84358252,-11.92179126,{'tags': []},-23.84358252,-11.92179126,-0.08584454,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,2,5,mp-1219509,,ReOs,"{'functional': 'PBE', 'labels': ['Re_pv', 'Os_pv'], 'pot_type': 'paw'}","{'Re': 1.0, 'Os': 1.0}",GGA,mp-1219509,"['mp-1219509', 'mp-1421435', 'mp-1674748', 'mp-1866073', 'mp-1606835']",0.0005095,"{'Re': 1.0, 'Os': 1.0}",29.39913965108665,[],NM,False,187,0,"[0, 0]",1.733043912328121e-05,0.0005095,0,0.0005095,MP,data/source/MP/cleaned/cifs/MP-mp-1219509.cif,True,,data/final/MP/graphs/Os0.432Re0.568-MP-mp-1219509-synth_doped.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
B12Lu0.007Zr0.993,2,0.001076923076923,1.0,True,B12Lu0.007Zr0.993,B12Zr1,5.97,Other,True,B92.308Lu0.054Zr7.638,B-Lu-Zr,3,Supercon,Zr0.993Lu0.007B12,MP-mp-1084,Zr1B12,B-Zr,B92.308Zr7.692,F m -3 m,cubic,5.23882121,5.23882121,5.23882121,data/final/MP/cifs/B12Lu0.007Zr0.993-MP-mp-1084-synth_doped.cif,data/source/MP/raw/cifs/mp-1084.cif,mp-1084,0.0,,2011-05-13 01:55:40,3.608852766615364,10.17188/1187388,"@misc{osti_1187388,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrB12 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187388"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701270'}},0.0158721137179496,6.88737846,520.0,-91.45613101,-7.03508700076923,{'tags': ['Zirconium boride (1/12)']},-91.45613101,-7.03508700076923,-0.2119791638461532,"['xas', 'elasticity', 'bandstructure']",True,"[615764, 615752, 35363, 23861, 409634, 76257, 409635]",True,2021-05-12 10:56:10.715000,NM,13,8,mp-1084,,ZrB12,"{'functional': 'PBE', 'labels': ['Zr_sv', 'B'], 'pot_type': 'paw'}","{'Zr': 1.0, 'B': 12.0}",GGA,mp-1084,"['mp-922210', 'mp-1084', 'mp-907581', 'mp-921959', 'mp-1427051', 'mp-1701270', 'mp-1798000', 'mp-1593176']",1.76e-05,"{'Zr': 1.0, 'B': 12.0}",101.66833997602512,[],NM,False,225,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.7311190488750325e-07,1.76e-05,0,1.76e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1084.cif,True,,data/final/MP/graphs/B12Lu0.007Zr0.993-MP-mp-1084-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ni1Ta2,1,0.0,2.0,False,Ni2Ta4,Ni2Ta4,0.9,Other,True,Ni33.333Ta66.667,Ni-Ta,2,Supercon,Ni1Ta2,MP-mp-1867,Ta4Ni2,Ni-Ta,Ni33.333Ta66.667,I 4/m c m,tetragonal,4.870003995679771,5.03258768057149,5.03258768,data/final/MP/cifs/Ni1Ta2-MP-mp-1867.cif,data/source/MP/raw/cifs/mp-1867.cif,mp-1867,0.0,,2011-05-13 22:07:40,14.78623216926157,10.17188/1193327,"@misc{osti_1193327,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ta2Ni (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1193327"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688276'}},0.0,6.29387002,520.0,-60.40198748,-10.066997913333331,{'tags': ['Nickel tantalum (1/2)']},-60.40198748,-10.066997913333331,-0.2351006000000003,"['xas', 'elasticity', 'bandstructure']",True,"[102816, 105387]",True,2021-05-12 10:56:14.760000,NM,6,8,mp-1867,,Ta2Ni,"{'functional': 'PBE', 'labels': ['Ta_pv', 'Ni_pv'], 'pot_type': 'paw'}","{'Ta': 2.0, 'Ni': 1.0}",GGA,mp-1867,"['mp-941246', 'mp-941554', 'mp-934774', 'mp-1867', 'mp-1300446', 'mp-1688276', 'mp-1798241', 'mp-1592666']",0.0001078,"{'Ta': 4.0, 'Ni': 2.0}",94.4668963903272,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0]",2.2822809707769337e-06,0.0001078,0,0.0002156,MP,data/source/MP/cleaned/cifs/MP-mp-1867.cif,False,,data/final/MP/graphs/Ni1Ta2-MP-mp-1867.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As1Fe0.95Nd1Rh0.05O1,2,0.025,2.0,False,As2Fe1.9Nd2Rh0.1O2,As2Fe2Nd2O2,7.1,Ferrite,True,As25Fe23.75Nd25Rh1.25O25,As-Fe-Nd-Rh-O,5,Supercon,Nd1Fe0.95Rh0.05As1O1,MP-mp-622621,Nd2Fe2As2O2,As-Fe-Nd-O,As25Fe25Nd25O25,P 4/n m m,tetragonal,4.074653,4.074653,9.170967,data/final/MP/cifs/As1Fe0.95Nd1Rh0.05O1-MP-mp-622621-synth_doped.cif,data/source/MP/raw/cifs/mp-622621.cif,mp-622621,0.0,,2014-02-16 22:28:25,6.347279619112142,10.17188/1278150,"@misc{osti_1278150,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NdFeAsO (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278150"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-1677677'}},0.2809314202083302,3.74777613,520.0,-52.70842543,-6.58855317875,{'tags': ['Neodymium iron arsenic oxide (1/1/1/1)']},-52.70842543,-6.58855317875,-1.61299541125,"['xas', 'bandstructure']",True,"[163547, 164679, 422001, 163546, 236651, 236650, 602466, 164680, 164676]",True,2021-05-12 10:57:28.836000,FM,8,8,mp-622621,oxide,NdFeAsO,"{'functional': 'PBE', 'labels': ['Nd_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Nd': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-622621,"['mp-622621', 'mp-1079381', 'mp-1173401', 'mp-1438697', 'mp-1677677', 'mp-1772072', 'mp-1926310', 'mp-1592869']",3.83954265,"{'Nd': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",152.26370404041757,[],FM,True,129,1,"[0.0, 0.0, 3.6, 3.6, -0.0, -0.0, -0.0, -0.0]",0.0504328024094411,3.83954265,2,7.6790853,MP,data/source/MP/cleaned/cifs/MP-mp-622621.cif,True,,data/final/MP/graphs/As1Fe0.95Nd1Rh0.05O1-MP-mp-622621-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ce1Co2,1,0.0,2.0,False,Ce2Co4,Ce2Co4,1.1125,Heavy_fermion,True,Ce33.333Co66.667,Ce-Co,2,Supercon,Ce1Co2,MP-mp-1112,Ce2Co4,Ce-Co,Ce33.333Co66.667,F d -3 m,cubic,4.99867784,4.99867784,4.99867784,data/final/MP/cifs/Ce1Co2-MP-mp-1112.cif,data/source/MP/raw/cifs/mp-1112.cif,mp-1112,0.0,,2011-05-13 09:02:17,9.701049230746174,10.17188/1187580,"@misc{osti_1187580,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeCo2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187580"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686856'}},0.0,8.26937171,520.0,-41.81273492,-6.968789153333333,{'tags': ['Cerium cobalt (1/2)']},-41.81273492,-6.968789153333333,-0.2522142383333327,"['xas', 'bandstructure']",True,"[102094, 620652, 620671, 657905, 108239, 620681, 620677, 620694, 620679, 620691, 620644, 656107, 620672, 620661, 620654]",True,2021-05-12 10:56:51.169000,NM,6,9,mp-1112,,CeCo2,"{'functional': 'PBE', 'labels': ['Ce', 'Co'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Co': 2.0}",GGA,mp-1112,"['mp-930540', 'mp-929975', 'mp-913634', 'mp-1112', 'mp-1440572', 'mp-1686856', 'mp-1801907', 'mp-1593275', 'mp-1596792']",0.0056005,"{'Ce': 2.0, 'Co': 4.0}",88.31824824311025,[],NM,False,227,0,"[0.0, 0.0, -0.0, -0.0, -0.0, -0.0]",0.0001268254321481,0.0056005,0,0.011201,MP,data/source/MP/cleaned/cifs/MP-mp-1112.cif,False,,data/final/MP/graphs/Ce1Co2-MP-mp-1112.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
B4Pr1Ru4,1,0.0,4.0,False,B16Pr4Ru16,B16Pr4Ru16,0.0,Heavy_fermion,True,B44.444Pr11.111Ru44.444,B-Pr-Ru,3,Supercon,Pr1Ru4B4,MP-mp-1200756,Pr4B16Ru16,B-Pr-Ru,B44.444Pr11.111Ru44.444,I 41/a c d,tetragonal,7.576382002004288,7.576382002004288,9.27694202,data/final/MP/cifs/B4Pr1Ru4-MP-mp-1200756.cif,data/source/MP/raw/cifs/mp-1200756.cif,mp-1200756,0.0,,2019-01-12 05:06:16.941000,8.990286183793794,,,{'GGA': {'task_id': 'mp-1751207'}},0.0,6.96215135,520.0,-290.08083542,-8.057800983888889,{'tags': ['Praseodymium ruthenium boride (1/4/4)']},-290.08083542,-8.057800983888889,-0.4360204451851849,['bandstructure'],True,"[615202, 421308]",True,2021-05-12 10:58:37.524000,NM,36,6,mp-1200756,,Pr(BRu)4,"{'functional': 'PBE', 'labels': ['Pr_3', 'B', 'Ru_pv'], 'pot_type': 'paw'}","{'Pr': 1.0, 'B': 4.0, 'Ru': 4.0}",GGA,mp-1200756,"['mp-1200756', 'mp-1203537', 'mp-1392705', 'mp-1751207', 'mp-1822873', 'mp-1623223']",1.3925e-05,"{'Pr': 4.0, 'B': 16.0, 'Ru': 16.0}",434.7419972504445,[],NM,False,142,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.281219674019958e-07,1.3925e-05,0,5.57e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1200756.cif,False,,data/final/MP/graphs/B4Pr1Ru4-MP-mp-1200756.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B2Li0.2Mg0.8,3,0.1333333333333333,1.0,True,B2Li0.2Mg0.8,B2Mg1,34.0,Other,True,B66.667Li6.667Mg26.667,B-Li-Mg,3,Supercon,Mg0.8Li0.2B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B2Li0.2Mg0.8-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B2Li0.2Mg0.8-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ba0.57Bi1K0.43O3,2,0.0386666666666666,3.0,False,Ba1.71Bi3K1.29O9,Ba2Bi3K1O9,21.2,Oxide,True,Ba11.4Bi20K8.6O60,Ba-Bi-K-O,4,Supercon,Ba0.57K0.43Bi1O3,MP-mp-1223518,K1Ba2Bi3O9,Ba-Bi-K-O,Ba13.333Bi20K6.667O60,P -3 m 1,trigonal,6.18756400330999,6.187564340000001,7.581401,data/final/MP/cifs/Ba0.57Bi1K0.43O3-MP-mp-1223518-synth_doped.cif,data/source/MP/raw/cifs/mp-1223518.cif,mp-1223518,0.0,,2019-01-12 23:54:06.965000,7.16530091201999,,,{'GGA': {'task_id': 'mp-1729135'}},0.001551682833333,3.46143017,520.0,-85.22271396,-5.681514264,{'tags': []},-85.22271396,-5.681514264,-2.0170414252000004,[],False,[],True,2021-05-12 11:00:52.054000,NM,15,4,mp-1223518,oxide,KBa2(BiO3)3,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Bi', 'O'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 2.0, 'Bi': 3.0, 'O': 9.0}",GGA,mp-1223518,"['mp-1223518', 'mp-1391182', 'mp-1729135', 'mp-1775199']",4.99e-05,"{'K': 1.0, 'Ba': 2.0, 'Bi': 3.0, 'O': 9.0}",251.37352739849624,[],NM,False,164,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.9850936777799505e-07,4.99e-05,0,4.99e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1223518.cif,True,,data/final/MP/graphs/Ba0.57Bi1K0.43O3-MP-mp-1223518-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Br2,1,0.0,2.0,False,Br4,Br4,1.4,Other,True,Br100,Br,1,Supercon,Br2,MP-mp-23154,Br4,Br,Br100,C m c a,orthorhombic,4.258648004232382,4.73221932,8.743796,data/final/MP/cifs/Br2-MP-mp-23154.cif,data/source/MP/raw/cifs/mp-23154.cif,mp-23154,1.3266,,2013-06-07 20:09:01,3.3726136434377976,10.17188/1199274,"@misc{osti_1199274,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Br (SG:64) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199274"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1066194'}},0.0,-0.9947555,520.0,-6.54773157,-1.6369328925,{'tags': ['Bromine']},-6.54773157,-1.6369328925,0.0,"['eos', 'bandstructure', 'xas', 'diel', 'elasticity']",True,"[201695, 201692, 24019, 426930, 201694, 201693]",True,2021-05-12 10:56:16.728000,NM,4,34,mp-23154,,Br,"{'functional': 'PBE', 'labels': ['Br'], 'pot_type': 'paw'}",{'Br': 1.0},GGA,mp-23154,"['mp-1018092', 'mp-661435', 'mp-612894', 'mp-655343', 'mp-656942', 'mp-23154', 'mp-1064162', 'mp-1064169', 'mp-1064187', 'mp-1065442', 'mp-1065458', 'mp-1065450', 'mp-1066167', 'mp-1066544', 'mp-1066517', 'mp-1066526', 'mp-1066177', 'mp-1066194', 'mp-1067625', 'mp-1067633', 'mp-1067651', 'mp-1067757', 'mp-1067763', 'mp-1067779', 'mp-1141657', 'mp-1439769', 'mp-1932188', 'mp-1594149', 'mp-1066541', 'mp-1065457', 'mp-1067649', 'mp-1067780', 'mp-1064186', 'mp-1066190']",0.000235775,{'Br': 4.0},157.36604023502463,[],NM,False,64,0,"[0, 0, 0, 0]",5.993033812069551e-06,0.000235775,0,0.0009431,MP,data/source/MP/cleaned/cifs/MP-mp-23154.cif,False,,data/final/MP/graphs/Br2-MP-mp-23154.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
La0.5Sr0.5Ti1O3,3,0.0666666666666666,3.0,False,La1.5Sr1.5Ti3O9,La2Sr1Ti3O9,0.0,Oxide,True,La10Sr10Ti20O60,La-Sr-Ti-O,4,Supercon,La0.5Sr0.5Ti1O3,MP-mp-1218904,Sr1La2Ti3O9,La-Sr-Ti-O,La13.333Sr6.667Ti20O60,P -3 m 1,trigonal,5.585068000772868,5.5850682,6.830672,data/final/MP/cifs/La0.5Sr0.5Ti1O3-MP-mp-1218904-synth_doped.cif,data/source/MP/raw/cifs/mp-1218904.cif,mp-1218904,0.0,,2019-01-12 19:59:48.166000,5.876637677567727,,,{'GGA': {'task_id': 'mp-1736640'}},0.023043555354187,8.53292476,520.0,-127.7619896,-8.517465973333334,{'tags': []},-127.7619896,-8.517465973333334,-3.611023789444446,[],False,[],True,2021-05-12 11:00:42.526000,NM,15,4,mp-1218904,oxide,SrLa2Ti3O9,"{'functional': 'PBE', 'labels': ['Sr_sv', 'La', 'Ti_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 1.0, 'La': 2.0, 'Ti': 3.0, 'O': 9.0}",GGA,mp-1218904,"['mp-1218904', 'mp-1406224', 'mp-1736640', 'mp-1828534']",0.0004049,"{'Sr': 1.0, 'La': 2.0, 'Ti': 3.0, 'O': 9.0}",184.52321560267407,[],NM,False,164,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.194303836932117e-06,0.0004049,0,0.0004049,MP,data/source/MP/cleaned/cifs/MP-mp-1218904.cif,True,,data/final/MP/graphs/La0.5Sr0.5Ti1O3-MP-mp-1218904-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Co0.24La1Ru2.76Si2,3,0.08,1.0,True,Co0.24La1Ru2.76Si2,La1Ru3Si2,6.04,Other,True,Co4La16.667Ru46Si33.333,Co-La-Ru-Si,4,Supercon,La1Ru2.76Co0.24Si2,MP-mp-29240,La2Si4Ru6,La-Ru-Si,La16.667Ru50Si33.333,P 6/m m m,hexagonal,3.6088705,5.693851997310984,5.69385245,data/final/MP/cifs/Co0.24La1Ru2.76Si2-MP-mp-29240-synth_doped.cif,data/source/MP/raw/cifs/mp-29240.cif,mp-29240,0.0,,2014-02-24 11:42:03,8.166084465628895,10.17188/1203620,"@misc{osti_1203620,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaSi2Ru3 (SG:193) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1203620"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1719509'}},0.0844490616666675,8.56766587,520.0,-95.13702135,-7.9280851125,{'tags': []},-95.13702135,-7.9280851125,-0.6361177608333328,"['xas', 'bandstructure']",True,[],True,2021-05-12 10:57:03.017000,NM,12,10,mp-29240,,LaSi2Ru3,"{'functional': 'PBE', 'labels': ['La', 'Si', 'Ru_pv'], 'pot_type': 'paw'}","{'La': 1.0, 'Si': 2.0, 'Ru': 3.0}",GGA,mp-29240,"['mp-925171', 'mp-924493', 'mp-909454', 'mp-29240', 'mp-1172476', 'mp-1254946', 'mp-1406081', 'mp-1719509', 'mp-1834844', 'mp-1618500']",0.00014945,"{'La': 2.0, 'Si': 4.0, 'Ru': 6.0}",202.6489324904347,[],NM,False,38,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, 0.0, 0.0, 0.0, -0.0]",1.4749645918520125e-06,0.00014945,0,0.0002989,MP,data/source/MP/cleaned/cifs/MP-mp-29240.cif,True,,data/final/MP/graphs/Co0.24La1Ru2.76Si2-MP-mp-29240-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
B2C1Gd0.2Ni2Y0.8,3,0.0666666666666666,1.0,True,B2C1Gd0.2Ni2Y0.8,B2C1Ni2Y1,8.1,Other,True,B33.333C16.667Gd3.333Ni33.333Y13.333,B-C-Gd-Ni-Y,5,Supercon,Y0.8Gd0.2Ni2B2C1,MP-mp-6576,Y1Ni2B2C1,B-C-Ni-Y,B33.333C16.667Ni33.333Y16.667,I 4/m m m,tetragonal,3.548790000501972,3.548790000501972,5.76144136,data/final/MP/cifs/B2C1Gd0.2Ni2Y0.8-MP-mp-6576-synth_doped.cif,data/source/MP/raw/cifs/mp-6576.cif,mp-6576,0.0,,2011-05-13 05:21:43,6.099730998852292,10.17188/1281366,"@misc{osti_1281366,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281366"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688230'}},0.0,6.81083016,520.0,-43.677878,-7.279646333333333,{'tags': []},-43.677878,-7.279646333333333,-0.5109282141666659,"['xas', 'bandstructure']",True,"[75816, 89142, 83231, 79574, 41549]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6576,,YNi2B2C,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6576,"['mp-6576', 'mp-1007054', 'mp-1000583', 'mp-1439516', 'mp-1688230', 'mp-1794280', 'mp-1011792', 'mp-1597064']",0.0006603,"{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.3152437079014,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",1.010943177297096e-05,0.0006603,0,0.0006603,MP,data/source/MP/cleaned/cifs/MP-mp-6576.cif,True,,data/final/MP/graphs/B2C1Gd0.2Ni2Y0.8-MP-mp-6576-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ba0.249Cu1La1.751O4,3,0.0711428571428571,1.0,True,Ba0.249Cu1La1.751O4,Cu1La2O4,13.7,Cuprate,True,Ba3.557Cu14.286La25.014O57.142857142857146,Ba-Cu-La-O,4,Supercon,La1.751Ba0.249Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ba0.249Cu1La1.751O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ba0.249Cu1La1.751O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As2Fe1.88Ni0.12Sr1,2,0.048,1.0,True,As2Fe1.88Ni0.12Sr1,As2Fe2Sr1,5.92,Ferrite,True,As40Fe37.6Ni2.4Sr20,As-Fe-Ni-Sr,4,Supercon,Sr1Fe1.88Ni0.12As2,MP-mp-4488,Sr1Fe2As2,As-Fe-Sr,As40Fe40Sr20,I 4/m m m,tetragonal,3.9729799997357778,3.9729799997357778,6.45523327,data/final/MP/cifs/As2Fe1.88Ni0.12Sr1-MP-mp-4488-synth_doped.cif,data/source/MP/raw/cifs/mp-4488.cif,mp-4488,0.0,,2011-05-13 03:37:13,6.319998834487784,10.17188/1208187,"@misc{osti_1208187,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr(FeAs)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208187"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672865'}},0.0,5.13397273,520.0,-30.61898897,-6.123797794,"{'tags': ['Strontium diiron arsenide - HT', 'Strontium diiron arsenide', 'Strontium diiron diarsenide', 'Iron strontium arsenide (2/1/2)', 'Strontium diiron arsenide - LT']}",-30.61898897,-6.123797794,-0.5342483613333335,"['xas', 'elasticity', 'bandstructure']",True,"[182330, 181993, 610527, 163209, 163208, 163869]",True,2021-05-12 10:56:20.740000,NM,5,8,mp-4488,,Sr(FeAs)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Fe': 2.0, 'As': 2.0}",GGA,mp-4488,"['mp-906356', 'mp-920135', 'mp-919110', 'mp-4488', 'mp-1439153', 'mp-1672865', 'mp-1873948', 'mp-1592272']",0.0029206,"{'Sr': 1.0, 'Fe': 2.0, 'As': 2.0}",91.7377588211838,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",3.183640016422098e-05,0.0029206,0,0.0029206,MP,data/source/MP/cleaned/cifs/MP-mp-4488.cif,True,,data/final/MP/graphs/As2Fe1.88Ni0.12Sr1-MP-mp-4488-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B1Li2Pd2.7Pt0.3,3,0.0999999999999999,4.0,False,B4Li8Pd10.8Pt1.2,B4Li8Pd12,6.59,Other,True,B16.667Li33.333Pd45Pt5,B-Li-Pd-Pt,4,Supercon,Li2B1Pd2.7Pt0.3,MP-mp-20657,Li8B4Pd12,B-Li-Pd,B16.667Li33.333Pd50,P 43 3 2,cubic,6.834153,6.834153,6.834153,data/final/MP/cifs/B1Li2Pd2.7Pt0.3-MP-mp-20657-synth_doped.cif,data/source/MP/raw/cifs/mp-20657.cif,mp-20657,0.0,,2014-02-22 22:20:25,7.157380380013985,10.17188/1195787,"@misc{osti_1195787,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Li2BPd3 (SG:212) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195787"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672514'}},0.0,3.54739631,520.0,-115.20693246,-4.8002888525000005,{'tags': ['Lithium palladium boride (2/3/1)']},-115.20693246,-4.8002888525000005,-0.4608083634722219,"['xas', 'bandstructure']",True,"[156465, 246447, 84931]",True,2021-05-12 10:56:57.051000,NM,24,9,mp-20657,,Li2BPd3,"{'functional': 'PBE', 'labels': ['Li_sv', 'B', 'Pd'], 'pot_type': 'paw'}","{'Li': 2.0, 'B': 1.0, 'Pd': 3.0}",GGA,mp-20657,"['mp-921382', 'mp-906713', 'mp-920352', 'mp-20657', 'mp-1116014', 'mp-1415525', 'mp-1672514', 'mp-1806936', 'mp-1654311']",4.895e-05,"{'Li': 8.0, 'B': 4.0, 'Pd': 12.0}",319.1935391161389,[],NM,False,212,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.134209374731673e-07,4.895e-05,0,0.0001958,MP,data/source/MP/cleaned/cifs/MP-mp-20657.cif,True,,data/final/MP/graphs/B1Li2Pd2.7Pt0.3-MP-mp-20657-synth_doped.json,0,True,432,4,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba0.275Cu1La1.725O4,3,0.0785714285714285,1.0,True,Ba0.275Cu1La1.725O4,Cu1La2O4,0.0,Cuprate,True,Ba3.929Cu14.286La24.643O57.142857142857146,Ba-Cu-La-O,4,Supercon,La1.725Ba0.275Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ba0.275Cu1La1.725O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ba0.275Cu1La1.725O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Co1Na0.6O2,2,3.0839528461809905e-17,5.0,False,Co5Na3O10,Co5Na3O10,0.0,Oxide,True,Co27.778Na16.667O55.55555555555556,Co-Na-O,3,Supercon,Na0.6Co1O2,MP-mp-867705,Na6Co10O20,Co-Na-O,Co27.778Na16.667O55.55555555555556,C 1 m 1,monoclinic,4.91452569,5.76899511620919,7.558010120528888,data/final/MP/cifs/Co1Na0.6O2-MP-mp-867705.cif,data/source/MP/raw/cifs/mp-867705.cif,mp-867705,0.3054000000000001,,2014-08-22 13:43:09,4.480633874115267,,,{'GGA+U': {'task_id': 'mp-879286'}},0.0070583719444492,2.32429319,520.0,-200.81055048,-5.578070846666666,{'tags': []},-200.81055048,-5.578070846666666,-1.4709166852586206,"['xas', 'bandstructure']",True,[],True,2021-05-12 10:57:53.781000,AFM,36,17,mp-867705,oxide,Na3(CoO2)5,"{'functional': 'PBE', 'labels': ['Na_pv', 'Co', 'O'], 'pot_type': 'paw'}","{'Na': 3.0, 'Co': 5.0, 'O': 10.0}",GGA+U,mp-867705,"['mp-869142', 'mp-869060', 'mp-868581', 'mp-878291', 'mp-861555', 'mp-878068', 'mp-862406', 'mp-879286', 'mp-867705', 'mp-1290935', 'mp-1320576', 'mp-1313425', 'mp-1315827', 'mp-1303215', 'mp-1326578', 'mp-1312286', 'mp-889602']",4.8e-06,"{'Na': 6.0, 'Co': 10.0, 'O': 20.0}",388.1177998473492,[],AFM,True,8,3,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -1.1, -1.1, 0.0, 0.0, 0.0, 1.1, 1.1, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",2.473475837432805e-08,4.8e-06,4,9.6e-06,MP,data/source/MP/cleaned/cifs/MP-mp-867705.cif,False,,data/final/MP/graphs/Co1Na0.6O2-MP-mp-867705.json,0,True,m,0,0,5,0,0,0,0,0,1,0,0,1.0,False
Co7Y9,3,0.125,0.2222539682539682,False,Co1.556Y2,Co2Y2,2.85,Other,True,Co43.75Y56.25,Co-Y,2,Supercon,Co7Y9,MP-mp-865373,Y2Co2,Co-Y,Co50Y50,R -3 m,trigonal,3.908338158939893,3.908338158939893,7.20958979,data/final/MP/cifs/Co7Y9-MP-mp-865373-synth_doped.cif,data/source/MP/raw/cifs/mp-865373.cif,mp-865373,0.0,,2014-08-31 00:22:59,5.420377437912928,10.17188/1310675,"@misc{osti_1310675,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YCo (SG:166) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1310675"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1732145'}},0.0,3.2255559,520.0,-27.93837983,-6.9845949575,{'tags': ['Cobalt yttrium (1/1)']},-27.93837983,-6.9845949575,-0.1972005033333337,"['xas', 'elasticity', 'bandstructure']",True,[168949],True,2021-05-12 10:56:33.121000,FM,4,8,mp-865373,,YCo,"{'functional': 'PBE', 'labels': ['Y_sv', 'Co'], 'pot_type': 'paw'}","{'Y': 1.0, 'Co': 1.0}",GGA,mp-865373,"['mp-865373', 'mp-1052700', 'mp-1052728', 'mp-1428052', 'mp-1732145', 'mp-1796799', 'mp-1612999', 'mp-1052712']",0.09469185,"{'Y': 2.0, 'Co': 2.0}",90.58133408726616,[],FM,True,166,1,"[0.0, 0.0, 0.3, 0.3]",0.0020907585642042,0.09469185,2,0.1893837,MP,data/source/MP/cleaned/cifs/MP-mp-865373.cif,True,,data/final/MP/graphs/Co7Y9-MP-mp-865373-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Nb1Te2,1,0.0,3.0,False,Nb3Te6,Nb3Te6,0.5,Other,True,Nb33.333Te66.667,Nb-Te,2,Supercon,Nb1Te2,MP-mp-11675,Nb3Te6,Nb-Te,Nb33.333Te66.667,C 1 2/m 1,monoclinic,3.671411998812349,7.69828405,9.54795853,data/final/MP/cifs/Nb1Te2-MP-mp-11675.cif,data/source/MP/raw/cifs/mp-11675.cif,mp-11675,0.0,,2011-05-30 03:26:32,7.094396080281276,10.17188/1188143,"@misc{osti_1188143,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbTe2 (SG:12) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188143"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703933'}},0.0,6.1432341,520.0,-53.31370368,-5.923744853333334,"{'tags': ['Niobium telluride (1/2)', 'Niobium(IV) telluride']}",-53.31370368,-5.923744853333334,-0.7424425533333334,"['xas', 'elasticity', 'bandstructure']",True,"[645536, 14389]",True,2021-05-12 10:56:12.755000,NM,9,9,mp-11675,,NbTe2,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Te'], 'pot_type': 'paw'}","{'Nb': 1.0, 'Te': 2.0}",GGA,mp-11675,"['mp-1008148', 'mp-1001689', 'mp-11675', 'mp-1078495', 'mp-1426800', 'mp-1703933', 'mp-1876628', 'mp-1012466', 'mp-1601445']",0.0001189333333333,"{'Nb': 3.0, 'Te': 6.0}",244.436976783422,[],NM,False,12,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0]",1.45968095619238e-06,0.0001189333333333,0,0.0003568,MP,data/source/MP/cleaned/cifs/MP-mp-11675.cif,False,,data/final/MP/graphs/Nb1Te2-MP-mp-11675.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
In0.15Nb3Sn0.85,3,0.075,2.0,False,In0.3Nb6Sn1.7,Nb6Sn2,18.28,Other,True,In3.75Nb75Sn21.25,In-Nb-Sn,3,Supercon,In0.15Nb3Sn0.85,MP-mp-1326,Nb6Sn2,Nb-Sn,Nb75Sn25,P m -3 n,cubic,5.334611,5.334611,5.334611,data/final/MP/cifs/In0.15Nb3Sn0.85-MP-mp-1326-synth_doped.cif,data/source/MP/raw/cifs/mp-1326.cif,mp-1326,0.0,,2011-05-14 09:51:48,8.694218121896231,10.17188/1189484,"@misc{osti_1189484,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Sn (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189484"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668415'}},0.0,6.59372491,520.0,-69.93787048,-8.74223381,{'tags': ['Niobium tin (3/1)']},-69.93787048,-8.74223381,-0.163862066250001,"['xas', 'elasticity', 'bandstructure']",True,"[105230, 645503, 645489, 105231, 645498, 645485, 645474, 645496, 645480, 645488, 645482, 645487, 645500, 645493, 645477, 645484, 645502, 645483, 150878, 645479, 645481, 645486, 645473]",True,2021-05-12 10:56:12.755000,NM,8,9,mp-1326,,Nb3Sn,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Sn_d'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Sn': 1.0}",GGA,mp-1326,"['mp-930046', 'mp-913770', 'mp-930577', 'mp-1326', 'mp-1440651', 'mp-1668415', 'mp-1880085', 'mp-1594093', 'mp-1594507']",0.62023085,"{'Nb': 6.0, 'Sn': 2.0}",151.81275738025872,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0081709977567491,0.62023085,0,1.2404617,MP,data/source/MP/cleaned/cifs/MP-mp-1326.cif,True,,data/final/MP/graphs/In0.15Nb3Sn0.85-MP-mp-1326-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Hg4Na1,3,0.1,1.5,False,Hg6Na1.5,Hg6Na2,3.05,Other,True,Hg80Na20,Hg-Na,2,Supercon,Hg4Na1,MP-mp-1186152,Na2Hg6,Hg-Na,Hg75Na25,P 63/m m c,hexagonal,5.508011,6.6732940029708185,6.673293889999999,data/final/MP/cifs/Hg4Na1-MP-mp-1186152-synth_doped.cif,data/source/MP/raw/cifs/mp-1186152.cif,mp-1186152,0.0,,2019-01-11 14:06:25.507000,9.767562772067706,,,{'GGA': {'task_id': 'mp-1752652'}},0.0,1.93035397,520.0,-6.01804276,-0.752255345,{'tags': []},-6.01804276,-0.752255345,-0.193863747887931,['bandstructure'],True,[],True,2021-05-12 10:58:29.672000,NM,8,5,mp-1186152,,NaHg3,"{'functional': 'PBE', 'labels': ['Na_pv', 'Hg'], 'pot_type': 'paw'}","{'Na': 1.0, 'Hg': 3.0}",GGA,mp-1186152,"['mp-1186152', 'mp-1406576', 'mp-1752652', 'mp-1790150', 'mp-1623798']",0.00027635,"{'Na': 2.0, 'Hg': 6.0}",212.42515217740976,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",2.601857615892891e-06,0.00027635,0,0.0005527,MP,data/source/MP/cleaned/cifs/MP-mp-1186152.cif,True,,data/final/MP/graphs/Hg4Na1-MP-mp-1186152-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Ca0.85Cu2.2Tl1.8O8,3,0.043097643097643,1.0,True,Ba2Ca0.85Cu2.2Tl1.8O8,Ba2Ca1Cu2Tl2O8,104.0,Cuprate,True,Ba13.468Ca5.724Cu14.815Tl12.121O53.87205387205387,Ba-Ca-Cu-Tl-O,5,Supercon,Tl1.8Ba2Ca0.85Cu2.2O8,MP-mp-6885,Ba2Ca1Tl2Cu2O8,Ba-Ca-Cu-Tl-O,Ba13.333Ca6.667Cu13.333Tl13.333O53.333333333333336,I 4/m m m,tetragonal,3.8887880015527454,3.8887880015527454,15.44888372,data/final/MP/cifs/Ba2Ca0.85Cu2.2Tl1.8O8-MP-mp-6885-synth_doped.cif,data/source/MP/raw/cifs/mp-6885.cif,mp-6885,0.0,,2011-05-16 00:12:29,7.06827160481344,10.17188/1284435,"@misc{osti_1284435,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2CaTl2(CuO4)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1284435"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1676611'}},0.0059098983148224,4.22920004,520.0,-81.10596699,-5.407064466,"{'tags': ['Dithallium(III) dibarium calcium dicopper oxide', 'Dithallium dibarium calcium dicopper oxide']}",-81.10596699,-5.407064466,-1.8834025184444445,"['xas', 'bandstructure']",True,"[78592, 78593, 65554]",True,2021-05-12 10:57:38.495000,NM,15,8,mp-6885,oxide,Ba2CaTl2(CuO4)2,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ca_sv', 'Tl_d', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Ca': 1.0, 'Tl': 2.0, 'Cu': 2.0, 'O': 8.0}",GGA,mp-6885,"['mp-6885', 'mp-556042', 'mvc-16338', 'mp-1423335', 'mp-1676611', 'mp-1777344', 'mp-1931767', 'mp-1607471']",0.0018692,"{'Ba': 2.0, 'Ca': 1.0, 'Tl': 2.0, 'Cu': 2.0, 'O': 8.0}",229.8977800758837,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",8.130570027179132e-06,0.0018692,0,0.0018692,MP,data/source/MP/cleaned/cifs/MP-mp-6885.cif,True,,data/final/MP/graphs/Ba2Ca0.85Cu2.2Tl1.8O8-MP-mp-6885-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ni1Ti1,1,0.0,2.0,False,Ni2Ti2,Ni2Ti2,0.0,Other,True,Ni50Ti50,Ni-Ti,2,Supercon,Ni1Ti1,MP-mp-1048,Ti2Ni2,Ni-Ti,Ni50Ti50,P 1 21/m 1,monoclinic,2.915461,4.05501,4.75410703,data/final/MP/cifs/Ni1Ti1-MP-mp-1048.cif,data/source/MP/raw/cifs/mp-1048.cif,mp-1048,0.0,,2011-05-13 05:04:45,6.412985726454696,10.17188/1187148,"@misc{osti_1187148,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TiNi (SG:11) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187148"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1670762'}},0.0,6.9571684,520.0,-28.9346775,-7.233669375,"{'tags': ['Titanium nickel (1/1) - monoclinic', 'Titanium nickel (1/1)', 'Nickel titanium (1/1) - martensite', ""Nickel titanium (1/1) - martensite B19'"", 'Nickel titanium (1/1) - monoclinic', ""Nickel titanium (1/1) - B19'"", ""Titanium nickel (1/1) - B19'"", 'Nickel titanium (1/1)', 'Nickel titanium (1/1) - LT']}",-28.9346775,-7.233669375,-0.3958550266666663,"['xas', 'elasticity', 'bandstructure']",True,"[245081, 166367, 105415, 164155, 646942, 181724, 164151, 105416, 161458, 187470, 105414, 164153, 166012, 166372, 157607, 164156, 164154, 164152, 240195, 157983]",True,2021-05-12 10:56:10.715000,NM,4,18,mp-1048,,TiNi,"{'functional': 'PBE', 'labels': ['Ti_pv', 'Ni_pv'], 'pot_type': 'paw'}","{'Ti': 1.0, 'Ni': 1.0}",GGA,mp-1048,"['mp-919196', 'mp-904164', 'mp-918200', 'mp-1048', 'mp-570144', 'mp-1066307', 'mp-1066543', 'mp-1066363', 'mp-1066587', 'mp-1066643', 'mp-1066845', 'mp-1300499', 'mp-1670762', 'mp-1792343', 'mp-1590186', 'mp-1596483', 'mp-1066385', 'mp-1066675']",0.00201315,"{'Ti': 2.0, 'Ni': 2.0}",55.1841886759804,[],NM,False,11,0,"[0.0, 0.0, -0.0, -0.0]",7.296111615667364e-05,0.00201315,0,0.0040263,MP,data/source/MP/cleaned/cifs/MP-mp-1048.cif,False,,data/final/MP/graphs/Ni1Ti1-MP-mp-1048.json,0,True,2/m,0,0,3,0,0,0,0,1,0,0,0,1.0,False
Co3Th7,1,0.0,2.0,False,Co6Th14,Co6Th14,1.815,Other,True,Co30Th70,Co-Th,2,Supercon,Co3Th7,MP-mp-30565,Th14Co6,Co-Th,Co30Th70,P 63 m c,hexagonal,6.184225,9.751581999694729,9.75158136,data/final/MP/cifs/Co3Th7-MP-mp-30565.cif,data/source/MP/raw/cifs/mp-30565.cif,mp-30565,0.0,,2014-02-20 05:34:26,11.744720671883762,10.17188/1204957,"@misc{osti_1204957,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Th7Co3 (SG:186) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1204957"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1670598'}},0.0,7.50083398,520.0,-151.47686986,-7.573843493,"{'tags': ['Cobalt thorium (3/7)', 'Thorium cobalt (7/3)']}",-151.47686986,-7.573843493,-0.2516473794999996,"['xas', 'bandstructure']",True,"[102700, 625427, 625441, 625455]",True,2021-05-12 10:57:04.957000,NM,20,9,mp-30565,,Th7Co3,"{'functional': 'PBE', 'labels': ['Th', 'Co'], 'pot_type': 'paw'}","{'Th': 7.0, 'Co': 3.0}",GGA,mp-30565,"['mp-934767', 'mp-941242', 'mp-941558', 'mp-30565', 'mp-1116211', 'mp-1434601', 'mp-1670598', 'mp-1928124', 'mp-1630161']",0.00030055,"{'Th': 14.0, 'Co': 6.0}",509.2910332022394,[],NM,False,186,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.1802681783350845e-06,0.00030055,0,0.0006011,MP,data/source/MP/cleaned/cifs/MP-mp-30565.cif,False,,data/final/MP/graphs/Co3Th7-MP-mp-30565.json,0,True,6mm,0,5,0,0,0,0,0,1,0,0,0,1.0,False
Ge1La1Pt1,1,0.0,2.0,False,Ge2La2Pt2,Ge2La2Pt2,3.4,Other,True,Ge33.333La33.333Pt33.333,Ge-La-Pt,3,Supercon,La1Pt1Ge1,MP-mp-1077797,La2Ge2Pt2,Ge-La-Pt,Ge33.333La33.333Pt33.333,I 41 m d,tetragonal,4.2991039995484455,4.2991039995484455,8.17121725,data/final/MP/cifs/Ge1La1Pt1-MP-mp-1077797.cif,data/source/MP/raw/cifs/mp-1077797.cif,mp-1077797,0.0,,2018-04-09 18:01:22,9.63349214948222,,,{'GGA': {'task_id': 'mp-1695569'}},0.0,6.78923348,520.0,-37.84677693,-6.307796154999999,"{'tags': ['LaPtSi', 'Lanthanum platinum germanide (1/1/1)', 'LaPtGe']}",-37.84677693,-6.307796154999999,-1.0978152649999997,['bandstructure'],True,[636837],True,2021-05-12 10:58:14.654000,NM,6,5,mp-1077797,,LaGePt,"{'functional': 'PBE', 'labels': ['La', 'Ge_d', 'Pt'], 'pot_type': 'paw'}","{'La': 1.0, 'Ge': 1.0, 'Pt': 1.0}",GGA,mp-1077797,"['mp-1077797', 'mp-1423408', 'mp-1695569', 'mp-1778546', 'mp-1596279']",0.00105375,"{'La': 2.0, 'Ge': 2.0, 'Pt': 2.0}",140.18262746020812,[],NM,False,109,0,"[0, 0, 0, 0, 0, 0]",1.503395990061771e-05,0.00105375,0,0.0021075,MP,data/source/MP/cleaned/cifs/MP-mp-1077797.cif,False,,data/final/MP/graphs/Ge1La1Pt1-MP-mp-1077797.json,0,True,4mm,0,0,0,0,5,0,0,0,0,1,0,1.0,False
Al3Gd0.05Pd2U0.95,2,0.0166666666666666,1.0,True,Al3Gd0.05Pd2U0.95,Al3Pd2U1,0.0,Heavy_fermion,True,Al50Gd0.833Pd33.333U15.833,Al-Gd-Pd-U,4,Supercon,U0.95Gd0.05Pd2Al3,MP-mp-4561,U1Al3Pd2,Al-Pd-U,Al50Pd33.333U16.667,P 6/m m m,hexagonal,4.239652,5.384229999094356,5.3842309,data/final/MP/cifs/Al3Gd0.05Pd2U0.95-MP-mp-4561-synth_doped.cif,data/source/MP/raw/cifs/mp-4561.cif,mp-4561,0.0,,2011-05-12 23:59:10,8.296603403902926,10.17188/1208253,"@misc{osti_1208253,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UAl3Pd2 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208253"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700804'}},0.0796314472916668,8.0468212,520.0,-36.36476907,-6.060794845,"{'tags': ['Aluminium palladium uranium (3/2/1)', 'Aluminum palladium uranium (3/2/1)']}",-36.36476907,-6.060794845,-0.5794779916666665,"['xas', 'elasticity', 'bandstructure']",True,"[657574, 106242, 659234]",True,2021-05-12 10:56:20.740000,FM,6,9,mp-4561,,UAl3Pd2,"{'functional': 'PBE', 'labels': ['U', 'Al', 'Pd'], 'pot_type': 'paw'}","{'U': 1.0, 'Al': 3.0, 'Pd': 2.0}",GGA,mp-4561,"['mp-4561', 'mp-991619', 'mp-993538', 'mp-1251974', 'mp-1441898', 'mp-1700804', 'mp-1933710', 'mp-994863', 'mp-1593816']",2.2050571,"{'U': 1.0, 'Al': 3.0, 'Pd': 2.0}",106.4408038742404,[],FM,True,191,1,"[2.2, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0207162762750765,2.2050571,1,2.2050571,MP,data/source/MP/cleaned/cifs/MP-mp-4561.cif,True,,data/final/MP/graphs/Al3Gd0.05Pd2U0.95-MP-mp-4561-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Bi2Ca1Cu2Sr2O8.19,2,0.0116743471582181,1.9536203907203904,False,Bi3.907Ca1.954Cu3.907Sr3.907O16,Bi4Ca2Cu4Sr4O16,89.26666667,Cuprate,True,Bi13.167Ca6.583Cu13.167Sr13.167O53.917050691244235,Bi-Ca-Cu-Sr-O,5,Supercon,Bi2Sr2Ca1Cu2O8.19,MP-mp-1218930,Sr4Ca2Cu4Bi4O16,Bi-Ca-Cu-Sr-O,Bi13.333Ca6.667Cu13.333Sr13.333O53.333333333333336,C c c 2,orthorhombic,5.417115,5.472898000129128,16.11398919,data/final/MP/cifs/Bi2Ca1Cu2Sr2O8.19-MP-mp-1218930-synth_doped.cif,data/source/MP/raw/cifs/mp-1218930.cif,mp-1218930,0.0,,2019-01-12 20:01:06.544000,6.266668983881059,,,,0.039252223722225,4.51768334,520.0,-173.15021002,-5.771673667333333,{'tags': []},-173.15021002,-5.771673667333333,-2.074956548222222,[],False,[],True,2021-05-12 11:00:42.526000,NM,30,3,mp-1218930,oxide,Sr2CaCu2(BiO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",GGA,mp-1218930,"['mp-1218930', 'mp-1359698', 'mp-1817714']",0.00011165,"{'Sr': 4.0, 'Ca': 2.0, 'Cu': 4.0, 'Bi': 4.0, 'O': 16.0}",470.7976286073367,[],NM,False,37,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.743014544498498e-07,0.00011165,0,0.0002233,MP,data/source/MP/cleaned/cifs/MP-mp-1218930.cif,True,,data/final/MP/graphs/Bi2Ca1Cu2Sr2O8.19-MP-mp-1218930-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Ce1Co0.01Ru1.99,2,0.0066666666666666,2.0,False,Ce2Co0.02Ru3.98,Ce2Ru4,4.74,Heavy_fermion,True,Ce33.333Co0.333Ru66.333,Ce-Co-Ru,3,Supercon,Ce1Ru1.99Co0.01,MP-mp-607,Ce2Ru4,Ce-Ru,Ce33.333Ru66.667,F d -3 m,cubic,5.35903077,5.35903077,5.35903077,data/final/MP/cifs/Ce1Co0.01Ru1.99-MP-mp-607-synth_doped.cif,data/source/MP/raw/cifs/mp-607.cif,mp-607,0.0,,2011-05-13 22:34:26,10.444470046690055,10.17188/1277529,"@misc{osti_1277529,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeRu2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277529"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686879'}},0.0,8.61419203,520.0,-50.66413619,-8.444022698333333,"{'tags': ['Cerium ruthenium (1/2)', 'Cerium ruthenium hydride (1/2/4)']}",-50.66413619,-8.444022698333333,-0.2833998766666663,"['xas', 'elasticity', 'bandstructure']",True,"[621326, 656077, 621978, 621973, 621980, 621984, 102277, 621972, 621976, 621979, 604113, 621977, 621982, 621983, 102276, 656078]",True,2021-05-12 10:56:27.046000,NM,6,14,mp-607,,CeRu2,"{'functional': 'PBE', 'labels': ['Ce', 'Ru_pv'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Ru': 2.0}",GGA,mp-607,"['mp-928203', 'mp-912221', 'mp-928809', 'mp-607', 'mp-1071462', 'mp-1071593', 'mp-1071613', 'mp-1077792', 'mp-1440763', 'mp-1686879', 'mp-1803198', 'mp-1591928', 'mp-1591642', 'mp-1071635']",1.005e-05,"{'Ce': 2.0, 'Ru': 4.0}",108.82877852828122,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",1.846937939745105e-07,1.005e-05,0,2.01e-05,MP,data/source/MP/cleaned/cifs/MP-mp-607.cif,True,,data/final/MP/graphs/Ce1Co0.01Ru1.99-MP-mp-607-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
B4Ir4Lu0.8Y0.2,3,0.0666666666666666,2.0,False,B8Ir8Lu1.6Y0.4,B8Ir8Lu1Y1,3.04,Other,True,B44.444Ir44.444Lu8.889Y2.222,B-Ir-Lu-Y,4,Supercon,Y0.2Lu0.8Ir4B4,MP-mp-1215947,Y1Lu1B8Ir8,B-Ir-Lu-Y,B44.444Ir44.444Lu5.556Y5.556,P -4 m 2,tetragonal,5.397527,5.397527,7.454301,data/final/MP/cifs/B4Ir4Lu0.8Y0.2-MP-mp-1215947-synth_doped.cif,data/source/MP/raw/cifs/mp-1215947.cif,mp-1215947,0.0,,2019-01-12 17:32:34.719000,14.436994561781765,,,,0.0267232327777815,8.34985726,520.0,-144.25774255,-8.014319030555555,{'tags': []},-144.25774255,-8.014319030555555,-0.5070968549999988,[],False,[],True,2021-05-12 11:00:37.845000,NM,18,3,mp-1215947,,YLu(BIr)8,"{'functional': 'PBE', 'labels': ['Y_sv', 'Lu_3', 'B', 'Ir'], 'pot_type': 'paw'}","{'Y': 1.0, 'Lu': 1.0, 'B': 8.0, 'Ir': 8.0}",GGA,mp-1215947,"['mp-1215947', 'mp-1367845', 'mp-1830201']",5.13e-05,"{'Y': 1.0, 'Lu': 1.0, 'B': 8.0, 'Ir': 8.0}",217.1683702956564,[],NM,False,115,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.3622224511865785e-07,5.13e-05,0,5.13e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1215947.cif,True,,data/final/MP/graphs/B4Ir4Lu0.8Y0.2-MP-mp-1215947-synth_doped.json,0,True,-42m,0,0,0,0,6,0,0,1,0,0,0,1.0,False
Ce0.15Cu1La1Nd0.85O4,2,0.0428571428571428,1.0,True,Ce0.15Cu1La1Nd0.85O4,Cu1La1Nd1O4,11.9,Cuprate,True,Ce2.143Cu14.286La14.286Nd12.143O57.142857142857146,Ce-Cu-La-Nd-O,5,Supercon,Nd0.85La1Ce0.15Cu1O4,MP-mp-1222802,La1Nd1Cu1O4,Cu-La-Nd-O,Cu14.286La14.286Nd14.286O57.142857142857146,I 4 m m,tetragonal,3.990583997710408,3.990583997710408,6.86113394,data/final/MP/cifs/Ce0.15Cu1La1Nd0.85O4-MP-mp-1222802-synth_doped.cif,data/source/MP/raw/cifs/mp-1222802.cif,mp-1222802,0.0,,2019-01-12 23:17:08.795000,6.847501059175971,,,{'GGA': {'task_id': 'mp-1757801'}},0.0221520027777764,4.77137154,520.0,-51.89321393,-7.413316275714286,{'tags': []},-51.89321393,-7.413316275714286,-3.006573275,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,7,5,mp-1222802,oxide,LaNdCuO4,"{'functional': 'PBE', 'labels': ['La', 'Nd_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 1.0, 'Nd': 1.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1222802,"['mp-1222802', 'mp-1396444', 'mp-1757801', 'mp-1797162', 'mp-1627120']",0.006009,"{'La': 1.0, 'Nd': 1.0, 'Cu': 1.0, 'O': 4.0}",99.5937875942181,[],NM,False,107,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",6.03350886149936e-05,0.006009,0,0.006009,MP,data/source/MP/cleaned/cifs/MP-mp-1222802.cif,True,,data/final/MP/graphs/Ce0.15Cu1La1Nd0.85O4-MP-mp-1222802-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,0,0,1,0,1.0,False
Ba2Cd0.25Cu1Tl1.75O6,3,0.0454545454545454,2.0,False,Ba4Cd0.5Cu2Tl3.5O12,Ba4Cu2Tl4O12,88.0,Cuprate,True,Ba18.182Cd2.273Cu9.091Tl15.909O54.54545454545455,Ba-Cd-Cu-Tl-O,5,Supercon,Tl1.75Cd0.25Ba2Cu1O6,MP-mp-6027,Ba4Tl4Cu2O12,Ba-Cu-Tl-O,Ba18.182Cu9.091Tl18.182O54.54545454545455,C m c a,orthorhombic,5.504110002693673,5.585743,12.28312762,data/final/MP/cifs/Ba2Cd0.25Cu1Tl1.75O6-MP-mp-6027-synth_doped.cif,data/source/MP/raw/cifs/mp-6027.cif,mp-6027,0.0,,2011-05-19 00:05:23,7.606665315628389,10.17188/1277350,"@misc{osti_1277350,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Tl2CuO6 (SG:64) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277350"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1673478'}},0.0059215576010052,4.10961464,520.0,-115.75418737,-5.261553971363636,"{'tags': ['Dithallium dibarium cuprate', 'Dithallium(III) dibarium copper oxide']}",-115.75418737,-5.261553971363636,-1.7862630028787878,"['xas', 'bandstructure']",True,"[202723, 202724, 202722]",True,2021-05-12 10:57:28.836000,NM,22,8,mp-6027,oxide,Ba2Tl2CuO6,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Tl_d', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Tl': 2.0, 'Cu': 1.0, 'O': 6.0}",GGA,mp-6027,"['mp-925246', 'mp-909581', 'mp-924678', 'mp-6027', 'mp-1504634', 'mp-1673478', 'mp-1837163', 'mp-1605186']",2.9e-05,"{'Ba': 4.0, 'Tl': 4.0, 'Cu': 2.0, 'O': 12.0}",368.0385386017736,[],NM,False,64,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.5759219189476614e-07,2.9e-05,0,5.8e-05,MP,data/source/MP/cleaned/cifs/MP-mp-6027.cif,True,,data/final/MP/graphs/Ba2Cd0.25Cu1Tl1.75O6-MP-mp-6027-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Cu2S2Sr2Zn1O2,1,0.0,1.0,True,Cu2S2Sr2Zn1O2,Cu2S2Sr2Zn1O2,0.0,Cuprate,True,Cu22.222S22.222Sr22.222Zn11.111O22.22222222222222,Cu-S-Sr-Zn-O,5,Supercon,Sr2Cu2Zn1S2O2,MP-mp-9453,Sr2Zn1Cu2S2O2,Cu-S-Sr-Zn-O,Cu22.222S22.222Sr22.222Zn11.111O22.22222222222222,I 4/m m m,tetragonal,4.032869999020947,4.032869999020947,9.36401861,data/final/MP/cifs/Cu2S2Sr2Zn1O2-MP-mp-9453.cif,data/source/MP/raw/cifs/mp-9453.cif,mp-9453,0.8325999999999993,,2011-05-30 04:25:12,5.309931878759118,10.17188/1313233,"@misc{osti_1313233,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr2ZnCu2(SO)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1313233"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698361'}},0.0824319179861099,4.532329,520.0,-43.99925682,-4.888806313333333,{'tags': ['Distrontium dicopper(I) zinc dioxide disulfide']},-43.99925682,-4.888806313333333,-1.708143468842593,"['xas', 'elasticity', 'bandstructure']",True,[84735],True,2021-05-12 10:56:35.166000,NM,9,12,mp-9453,oxide,Sr2ZnCu2(SO)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Zn', 'Cu_pv', 'S', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Zn': 1.0, 'Cu': 2.0, 'S': 2.0, 'O': 2.0}",GGA,mp-9453,"['mp-661101', 'mp-670670', 'mp-9453', 'mvc-16081', 'mp-1048707', 'mp-1048710', 'mp-1418618', 'mp-1698361', 'mp-1934743', 'mp-1593940', 'mp-1048712', 'mp-687664']",0.0002807,"{'Sr': 2.0, 'Zn': 1.0, 'Cu': 2.0, 'S': 2.0, 'O': 2.0}",145.0628637623755,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0]",1.935023152857432e-06,0.0002807,0,0.0002807,MP,data/source/MP/cleaned/cifs/MP-mp-9453.cif,False,,data/final/MP/graphs/Cu2S2Sr2Zn1O2-MP-mp-9453.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Rb0.16W1O3,2,0.0030769230769231,6.0,False,Rb0.96W6O18,Rb1W6O18,4.95,Oxide,True,Rb3.846W24.038O72.11538461538461,Rb-W-O,3,Supercon,Rb0.16W1O3,MP-mp-698610,Rb2W12O36,Rb-W-O,Rb4W24O72,I m m m,orthorhombic,7.517873,7.73016,8.453532552068545,data/final/MP/cifs/Rb0.16W1O3-MP-mp-698610-synth_doped.cif,data/source/MP/raw/cifs/mp-698610.cif,mp-698610,0.0,,2014-05-03 10:33:20,6.479585148375198,10.17188/1285396,"@misc{osti_1285396,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Rb(WO3)6 (SG:58) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1285396"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-948538'}},0.0,2.14597584,520.0,-369.09548382,-7.3819096764,{'tags': []},-369.09548382,-7.3819096764,-2.2299660371000005,[],False,[],True,2021-05-12 11:01:44.406000,NM,50,6,mp-698610,oxide,Rb(WO3)6,"{'functional': 'PBE', 'labels': ['Rb_sv', 'W_pv', 'O'], 'pot_type': 'paw'}","{'Rb': 1.0, 'W': 6.0, 'O': 18.0}",GGA+U,mp-698610,"['mp-698610', 'mp-938151', 'mp-948538', 'mp-949215', 'mp-1359932', 'mp-1892222']",0.0029009,"{'Rb': 2.0, 'W': 12.0, 'O': 36.0}",756.7709642128867,[],NM,False,4,0,"[0.0, 0.0, 0.0, -0.0, 0.0, -0.0, -0.0, -0.0, 0.0, 0.0, 0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",7.666520353399684e-06,0.0029009,0,0.0058018,MP,data/source/MP/cleaned/cifs/MP-mp-698610.cif,True,,data/final/MP/graphs/Rb0.16W1O3-MP-mp-698610-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,0,1,0,1.0,False
As1Co0.019Fe0.981Na1,2,0.0126666666666666,2.0,False,As2Co0.038Fe1.962Na2,As2Fe2Na2,19.3,Ferrite,True,As33.333Co0.633Fe32.7Na33.333,As-Co-Fe-Na,4,Supercon,Na1Fe0.981Co0.019As1,MP-mp-22152,Na2Fe2As2,As-Fe-Na,As33.333Fe33.333Na33.333,P 4/n m m,tetragonal,3.923688,3.923688,6.918844,data/final/MP/cifs/As1Co0.019Fe0.981Na1-MP-mp-22152-synth_doped.cif,data/source/MP/raw/cifs/mp-22152.cif,mp-22152,0.0,,2014-02-21 10:51:39,4.793908463406792,10.17188/1197381,"@misc{osti_1197381,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NaFeAs (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197381"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704688'}},0.0,4.10723066,520.0,-30.57538864,-5.095898106666667,{'tags': ['Sodium iron arsenide']},-30.57538864,-5.095898106666667,-0.2786807238505749,"['xas', 'elasticity', 'bandstructure']",True,"[163144, 163143]",True,2021-05-12 10:56:16.728000,FM,6,8,mp-22152,,NaFeAs,"{'functional': 'PBE', 'labels': ['Na_pv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Na': 1.0, 'Fe': 1.0, 'As': 1.0}",GGA,mp-22152,"['mp-906352', 'mp-920130', 'mp-919102', 'mp-22152', 'mp-1413190', 'mp-1704688', 'mp-1797758', 'mp-1594769']",0.0693226,"{'Na': 2.0, 'Fe': 2.0, 'As': 2.0}",106.5178694490858,[],FM,True,129,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.0]",0.0013016144682303,0.0693226,2,0.1386452,MP,data/source/MP/cleaned/cifs/MP-mp-22152.cif,True,,data/final/MP/graphs/As1Co0.019Fe0.981Na1-MP-mp-22152-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ge2Pd2Yb1,1,0.0,1.0,True,Ge2Pd2Yb1,Ge2Pd2Yb1,1.17,Heavy_fermion,True,Ge40Pd40Yb20,Ge-Pd-Yb,3,Supercon,Yb1Pd2Ge2,MP-mp-3296,Yb1Ge2Pd2,Ge-Pd-Yb,Ge40Pd40Yb20,I 4/m m m,tetragonal,4.341900001909716,4.341900001909716,5.90470427,data/final/MP/cifs/Ge2Pd2Yb1-MP-mp-3296.cif,data/source/MP/raw/cifs/mp-3296.cif,mp-3296,0.0,,2011-05-13 06:49:07,9.275998532037931,10.17188/1206453,"@misc{osti_1206453,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Yb(GePd)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1206453"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696556'}},0.0,4.05724494,520.0,-24.9398161,-4.98796322,"{'tags': ['Palladium ytterbium germanide (2/1/2)', 'Germanium palladium ytterbium (2/2/1)']}",-24.9398161,-4.98796322,-0.7588776980000006,"['xas', 'bandstructure']",True,"[658347, 637567, 53886]",True,2021-05-12 10:57:06.958000,NM,5,8,mp-3296,,Yb(GePd)2,"{'functional': 'PBE', 'labels': ['Yb_2', 'Ge_d', 'Pd'], 'pot_type': 'paw'}","{'Yb': 1.0, 'Ge': 2.0, 'Pd': 2.0}",GGA,mp-3296,"['mp-930625', 'mp-913861', 'mp-3296', 'mp-1441699', 'mp-1696556', 'mp-1797733', 'mp-977650', 'mp-1586192']",0.0004187,"{'Yb': 1.0, 'Ge': 2.0, 'Pd': 2.0}",95.08538919760676,[],NM,False,139,0,"[0, 0, 0, 0, 0]",4.403410487491998e-06,0.0004187,0,0.0004187,MP,data/source/MP/cleaned/cifs/MP-mp-3296.cif,False,,data/final/MP/graphs/Ge2Pd2Yb1-MP-mp-3296.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ba24Si100,1,0.0,1.0,True,Ba24Si100,Ba24Si100,1.475,Other,True,Ba19.355Si80.645,Ba-Si,2,Supercon,Ba24Si100,MP-mp-16094,Ba24Si100,Ba-Si,Ba19.355Si80.645,P 41 3 2,cubic,14.166191,14.166191,14.166191,data/final/MP/cifs/Ba24Si100-MP-mp-16094.cif,data/source/MP/raw/cifs/mp-16094.cif,mp-16094,0.0431999999999996,,2014-02-16 11:43:15,3.565600318115223,10.17188/1191560,"@misc{osti_1191560,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba6Si25 (SG:213) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191560"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",,0.0530338842741953,6.02423767,520.0,-611.63910554,-4.932573431774193,{'tags': ['Barium silicide (24/100)']},-611.63910554,-4.932573431774193,-0.128648416290322,['xas'],False,[90703],True,2021-05-12 10:56:53.126000,NM,124,4,mp-16094,,Ba6Si25,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Si'], 'pot_type': 'paw'}","{'Ba': 6.0, 'Si': 25.0}",GGA,mp-16094,"['mp-16094', 'mp-1138793', 'mp-1146335', 'mp-1337813']",0.000877725,"{'Ba': 24.0, 'Si': 100.0}",2842.8849149399643,[],NM,False,213,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.2349778851579517e-06,0.000877725,0,0.0035109,MP,data/source/MP/cleaned/cifs/MP-mp-16094.cif,False,,data/final/MP/graphs/Ba24Si100-MP-mp-16094.json,0,True,432,4,0,0,0,0,0,0,1,0,0,0,1.0,False
Ir0.96Pt0.04Te2,2,0.0266666666666666,4.0,False,Ir3.84Pt0.16Te8,Ir4Te8,2.9725,Other,True,Ir32Pt1.333Te66.667,Ir-Pt-Te,3,Supercon,Ir0.96Pt0.04Te2,MP-mp-569322,Te8Ir4,Ir-Te,Ir33.333Te66.667,P n m a,orthorhombic,4.049805,5.441863,13.587474,data/final/MP/cifs/Ir0.96Pt0.04Te2-MP-mp-569322-synth_doped.cif,data/source/MP/raw/cifs/mp-569322.cif,mp-569322,0.0,,2014-02-16 04:48:25,9.924328423353325,10.17188/1275037,"@misc{osti_1275037,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Te2Ir (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1275037"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1746248'}},0.0123894575000003,7.60847828,520.0,-63.94410921,-5.3286757675,{'tags': ['Iridium telluride (1/2)']},-63.94410921,-5.3286757675,-0.5683316741666667,"['xas', 'bandstructure']",True,[93894],True,2021-05-12 10:57:24.969000,NM,12,7,mp-569322,,Te2Ir,"{'functional': 'PBE', 'labels': ['Te', 'Ir'], 'pot_type': 'paw'}","{'Te': 2.0, 'Ir': 1.0}",GGA,mp-569322,"['mp-927873', 'mp-927408', 'mp-569322', 'mp-911451', 'mp-1392626', 'mp-1746248', 'mp-1810340']",0.000153075,"{'Te': 8.0, 'Ir': 4.0}",299.44732816890644,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.0447669503153013e-06,0.000153075,0,0.0006123,MP,data/source/MP/cleaned/cifs/MP-mp-569322.cif,True,,data/final/MP/graphs/Ir0.96Pt0.04Te2-MP-mp-569322-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Nb0.222U0.778,3,0.056,8.0,False,Nb1.776U6.224,Nb2U6,1.98,Heavy_fermion,True,Nb22.2U77.8,Nb-U,2,Supercon,Nb0.222U0.778,MP-mp-972551,U6Nb2,Nb-U,Nb25U75,P 63/m m c,hexagonal,5.47549,5.930717999946023,5.930717609999999,data/final/MP/cifs/Nb0.222U0.778-MP-mp-972551-synth_doped.cif,data/source/MP/raw/cifs/mp-972551.cif,mp-972551,0.0,,2015-09-16 01:37:32,16.068701668754734,10.17188/1313878,"@misc{osti_1313878,
    author = ""Persson, Kristin"",
    title = ""Materials Data on U3Nb (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1313878"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1752359'}},0.3415145425000006,12.07866299,520.0,-85.2189538,-10.652369225,{'tags': []},-85.2189538,-10.652369225,0.3415145425000006,"['xas', 'bandstructure']",True,[],True,2021-05-12 10:57:55.580000,NM,8,8,mp-972551,,U3Nb,"{'functional': 'PBE', 'labels': ['U', 'Nb_pv'], 'pot_type': 'paw'}","{'U': 3.0, 'Nb': 1.0}",GGA,mp-972551,"['mp-972719', 'mp-972786', 'mp-972551', 'mp-1386707', 'mp-1752359', 'mp-1827596', 'mp-1655008', 'mp-972844']",0.14362885,"{'U': 6.0, 'Nb': 2.0}",166.789279340187,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0017222791604855,0.14362885,0,0.2872577,MP,data/source/MP/cleaned/cifs/MP-mp-972551.cif,True,,data/final/MP/graphs/Nb0.222U0.778-MP-mp-972551-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Cu0.08Ru0.92Sr2Y1O6,2,0.0159999999999999,2.0,False,Cu0.16Ru1.84Sr4Y2O12,Ru2Sr4Y2O12,17.6,Cuprate,True,Cu0.8Ru9.2Sr20Y10O60,Cu-Ru-Sr-Y-O,5,Supercon,Sr2Y1Ru0.92Cu0.08O6,MP-mp-14430,Sr4Y2Ru2O12,Ru-Sr-Y-O,Ru10Sr20Y10O60,P 1 21/c 1,monoclinic,5.816658,5.885394,8.254861792272742,data/final/MP/cifs/Cu0.08Ru0.92Sr2Y1O6-MP-mp-14430-synth_doped.cif,data/source/MP/raw/cifs/mp-14430.cif,mp-14430,0.0,,2011-06-07 07:34:15,5.420400820723878,10.17188/1190674,"@misc{osti_1190674,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr2YRuO6 (SG:14) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1190674"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1669873'}},0.0,3.25749146,520.0,-146.31379286,-7.315689643000001,"{'tags': ['Distrontium yttrium ruthenium(V) oxide', 'Distrontium yttrium ruthenium hexaoxide']}",-146.31379286,-7.315689643000001,-2.847128272500001,"['xas', 'bandstructure']",True,"[192766, 49500]",True,2021-05-12 10:56:53.126000,FM,20,10,mp-14430,oxide,Sr2YRuO6,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Y_sv', 'Ru_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Y': 1.0, 'Ru': 1.0, 'O': 6.0}",GGA,mp-14430,"['mp-923119', 'mp-922143', 'mp-917338', 'mp-14430', 'mp-1106028', 'mp-1236895', 'mp-1431640', 'mp-1669873', 'mp-1931083', 'mp-1608013']",2.9996044,"{'Sr': 4.0, 'Y': 2.0, 'Ru': 2.0, 'O': 12.0}",282.584622226224,[],FM,True,14,1,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 2.0, 2.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0212297780138839,2.9996044,2,5.9992088,MP,data/source/MP/cleaned/cifs/MP-mp-14430.cif,True,,data/final/MP/graphs/Cu0.08Ru0.92Sr2Y1O6-MP-mp-14430-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,1,0,0,0,1.0,False
Cu1La2O4.034,2,0.0041431414760956,0.991690547017022,True,Cu0.992La1.983O4,Cu1La2O4,30.7,Cuprate,True,Cu14.217La28.433O57.350014216661926,Cu-La-O,3,Supercon,La2Cu1O4.034,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La2O4.034-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La2O4.034-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Be2Nb1,1,0.0,2.0,False,Be4Nb2,Be4Nb2,2.15,Other,True,Be66.667Nb33.333,Be-Nb,2,Supercon,Be2Nb1,MP-mp-2028,Be4Nb2,Be-Nb,Be66.667Nb33.333,F d -3 m,cubic,4.624223789999999,4.624223789999999,4.624223789999999,data/final/MP/cifs/Be2Nb1-MP-mp-2028.cif,data/source/MP/raw/cifs/mp-2028.cif,mp-2028,0.0,,2011-05-12 22:10:38,5.269015614354269,10.17188/1195410,"@misc{osti_1195410,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Be2Nb (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195410"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701582'}},0.0217831695238084,4.10024605,520.0,-36.30014894,-6.050024823333334,{'tags': ['Beryllium niobium (2/1)']},-36.30014894,-6.050024823333334,-0.1899812333333332,"['xas', 'elasticity', 'bandstructure']",True,"[58721, 616354]",True,2021-05-12 10:56:14.760000,NM,6,8,mp-2028,,Be2Nb,"{'functional': 'PBE', 'labels': ['Be_sv', 'Nb_pv'], 'pot_type': 'paw'}","{'Be': 2.0, 'Nb': 1.0}",GGA,mp-2028,"['mp-912114', 'mp-928186', 'mp-928711', 'mp-2028', 'mp-1441082', 'mp-1701582', 'mp-1800202', 'mp-1592566']",0.003726,"{'Be': 4.0, 'Nb': 2.0}",69.92001830367636,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",0.0001065789194681,0.003726,0,0.007452,MP,data/source/MP/cleaned/cifs/MP-mp-2028.cif,False,,data/final/MP/graphs/Be2Nb1-MP-mp-2028.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
B2Li0.08Mg0.92,3,0.0533333333333333,1.0,True,B2Li0.08Mg0.92,B2Mg1,38.0,Other,True,B66.667Li2.667Mg30.667,B-Li-Mg,3,Supercon,Mg0.92Li0.08B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B2Li0.08Mg0.92-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B2Li0.08Mg0.92-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ga2Pt1,1,0.0,1.0,True,Ga2Pt1,Ga2Pt1,1.9,Other,True,Ga66.667Pt33.333,Ga-Pt,2,Supercon,Ga2Pt1,MP-mp-22095,Ga2Pt1,Ga-Pt,Ga66.667Pt33.333,F m -3 m,cubic,4.24389227,4.24389227,4.24389227,data/final/MP/cifs/Ga2Pt1-MP-mp-22095.cif,data/source/MP/raw/cifs/mp-22095.cif,mp-22095,0.0,,2014-02-21 06:12:54,10.27794085635186,10.17188/1197346,"@misc{osti_1197346,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ga2Pt (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197346"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1674385'}},0.0,4.40311282,520.0,-13.87046676,-4.62348892,{'tags': ['Gallium platinum (2/1)']},-13.87046676,-4.62348892,-0.5811223349999999,"['xas', 'elasticity', 'bandstructure']",True,[103925],True,2021-05-12 10:56:16.728000,NM,3,8,mp-22095,,Ga2Pt,"{'functional': 'PBE', 'labels': ['Ga_d', 'Pt'], 'pot_type': 'paw'}","{'Ga': 2.0, 'Pt': 1.0}",GGA,mp-22095,"['mp-912474', 'mp-929304', 'mp-928931', 'mp-22095', 'mp-1437762', 'mp-1674385', 'mp-1793498', 'mp-1593536']",5.93e-05,"{'Ga': 2.0, 'Pt': 1.0}",54.0478040994363,[],NM,False,225,0,"[0, 0, 0]",1.0971768601532968e-06,5.93e-05,0,5.93e-05,MP,data/source/MP/cleaned/cifs/MP-mp-22095.cif,False,,data/final/MP/graphs/Ga2Pt1-MP-mp-22095.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Al3Pd2U1,1,0.0,1.0,True,Al3Pd2U1,Al3Pd2U1,1.864,Heavy_fermion,True,Al50Pd33.333U16.667,Al-Pd-U,3,Supercon,U1Pd2Al3,MP-mp-4561,U1Al3Pd2,Al-Pd-U,Al50Pd33.333U16.667,P 6/m m m,hexagonal,4.239652,5.384229999094356,5.3842309,data/final/MP/cifs/Al3Pd2U1-MP-mp-4561.cif,data/source/MP/raw/cifs/mp-4561.cif,mp-4561,0.0,,2011-05-12 23:59:10,8.296603403902926,10.17188/1208253,"@misc{osti_1208253,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UAl3Pd2 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208253"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700804'}},0.0796314472916668,8.0468212,520.0,-36.36476907,-6.060794845,"{'tags': ['Aluminium palladium uranium (3/2/1)', 'Aluminum palladium uranium (3/2/1)']}",-36.36476907,-6.060794845,-0.5794779916666665,"['xas', 'elasticity', 'bandstructure']",True,"[657574, 106242, 659234]",True,2021-05-12 10:56:20.740000,FM,6,9,mp-4561,,UAl3Pd2,"{'functional': 'PBE', 'labels': ['U', 'Al', 'Pd'], 'pot_type': 'paw'}","{'U': 1.0, 'Al': 3.0, 'Pd': 2.0}",GGA,mp-4561,"['mp-4561', 'mp-991619', 'mp-993538', 'mp-1251974', 'mp-1441898', 'mp-1700804', 'mp-1933710', 'mp-994863', 'mp-1593816']",2.2050571,"{'U': 1.0, 'Al': 3.0, 'Pd': 2.0}",106.4408038742404,[],FM,True,191,1,"[2.2, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0207162762750765,2.2050571,1,2.2050571,MP,data/source/MP/cleaned/cifs/MP-mp-4561.cif,False,,data/final/MP/graphs/Al3Pd2U1-MP-mp-4561.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Be13Zr1,1,0.0,2.0,False,Be26Zr2,Be26Zr2,0.0,Other,True,Be92.857Zr7.143,Be-Zr,2,Supercon,Be13Zr1,MP-mp-30445,Zr2Be26,Be-Zr,Be92.857Zr7.143,F m -3 c,cubic,7.06803998,7.068039979999999,7.068039979999999,data/final/MP/cifs/Be13Zr1-MP-mp-30445.cif,data/source/MP/raw/cifs/mp-30445.cif,mp-30445,0.0,,2014-02-24 11:51:59,2.7717755747305075,10.17188/1204853,"@misc{osti_1204853,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrBe13 (SG:226) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1204853"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671842'}},0.0,4.33702932,520.0,-119.86603832,-4.28092994,{'tags': ['Beryllium zirconium (13/1)']},-119.86603832,-4.28092994,-0.1980679489285717,"['xas', 'bandstructure']",True,"[58758, 616516]",True,2021-05-12 10:57:04.957000,NM,28,8,mp-30445,,ZrBe13,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Be_sv'], 'pot_type': 'paw'}","{'Zr': 1.0, 'Be': 13.0}",GGA,mp-30445,"['mp-928749', 'mp-912152', 'mp-928254', 'mp-30445', 'mp-1430210', 'mp-1671842', 'mp-1778003', 'mp-1607793']",0.0006228,"{'Zr': 2.0, 'Be': 26.0}",249.67898749680185,[],NM,False,226,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.9888058762492176e-06,0.0006228,0,0.0012456,MP,data/source/MP/cleaned/cifs/MP-mp-30445.cif,False,,data/final/MP/graphs/Be13Zr1-MP-mp-30445.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Au1Si3Sr1,1,0.0,1.0,True,Au1Si3Sr1,Au1Si3Sr1,1.65,Other,True,Au20Si60Sr20,Au-Si-Sr,3,Supercon,Sr1Au1Si3,MP-mp-1067925,Sr1Si3Au1,Au-Si-Sr,Au20Si60Sr20,I 4 m m,tetragonal,4.462693997159328,4.462693997159328,5.86681499,data/final/MP/cifs/Au1Si3Sr1-MP-mp-1067925.cif,data/source/MP/raw/cifs/mp-1067925.cif,mp-1067925,0.0,,2018-03-21 22:01:50,6.218035467193794,,,{'GGA': {'task_id': 'mp-1703007'}},0.0203489829999998,6.44043718,520.0,-23.05340451,-4.610680902,{'tags': ['Strontium gold silicide (1/1/3)']},-23.05340451,-4.610680902,-0.320217491333333,['bandstructure'],True,[194347],True,2021-05-12 10:58:14.654000,NM,5,8,mp-1067925,,SrSi3Au,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Si', 'Au'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Si': 3.0, 'Au': 1.0}",GGA,mp-1067925,"['mp-1067925', 'mp-1067957', 'mp-1067990', 'mp-1437348', 'mp-1703007', 'mp-1796139', 'mp-1591251', 'mp-1067980']",0.0025024,"{'Sr': 1.0, 'Si': 3.0, 'Au': 1.0}",98.50029462690593,[],NM,False,107,0,"[0, 0, 0, 0, 0]",2.5405000152318884e-05,0.0025024,0,0.0025024,MP,data/source/MP/cleaned/cifs/MP-mp-1067925.cif,False,,data/final/MP/graphs/Au1Si3Sr1-MP-mp-1067925.json,0,True,4mm,0,0,0,0,5,0,0,0,0,1,0,1.0,False
B4Rh4Th1,1,0.0,2.0,False,B8Rh8Th2,B8Rh8Th2,4.448,Other,True,B44.444Rh44.444Th11.111,B-Rh-Th,3,Supercon,Th1Rh4B4,MP-mp-1106347,Th2B8Rh8,B-Rh-Th,B44.444Rh44.444Th11.111,P 42/n m c,tetragonal,5.392304,5.392304,7.622436,data/final/MP/cifs/B4Rh4Th1-MP-mp-1106347.cif,data/source/MP/raw/cifs/mp-1106347.cif,mp-1106347,0.0,,2018-07-19 11:00:42,10.292779125538743,,,{'GGA': {'task_id': 'mp-1670236'}},0.025339434999994,7.89807222,520.0,-137.70495405,-7.650275225,{'tags': ['Thorium rhodium boride (1/4/4)']},-137.70495405,-7.650275225,-0.5848689124074077,['bandstructure'],True,"[601578, 615326]",True,2021-05-12 10:58:22.271000,NM,18,6,mp-1106347,,Th(BRh)4,"{'functional': 'PBE', 'labels': ['Th', 'B', 'Rh_pv'], 'pot_type': 'paw'}","{'Th': 1.0, 'B': 4.0, 'Rh': 4.0}",GGA,mp-1106347,"['mp-1106347', 'mp-1188166', 'mp-1414014', 'mp-1670236', 'mp-1871340', 'mp-1603981']",2.925e-05,"{'Th': 2.0, 'B': 8.0, 'Rh': 8.0}",221.6371327362856,[],NM,False,137,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.639449413452126e-07,2.925e-05,0,5.85e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1106347.cif,False,,data/final/MP/graphs/B4Rh4Th1-MP-mp-1106347.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
As2Ba0.5Fe1.88K0.5Zn0.12,2,0.048,2.0,False,As4Ba1Fe3.76K1Zn0.24,As4Ba1Fe4K1,33.5,Ferrite,True,As40Ba10Fe37.6K10Zn2.4,As-Ba-Fe-K-Zn,5,Supercon,Ba0.5K0.5Fe1.88Zn0.12As2,MP-mp-1223517,K1Ba1Fe4As4,As-Ba-Fe-K,As40Ba10Fe40K10,C m m m,orthorhombic,5.479027,5.480024002658328,7.13170472,data/final/MP/cifs/As2Ba0.5Fe1.88K0.5Zn0.12-MP-mp-1223517-synth_doped.cif,data/source/MP/raw/cifs/mp-1223517.cif,mp-1223517,0.0,,2019-01-12 23:54:03.876000,5.87534599912672,,,{'GGA': {'task_id': 'mp-1743010'}},0.0132513644999994,4.21185628,520.0,-59.66633886,-5.966633886,{'tags': []},-59.66633886,-5.966633886,-0.4120461663000007,[],False,[],True,2021-05-12 11:00:52.054000,FM,10,4,mp-1223517,,KBa(FeAs)4,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",GGA,mp-1223517,"['mp-1223517', 'mp-1396881', 'mp-1743010', 'mp-1827585']",0.9947188,"{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",197.6961518155852,[],FM,True,65,1,"[0.0, 0.0, 0.3, 0.3, 0.3, 0.3, 0.0, 0.0, 0.0, 0.0]",0.0050315536790412,0.9947188,4,0.9947188,MP,data/source/MP/cleaned/cifs/MP-mp-1223517.cif,True,,data/final/MP/graphs/As2Ba0.5Fe1.88K0.5Zn0.12-MP-mp-1223517-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ir2Th1,1,0.0,2.0,False,Ir4Th2,Ir4Th2,6.11,Other,True,Ir66.667Th33.333,Ir-Th,2,Supercon,Ir2Th1,MP-mp-1187,Th2Ir4,Ir-Th,Ir66.667Th33.333,F d -3 m,cubic,5.45579126,5.45579126,5.45579126,data/final/MP/cifs/Ir2Th1-MP-mp-1187.cif,data/source/MP/raw/cifs/mp-1187.cif,mp-1187,0.0,,2011-05-13 08:24:56,17.82929828099463,10.17188/1188440,"@misc{osti_1188440,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ThIr2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188440"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1674377'}},0.0,9.20830531,520.0,-55.18109661,-9.196849435,"{'tags': ['Iridium thorium (2/1)', 'Thorium iridium (1/2)']}",-55.18109661,-9.196849435,-0.8332764049999994,"['xas', 'elasticity', 'bandstructure']",True,"[104572, 641099, 641106, 104571, 641094, 150742, 641102]",True,2021-05-12 10:56:12.755000,NM,6,8,mp-1187,,ThIr2,"{'functional': 'PBE', 'labels': ['Th', 'Ir'], 'pot_type': 'paw'}","{'Th': 1.0, 'Ir': 2.0}",GGA,mp-1187,"['mp-990623', 'mp-1187', 'mp-914552', 'mp-1439466', 'mp-1674377', 'mp-1803101', 'mp-992717', 'mp-1597100']",0.00093205,"{'Th': 2.0, 'Ir': 4.0}",114.83076035455412,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",1.6233455166928805e-05,0.00093205,0,0.0018641,MP,data/source/MP/cleaned/cifs/MP-mp-1187.cif,False,,data/final/MP/graphs/Ir2Th1-MP-mp-1187.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Re1Ta1,1,0.0,1.0,True,Re1Ta1,Re1Ta1,0.65,Other,True,Re50Ta50,Re-Ta,2,Supercon,Re1Ta1,MP-mp-1217894,Ta1Re1,Re-Ta,Re50Ta50,C m m m,orthorhombic,2.80338206,2.80338206,4.467671,data/final/MP/cifs/Re1Ta1-MP-mp-1217894.cif,data/source/MP/raw/cifs/mp-1217894.cif,mp-1217894,0.0,,2019-01-12 19:09:16.930000,18.529271914578253,,,{'GGA': {'task_id': 'mp-1674724'}},0.0,6.8676142,520.0,-24.70207745,-12.351038725,{'tags': []},-24.70207745,-12.351038725,-0.1998863175000007,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,2,5,mp-1217894,,TaRe,"{'functional': 'PBE', 'labels': ['Ta_pv', 'Re_pv'], 'pot_type': 'paw'}","{'Ta': 1.0, 'Re': 1.0}",GGA,mp-1217894,"['mp-1217894', 'mp-1423594', 'mp-1674724', 'mp-1791910', 'mp-1611781']",0.0002459,"{'Ta': 1.0, 'Re': 1.0}",32.903344747893826,[],NM,False,65,0,"[0, 0]",7.473404357036994e-06,0.0002459,0,0.0002459,MP,data/source/MP/cleaned/cifs/MP-mp-1217894.cif,False,,data/final/MP/graphs/Re1Ta1-MP-mp-1217894.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Bi1La0.85S2Th0.15O1,3,0.06,2.0,False,Bi2La1.7S4Th0.3O2,Bi2La2S4O2,2.85,Oxide,True,Bi20La17S40Th3O20,Bi-La-S-Th-O,5,Supercon,La0.85Th0.15Bi1S2O1,MP-mp-1078397,La2Bi2S4O2,Bi-La-S-O,Bi20La20S40O20,P 4/n m m,tetragonal,4.055497,4.055497,14.173265,data/final/MP/cifs/Bi1La0.85S2Th0.15O1-MP-mp-1078397-synth_doped.cif,data/source/MP/raw/cifs/mp-1078397.cif,mp-1078397,1.0743999999999998,,2018-04-11 10:57:38,6.097899749460756,,,{'GGA': {'task_id': 'mp-1676377'}},0.0053330699999989,4.69184382,520.0,-61.66700475,-6.166700475,{'tags': ['Lanthanum bismuth oxodisulphate']},-61.66700475,-6.166700475,-2.09592004425,['bandstructure'],True,[196231],True,2021-05-12 10:58:14.654000,NM,10,5,mp-1078397,oxide,LaBiS2O,"{'functional': 'PBE', 'labels': ['La', 'Bi', 'S', 'O'], 'pot_type': 'paw'}","{'La': 1.0, 'Bi': 1.0, 'S': 2.0, 'O': 1.0}",GGA,mp-1078397,"['mp-1078397', 'mp-1380859', 'mp-1676377', 'mp-1776923', 'mp-1600973']",6.57e-05,"{'La': 2.0, 'Bi': 2.0, 'S': 4.0, 'O': 2.0}",233.1084819815865,[],NM,False,129,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.636860524465146e-07,6.57e-05,0,0.0001314,MP,data/source/MP/cleaned/cifs/MP-mp-1078397.cif,True,,data/final/MP/graphs/Bi1La0.85S2Th0.15O1-MP-mp-1078397-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B2Pr1Ru3,1,0.0,1.0,True,B2Pr1Ru3,B2Pr1Ru3,0.0,Heavy_fermion,True,B33.333Pr16.667Ru50,B-Pr-Ru,3,Supercon,Pr1Ru3B2,MP-mp-5939,Pr1B2Ru3,B-Pr-Ru,B33.333Pr16.667Ru50,P 6/m m m,hexagonal,3.052432,5.586162004780046,5.58616183,data/final/MP/cifs/B2Pr1Ru3-MP-mp-5939.cif,data/source/MP/raw/cifs/mp-5939.cif,mp-5939,0.0,,2011-05-13 08:07:24,9.375374963885646,10.17188/1277193,"@misc{osti_1277193,
    author = ""Persson, Kristin"",
    title = ""Materials Data on PrB2Ru3 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277193"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696519'}},0.0270357249999975,6.61897606,520.0,-48.2908011,-8.04846685,"{'tags': ['Praseodymium ruthenium boride (1/3/2)', 'Ruthenium praseodymium boride (3/1/2)']}",-48.2908011,-8.04846685,-0.3879915747222225,"['xas', 'bandstructure']",True,"[615201, 44551]",True,2021-05-12 10:57:26.891000,NM,6,8,mp-5939,,PrB2Ru3,"{'functional': 'PBE', 'labels': ['Pr_3', 'B', 'Ru_pv'], 'pot_type': 'paw'}","{'Pr': 1.0, 'B': 2.0, 'Ru': 3.0}",GGA,mp-5939,"['mp-1007270', 'mp-1000816', 'mp-5939', 'mp-1440499', 'mp-1696519', 'mp-1801958', 'mp-1012010', 'mp-1595295']",0.0065628,"{'Pr': 1.0, 'B': 2.0, 'Ru': 3.0}",82.49044829339626,[],NM,False,191,0,"[0, 0, 0, 0, 0, 0]",7.955830203101687e-05,0.0065628,0,0.0065628,MP,data/source/MP/cleaned/cifs/MP-mp-5939.cif,False,,data/final/MP/graphs/B2Pr1Ru3-MP-mp-5939.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Pt8Ti1,1,0.0,1.0,True,Pt8Ti1,Pt8Ti1,0.0,Other,True,Pt88.889Ti11.111,Pt-Ti,2,Supercon,Pt8Ti1,MP-mp-30852,Ti1Pt8,Pt-Ti,Pt88.889Ti11.111,I 4/m m m,tetragonal,3.940330000649949,6.277291659544549,6.27729166,data/final/MP/cifs/Pt8Ti1-MP-mp-30852.cif,data/source/MP/raw/cifs/mp-30852.cif,mp-30852,0.0,,2014-02-24 05:13:09,19.082725895430062,10.17188/1205208,"@misc{osti_1205208,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TiPt8 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1205208"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697470'}},0.0,7.43604478,520.0,-60.37475542,-6.708306157777778,{'tags': ['Platinum titanium (8/1)']},-60.37475542,-6.708306157777778,-0.4346668581481481,"['xas', 'elasticity', 'bandstructure']",True,[105818],True,2021-05-12 10:56:18.721000,NM,9,8,mp-30852,,TiPt8,"{'functional': 'PBE', 'labels': ['Ti_pv', 'Pt'], 'pot_type': 'paw'}","{'Ti': 1.0, 'Pt': 8.0}",GGA,mp-30852,"['mp-932784', 'mp-943084', 'mp-942057', 'mp-30852', 'mp-1428193', 'mp-1697470', 'mp-1778933', 'mp-1595450']",0.000352,"{'Ti': 1.0, 'Pt': 8.0}",139.97171390956044,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0]",2.5147938120371725e-06,0.000352,0,0.000352,MP,data/source/MP/cleaned/cifs/MP-mp-30852.cif,False,,data/final/MP/graphs/Pt8Ti1-MP-mp-30852.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Pb2Pd1,1,0.0,2.0,False,Pb4Pd2,Pb4Pd2,2.98,Other,True,Pb66.667Pd33.333,Pb-Pd,2,Supercon,Pb2Pd1,MP-mp-20599,Pd2Pb4,Pb-Pd,Pb66.667Pd33.333,I 4/m c m,tetragonal,5.792968279411648,5.79296828,5.792968279999999,data/final/MP/cifs/Pb2Pd1-MP-mp-20599.cif,data/source/MP/raw/cifs/mp-20599.cif,mp-20599,0.0,,2014-02-21 15:22:02,11.782374733863442,10.17188/1195737,"@misc{osti_1195737,
    author = ""Persson, Kristin"",
    title = ""Materials Data on PdPb2 (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195737"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704007'}},0.0,7.03655028,520.0,-26.44022088,-4.40670348,"{'tags': ['Palladium lead (1/2)', 'Lead palladium (2/1)']}",-26.44022088,-4.40670348,-0.2049781633333331,"['xas', 'elasticity', 'bandstructure']",True,"[102803, 105590]",True,2021-05-12 10:56:14.760000,NM,6,8,mp-20599,,PdPb2,"{'functional': 'PBE', 'labels': ['Pd', 'Pb_d'], 'pot_type': 'paw'}","{'Pd': 1.0, 'Pb': 2.0}",GGA,mp-20599,"['mp-941553', 'mp-934771', 'mp-941244', 'mp-20599', 'mp-1433135', 'mp-1704007', 'mp-1779126', 'mp-1588239']",0.00015895,"{'Pd': 2.0, 'Pb': 4.0}",146.80265671418346,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0]",2.165492145138309e-06,0.00015895,0,0.0003179,MP,data/source/MP/cleaned/cifs/MP-mp-20599.cif,False,,data/final/MP/graphs/Pb2Pd1-MP-mp-20599.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Bi4Te3,1,0.0,1.0,True,Bi4Te3,Bi4Te3,3.5,Other,True,Bi57.143Te42.857,Bi-Te,2,Supercon,Bi4Te3,MP-mp-28229,Bi4Te3,Bi-Te,Bi57.143Te42.857,R -3 m,trigonal,4.51000310050356,4.51000310050356,14.47415103,data/final/MP/cifs/Bi4Te3-MP-mp-28229.cif,data/source/MP/raw/cifs/mp-28229.cif,mp-28229,0.2557,,2014-02-19 17:23:08,8.069002640435489,10.17188/1202355,"@misc{osti_1202355,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Bi4Te3 (SG:166) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1202355"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1754995'}},0.0,5.24362344,520.0,-26.19682052,-3.7424029314285714,{'tags': []},-26.19682052,-3.7424029314285714,-0.3532543557142859,['bandstructure'],True,[],True,2021-05-12 10:58:49.477000,NM,7,8,mp-28229,,Bi4Te3,"{'functional': 'PBE', 'labels': ['Bi', 'Te'], 'pot_type': 'paw'}","{'Bi': 4.0, 'Te': 3.0}",GGA,mp-28229,"['mp-915876', 'mp-932364', 'mp-931403', 'mp-28229', 'mp-1400822', 'mp-1754995', 'mp-1880219', 'mp-1622782']",0.0,"{'Bi': 4.0, 'Te': 3.0}",250.80358977302745,[],NM,False,166,0,"[0, 0, 0, 0, 0, 0, 0]",0.0,0.0,0,0.0,MP,data/source/MP/cleaned/cifs/MP-mp-28229.cif,False,,data/final/MP/graphs/Bi4Te3-MP-mp-28229.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ni29Zr71,3,0.0866666666666666,0.0563414278776104,False,Ni1.634Zr4,Ni2Zr4,2.78,Other,True,Ni29Zr71,Ni-Zr,2,Supercon,Ni29Zr71,MP-mp-328,Zr4Ni2,Ni-Zr,Ni33.333Zr66.667,I 4/m c m,tetragonal,5.262569995425936,5.300086679397286,5.30008668,data/final/MP/cifs/Ni29Zr71-MP-mp-328-synth_doped.cif,data/source/MP/raw/cifs/mp-328.cif,mp-328,0.0,,2011-05-13 23:00:52,7.189329355994663,10.17188/1206385,"@misc{osti_1206385,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Zr2Ni (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1206385"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704571'}},0.0,5.05377097,520.0,-47.68946569,-7.948244281666667,{'tags': ['Nickel zirconium (1/2)']},-47.68946569,-7.948244281666667,-0.3230649683333328,"['xas', 'elasticity', 'bandstructure']",True,"[656070, 647167, 102805, 105479]",True,2021-05-12 10:56:20.740000,NM,6,11,mp-328,,Zr2Ni,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Ni_pv'], 'pot_type': 'paw'}","{'Zr': 2.0, 'Ni': 1.0}",GGA,mp-328,"['mp-918996', 'mp-919988', 'mp-906163', 'mp-604722', 'mp-328', 'mp-1076983', 'mp-1205320', 'mp-1413019', 'mp-1704571', 'mp-1802467', 'mp-1592827']",0.00134705,"{'Zr': 4.0, 'Ni': 2.0}",111.39417752247834,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0]",2.4185285621920005e-05,0.00134705,0,0.0026941,MP,data/source/MP/cleaned/cifs/MP-mp-328.cif,True,,data/final/MP/graphs/Ni29Zr71-MP-mp-328-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
In2Mo6Se6,1,0.0,1.0,True,In2Mo6Se6,In2Mo6Se6,0.7125,Chevrel,True,In14.286Mo42.857Se42.857,In-Mo-Se,3,Supercon,In2Mo6Se6,MP-mp-20152,In2Mo6Se6,In-Mo-Se,In14.286Mo42.857Se42.857,P 63/m,hexagonal,4.513454,9.207621998665529,9.20762238,data/final/MP/cifs/In2Mo6Se6-MP-mp-20152.cif,data/source/MP/raw/cifs/mp-20152.cif,mp-20152,0.3845,,2014-02-22 19:29:20,6.409102625764977,10.17188/1195295,"@misc{osti_1195295,
    author = ""Persson, Kristin"",
    title = ""Materials Data on In(MoSe)3 (SG:176) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195295"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668657'}},0.0091664292857132,5.09490929,520.0,-97.50244134,-6.964460095714286,"{'tags': ['Indium molybdenum selenide (1/3/3)', 'Indium molybdenum(I) selenide (1/3/3)']}",-97.50244134,-6.964460095714286,-0.6272676310044645,"['xas', 'bandstructure']",True,"[640009, 604502, 603626, 640016, 53098]",True,2021-05-12 10:56:57.051000,NM,14,10,mp-20152,,In(MoSe)3,"{'functional': 'PBE', 'labels': ['In_d', 'Mo_pv', 'Se'], 'pot_type': 'paw'}","{'In': 1.0, 'Mo': 3.0, 'Se': 3.0}",GGA,mp-20152,"['mp-940150', 'mp-924026', 'mp-940573', 'mp-20152', 'mp-1104442', 'mp-1104683', 'mp-1431328', 'mp-1668657', 'mp-1811832', 'mp-1604030']",0.0001155,"{'In': 2.0, 'Mo': 6.0, 'Se': 6.0}",331.3863686703401,[],NM,False,176,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.97071520856057e-07,0.0001155,0,0.000231,MP,data/source/MP/cleaned/cifs/MP-mp-20152.cif,False,,data/final/MP/graphs/In2Mo6Se6-MP-mp-20152.json,0,True,6/m,0,3,0,0,0,0,0,1,0,0,0,1.0,False
B0.027C0.973Cu1Sr2O5,2,0.006,4.0,False,B0.108C3.892Cu4Sr8O20,C4Cu4Sr8O20,0.0,Cuprate,True,B0.3C10.811Cu11.111Sr22.222O55.55555555555556,B-C-Cu-Sr-O,5,Supercon,Sr2Cu1C0.973B0.027O5,MP-mp-1198030,Sr8Cu4C4O20,C-Cu-Sr-O,C11.111Cu11.111Sr22.222O55.55555555555556,I -4,tetragonal,7.877744002100394,7.877744002100395,9.46755054,data/final/MP/cifs/B0.027C0.973Cu1Sr2O5-MP-mp-1198030-synth_doped.cif,data/source/MP/raw/cifs/mp-1198030.cif,mp-1198030,0.0,,2019-01-12 02:53:33.853000,4.624821022244182,,,{'GGA': {'task_id': 'mp-1742814'}},0.0386187874999981,3.47889523,520.0,-237.90163358,-6.608378710555556,"{'tags': ['Distrontium copper dioxide carbonate - LT', 'Distrontium copper dioxide carbonate']}",-237.90163358,-6.608378710555556,-2.385069899259259,['bandstructure'],True,"[78650, 83095]",True,2021-05-12 10:58:37.524000,NM,36,6,mp-1198030,oxide,Sr2CuCO5,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Cu_pv', 'C', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Cu': 1.0, 'C': 1.0, 'O': 5.0}",GGA,mp-1198030,"['mp-1198030', 'mp-1200477', 'mp-1399692', 'mp-1742814', 'mp-1929945', 'mp-1655225']",0.000743875,"{'Sr': 8.0, 'Cu': 4.0, 'C': 4.0, 'O': 20.0}",475.08507610840775,[],NM,False,82,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.263088759540475e-06,0.000743875,0,0.0029755,MP,data/source/MP/cleaned/cifs/MP-mp-1198030.cif,True,,data/final/MP/graphs/B0.027C0.973Cu1Sr2O5-MP-mp-1198030-synth_doped.json,0,True,-4,0,0,0,0,2,0,0,0,0,1,0,1.0,False
B1Mn2,1,0.0,2.0,False,B2Mn4,B2Mn4,0.0,Other,True,B33.333Mn66.667,B-Mn,2,Supercon,B1Mn2,MP-mp-20318,Mn4B2,B-Mn,B33.333Mn66.667,I 4/m c m,tetragonal,4.103889997835049,4.128524329700972,4.128524330000001,data/final/MP/cifs/B1Mn2-MP-mp-20318.cif,data/source/MP/raw/cifs/mp-20318.cif,mp-20318,0.0,,2014-02-21 09:14:29,7.60981702293654,10.17188/1195442,"@misc{osti_1195442,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Mn2B (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195442"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671088'}},0.0,7.71831403,520.0,-52.38837127,-8.731395211666667,"{'tags': ['Manganese boride (2/1) - epsilon', 'Manganese boride (2/1)']}",-52.38837127,-8.731395211666667,-0.3969210933429122,"['xas', 'elasticity', 'bandstructure']",True,"[42529, 614741, 76629, 614726, 614745]",True,2021-05-12 10:56:14.760000,NM,6,13,mp-20318,,Mn2B,"{'functional': 'PBE', 'labels': ['Mn_pv', 'B'], 'pot_type': 'paw'}","{'Mn': 2.0, 'B': 1.0}",GGA,mp-20318,"['mp-924870', 'mp-925435', 'mp-909839', 'mp-20318', 'mp-1072268', 'mp-1072291', 'mp-1072336', 'mp-1077052', 'mp-1439643', 'mp-1671088', 'mp-1793328', 'mp-1595796', 'mp-1072312']",0.01365015,"{'Mn': 4.0, 'B': 2.0}",52.670288175190834,[],NM,False,140,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0005183244851289,0.01365015,0,0.0273003,MP,data/source/MP/cleaned/cifs/MP-mp-20318.cif,False,,data/final/MP/graphs/B1Mn2-MP-mp-20318.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Mo1P1Ru1,1,0.0,4.0,False,Mo4P4Ru4,Mo4P4Ru4,15.5,Other,True,Mo33.333P33.333Ru33.333,Mo-P-Ru,3,Supercon,Mo1Ru1P1,MP-mp-22451,Mo4P4Ru4,Mo-P-Ru,Mo33.333P33.333Ru33.333,P n m a,orthorhombic,3.901803,6.044816,6.978545,data/final/MP/cifs/Mo1P1Ru1-MP-mp-22451.cif,data/source/MP/raw/cifs/mp-22451.cif,mp-22451,0.0,,2014-02-22 14:39:38,9.200251450554282,10.17188/1198296,"@misc{osti_1198296,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MoPRu (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198296"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703338'}},0.0,9.62182776,520.0,-108.42754301,-9.035628584166666,"{'tags': ['Molybdenum ruthenium phosphide (1/1/1) - o', 'Molybdenum ruthenium phosphide (1/1/1)']}",-108.42754301,-9.035628584166666,-0.5245168536111109,"['xas', 'bandstructure']",True,"[644094, 98405]",True,2021-05-12 10:56:59.077000,NM,12,10,mp-22451,,MoPRu,"{'functional': 'PBE', 'labels': ['Mo_pv', 'P', 'Ru_pv'], 'pot_type': 'paw'}","{'Mo': 1.0, 'P': 1.0, 'Ru': 1.0}",GGA,mp-22451,"['mp-943261', 'mp-942256', 'mp-933061', 'mp-22451', 'mp-1095602', 'mp-1237626', 'mp-1421864', 'mp-1703338', 'mp-1835311', 'mp-1597609']",0.0001847,"{'Mo': 4.0, 'P': 4.0, 'Ru': 4.0}",164.59373763252032,[],NM,False,11,0,"[-0.0, 0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",4.488627639342387e-06,0.0001847,0,0.0007388,MP,data/source/MP/cleaned/cifs/MP-mp-22451.cif,False,,data/final/MP/graphs/Mo1P1Ru1-MP-mp-22451.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ir2Si2Th1,1,0.0,2.0,False,Ir4Si4Th2,Ir4Si4Th2,2.215,Other,True,Ir40Si40Th20,Ir-Si-Th,3,Supercon,Th1Ir2Si2,MP-mp-1080037,Th2Si4Ir4,Ir-Si-Th,Ir40Si40Th20,P 4/n m m,tetragonal,4.192112,4.192112,9.98765,data/final/MP/cifs/Ir2Si2Th1-MP-mp-1080037.cif,data/source/MP/raw/cifs/mp-1080037.cif,mp-1080037,0.0,,2018-04-17 07:08:27,12.72725336404796,,,{'GGA': {'task_id': 'mp-1688291'}},0.0,9.1218571,520.0,-82.93690785,-8.293690784999999,{'tags': ['Iridium thorium silicide (2/1/2)']},-82.93690785,-8.293690784999999,-1.1054213590000004,['bandstructure'],True,"[603978, 641013]",True,2021-05-12 10:58:16.596000,NM,10,7,mp-1080037,,Th(SiIr)2,"{'functional': 'PBE', 'labels': ['Th', 'Si', 'Ir'], 'pot_type': 'paw'}","{'Th': 1.0, 'Si': 2.0, 'Ir': 2.0}",GGA,mp-1080037,"['mp-1080037', 'mp-1095103', 'mp-1265828', 'mp-1301003', 'mp-1688291', 'mp-1780688', 'mp-1602507']",0.001165,"{'Th': 2.0, 'Si': 4.0, 'Ir': 4.0}",175.52099373813627,[],NM,False,129,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.3274765316542018e-05,0.001165,0,0.00233,MP,data/source/MP/cleaned/cifs/MP-mp-1080037.cif,False,,data/final/MP/graphs/Ir2Si2Th1-MP-mp-1080037.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Li1.16Ti1.84O4,3,0.0457142857142856,2.0,False,Li2.32Ti3.68O8,Li2Ti4O8,8.3,Oxide,True,Li16.571Ti26.286O57.142857142857146,Li-Ti-O,3,Supercon,Li1.16Ti1.84O4,MP-mp-5670,Li2Ti4O8,Li-Ti-O,Li14.286Ti28.571O57.142857142857146,F d -3 m,cubic,5.986032260000001,5.98603226,5.98603226,data/final/MP/cifs/Li1.16Ti1.84O4-MP-mp-5670-synth_doped.cif,data/source/MP/raw/cifs/mp-5670.cif,mp-5670,0.0,,2011-05-14 11:10:22,3.649565337909552,10.17188/1273637,"@misc{osti_1273637,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LiTi2O4 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1273637"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699404'}},0.0,5.03116805,520.0,-114.93444733,-8.209603380714286,"{'tags': ['Lithium titanium oxide (1/2/4)', 'Lithium titanium(III) titanium(IV) oxide', 'Lithium titanium(III) titanium oxide', 'Lithium titanium titanium(III) oxide', 'Lithium titano(III)titanate', 'Spinel-(Li,Ti)']}",-114.93444733,-8.209603380714286,-3.2462103921428564,"['bandstructure', 'elasticity']",True,"[72859, 78482, 154982, 81329, 15789, 48127]",True,2021-05-12 10:56:22.739000,NM,14,7,mp-5670,oxide,LiTi2O4,"{'functional': 'PBE', 'labels': ['Li_sv', 'Ti_pv', 'O'], 'pot_type': 'paw'}","{'Li': 1.0, 'Ti': 2.0, 'O': 4.0}",GGA,mp-5670,"['mp-923613', 'mp-922835', 'mp-908534', 'mp-5670', 'mp-1418091', 'mp-1699404', 'mp-1787951']",0.0521081,"{'Li': 2.0, 'Ti': 4.0, 'O': 8.0}",151.67086379131675,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0006871207652868,0.0521081,0,0.1042162,MP,data/source/MP/cleaned/cifs/MP-mp-5670.cif,True,,data/final/MP/graphs/Li1.16Ti1.84O4-MP-mp-5670-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Hf1In1Pd2,1,0.0,1.0,True,Hf1In1Pd2,Hf1In1Pd2,2.63,Other,True,Hf25In25Pd50,Hf-In-Pd,3,Supercon,Hf1Pd2In1,MP-mp-864734,Hf1In1Pd2,Hf-In-Pd,Hf25In25Pd50,F m -3 m,cubic,4.665261440000001,4.66526144,4.66526144,data/final/MP/cifs/Hf1In1Pd2-MP-mp-864734.cif,data/source/MP/raw/cifs/mp-864734.cif,mp-864734,0.0,,2014-08-29 23:15:32,11.7061385767382,10.17188/1310113,"@misc{osti_1310113,
    author = ""Persson, Kristin"",
    title = ""Materials Data on HfInPd2 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1310113"",
    place = ""United States"",
    year = ""2016"",
    month = ""8"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1765909'}},0.0,6.84438464,520.0,-25.82379811,-6.4559495275,{'tags': []},-25.82379811,-6.4559495275,-0.6887904774999996,"['bandstructure', 'elasticity']",True,[],True,2021-05-12 10:56:31.128000,NM,4,11,mp-864734,,HfInPd2,"{'functional': 'PBE', 'labels': ['Hf_pv', 'In_d', 'Pd'], 'pot_type': 'paw'}","{'Hf': 1.0, 'In': 1.0, 'Pd': 2.0}",GGA,mp-864734,"['mp-1003012', 'mp-864734', 'mp-1004560', 'mp-1051462', 'mp-1051465', 'mp-1419539', 'mp-1765909', 'mp-1801418', 'mp-1010238', 'mp-1613927', 'mp-1051471']",5.7e-05,"{'Hf': 1.0, 'In': 1.0, 'Pd': 2.0}",71.79810165169323,[],NM,False,225,0,"[0, 0, 0, 0]",7.938928563392701e-07,5.7e-05,0,5.7e-05,MP,data/source/MP/cleaned/cifs/MP-mp-864734.cif,False,,data/final/MP/graphs/Hf1In1Pd2-MP-mp-864734.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ce0.95Co1In5Nd0.05,2,0.0142857142857142,1.0,True,Ce0.95Co1In5Nd0.05,Ce1Co1In5,1.95,Heavy_fermion,True,Ce13.571Co14.286In71.429Nd0.714,Ce-Co-In-Nd,4,Supercon,Ce0.95Nd0.05Co1In5,MP-mp-19961,Ce1In5Co1,Ce-Co-In,Ce14.286Co14.286In71.429,P 4/m m m,tetragonal,4.635989,4.635989,7.564124,data/final/MP/cifs/Ce0.95Co1In5Nd0.05-MP-mp-19961-synth_doped.cif,data/source/MP/raw/cifs/mp-19961.cif,mp-19961,0.0,,2014-02-21 14:08:25,7.897022127398995,10.17188/1195145,"@misc{osti_1195145,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeIn5Co (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195145"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701944'}},0.0,7.80626318,520.0,-28.52795357,-4.075421938571429,{'tags': ['Cerium cobalt indium (1/1/5)']},-28.52795357,-4.075421938571429,-0.2468754242857146,"['xas', 'bandstructure']",True,[102108],True,2021-05-12 10:56:57.051000,FM,7,8,mp-19961,,CeIn5Co,"{'functional': 'PBE', 'labels': ['Ce', 'In_d', 'Co'], 'pot_type': 'paw'}","{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",GGA,mp-19961,"['mp-928775', 'mp-912209', 'mp-928270', 'mp-19961', 'mp-1504062', 'mp-1701944', 'mp-1785253', 'mp-1593180']",0.9310323,"{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",162.57113333428427,[],FM,True,123,1,"[0.7, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0057269226147644,0.9310323,1,0.9310323,MP,data/source/MP/cleaned/cifs/MP-mp-19961.cif,True,,data/final/MP/graphs/Ce0.95Co1In5Nd0.05-MP-mp-19961-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ge2.25La1Pt1.75,3,0.1,1.0,True,Ge2.25La1Pt1.75,Ge2La1Pt2,0.0,Other,True,Ge45La20Pt35,Ge-La-Pt,3,Supercon,La1Pt1.75Ge2.25,MP-mp-21057,La1Ge2Pt2,Ge-La-Pt,Ge40La20Pt40,I 4/m m m,tetragonal,4.458128002603763,4.458128002603763,5.96043246,data/final/MP/cifs/Ge2.25La1Pt1.75-MP-mp-21057-synth_doped.cif,data/source/MP/raw/cifs/mp-21057.cif,mp-21057,0.0,,2014-02-21 09:25:11,11.137876633950224,10.17188/1196317,"@misc{osti_1196317,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La(GePt)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196317"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704515'}},0.0973405535000013,6.85937735,520.0,-30.67754438,-6.135508876,{'tags': ['Lanthanum platinum germanide (1/2/2)']},-30.67754438,-6.135508876,-0.8707332289999996,"['xas', 'bandstructure']",True,[53665],True,2021-05-12 10:56:57.051000,NM,5,8,mp-21057,,La(GePt)2,"{'functional': 'PBE', 'labels': ['La', 'Ge_d', 'Pt'], 'pot_type': 'paw'}","{'La': 1.0, 'Ge': 2.0, 'Pt': 2.0}",GGA,mp-21057,"['mp-993642', 'mp-991893', 'mp-21057', 'mp-1429115', 'mp-1704515', 'mp-1783057', 'mp-994947', 'mp-1591906']",0.003651,"{'La': 1.0, 'Ge': 2.0, 'Pt': 2.0}",100.53893739664449,[],NM,False,139,0,"[0, 0, 0, 0, 0]",3.631428871777447e-05,0.003651,0,0.003651,MP,data/source/MP/cleaned/cifs/MP-mp-21057.cif,True,,data/final/MP/graphs/Ge2.25La1Pt1.75-MP-mp-21057-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Co1Na0.74O2,3,0.1042780748663101,1.0,True,Co1Na0.74O2,Co1Na1O2,0.0,Oxide,True,Co26.738Na19.786O53.475935828877,Co-Na-O,3,Supercon,Na0.74Co1O2,MP-mp-18921,Na1Co1O2,Co-Na-O,Co25Na25O50,R -3 m,trigonal,2.919871454834869,2.919871454834869,5.5138631,data/final/MP/cifs/Co1Na0.74O2-MP-mp-18921-synth_doped.cif,data/source/MP/raw/cifs/mp-18921.cif,mp-18921,2.1838999999999995,,2013-06-06 02:16:11,4.8803582437020205,10.17188/1193659,"@misc{osti_1193659,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NaCoO2 (SG:166) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1193659"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-1688208'}},0.0,3.15019832,520.0,-21.58895337,-5.3972383425,"{'tags': ['Sodium cobalt(III) oxide', 'Sodium dioxocobaltate']}",-21.58895337,-5.3972383425,-1.5685470678879303,"['diel', 'xas', 'elasticity', 'bandstructure']",True,"[96428, 6152]",True,2021-05-12 10:56:22.739000,NM,4,18,mp-18921,oxide,NaCoO2,"{'functional': 'PBE', 'labels': ['Na_pv', 'Co', 'O'], 'pot_type': 'paw'}","{'Na': 1.0, 'Co': 1.0, 'O': 2.0}",GGA+U,mp-18921,"['mp-818780', 'mp-818928', 'mp-607800', 'mp-554427', 'mp-578616', 'mp-18921', 'mp-578617', 'mp-1141837', 'mp-578608', 'mp-578607', 'mp-545943', 'mp-825450', 'mp-835011', 'mp-1476080', 'mp-1688208', 'mp-1793641', 'mp-835772', 'mp-1595307']",2.85e-05,"{'Na': 1.0, 'Co': 1.0, 'O': 2.0}",38.76181433341651,[],NM,False,166,0,"[0, 0, 0, 0]",7.352597005612864e-07,2.85e-05,0,2.85e-05,MP,data/source/MP/cleaned/cifs/MP-mp-18921.cif,True,,data/final/MP/graphs/Co1Na0.74O2-MP-mp-18921-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ge2Pd1.9Pt0.1Sr1,2,0.04,1.0,True,Ge2Pd1.9Pt0.1Sr1,Ge2Pd2Sr1,2.89,Other,True,Ge40Pd38Pt2Sr20,Ge-Pd-Pt-Sr,4,Supercon,Sr1Pd1.9Pt0.1Ge2,MP-mp-978986,Sr1Ge2Pd2,Ge-Pd-Sr,Ge40Pd40Sr20,I 4/m m m,tetragonal,4.438671999438209,4.438671999438209,6.03054834,data/final/MP/cifs/Ge2Pd1.9Pt0.1Sr1-MP-mp-978986-synth_doped.cif,data/source/MP/raw/cifs/mp-978986.cif,mp-978986,0.0,,2015-10-09 03:56:43,7.295677176868866,10.17188/1316057,"@misc{osti_1316057,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr(GePd)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1316057"",
    place = ""United States"",
    year = ""2016"",
    month = ""9"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688092'}},0.0,4.0155429,520.0,-24.8627221,-4.97254442,"{'tags': ['Strontium palladium germanide (1/2/2)', 'Strontium palladium germanium (1/2/2)', 'High pressure experimental phase']}",-24.8627221,-4.97254442,-0.7134818633333324,"['xas', 'elasticity', 'bandstructure']",True,"[165985, 181157, 181155, 181156, 168133]",True,2021-05-12 10:56:37.246000,NM,5,9,mp-978986,,Sr(GePd)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ge_d', 'Pd'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Ge': 2.0, 'Pd': 2.0}",GGA,mp-978986,"['mp-1005776', 'mp-978986', 'mp-1005866', 'mp-979737', 'mp-1438850', 'mp-1688092', 'mp-1782349', 'mp-1011093', 'mp-1589601']",0.0012593,"{'Sr': 1.0, 'Ge': 2.0, 'Pd': 2.0}",101.45304755163892,[],NM,False,139,0,"[0, 0, 0, 0, 0]",1.2412638460752248e-05,0.0012593,0,0.0012593,MP,data/source/MP/cleaned/cifs/MP-mp-978986.cif,True,,data/final/MP/graphs/Ge2Pd1.9Pt0.1Sr1-MP-mp-978986-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Cu1La1.77Sr0.23O4,3,0.0657142857142857,1.0,True,Cu1La1.77Sr0.23O4,Cu1La2O4,21.15,Cuprate,True,Cu14.286La25.286Sr3.286O57.142857142857146,Cu-La-Sr-O,4,Supercon,La1.77Sr0.23Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La1.77Sr0.23O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La1.77Sr0.23O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ca1.8Cl2Cu1K0.2O2,3,0.0571428571428571,1.0,True,Ca1.8Cl2Cu1K0.2O2,Ca2Cl2Cu1O2,24.0,Cuprate,True,Ca25.714Cl28.571Cu14.286K2.857O28.571428571428573,Ca-Cl-Cu-K-O,5,Supercon,Ca1.8K0.2Cu1Cl2O2,MP-mp-23143,Ca2Cu1Cl2O2,Ca-Cl-Cu-O,Ca28.571Cl28.571Cu14.286O28.571428571428573,I 4/m m m,tetragonal,3.88024600076171,3.880246000761709,8.12907187,data/final/MP/cifs/Ca1.8Cl2Cu1K0.2O2-MP-mp-23143-synth_doped.cif,data/source/MP/raw/cifs/mp-23143.cif,mp-23143,0.0,,2014-02-21 09:50:06,3.554337150605878,10.17188/1199263,"@misc{osti_1199263,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ca2Cu(ClO)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199263"",
    place = ""United States"",
    year = ""2016"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700223'}},0.0191527683333321,4.19679796,520.0,-35.95348475,-5.136212107142858,"{'tags': ['Dicalcium copper dioxide dichloride', 'Dicalcium dichlorodioxocuprate']}",-35.95348475,-5.136212107142858,-2.407440427142858,"['xas', 'elasticity', 'bandstructure']",True,"[1027, 83117, 41581]",True,2021-05-12 10:56:16.728000,NM,7,8,mp-23143,oxide,Ca2Cu(ClO)2,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Cu_pv', 'Cl', 'O'], 'pot_type': 'paw'}","{'Ca': 2.0, 'Cu': 1.0, 'Cl': 2.0, 'O': 2.0}",GGA,mp-23143,"['mp-992231', 'mp-990553', 'mp-23143', 'mp-1436301', 'mp-1700223', 'mp-1803462', 'mp-993865', 'mp-1592909']",0.0134962,"{'Ca': 2.0, 'Cu': 1.0, 'Cl': 2.0, 'O': 2.0}",115.21141865211318,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001171429026557,0.0134962,0,0.0134962,MP,data/source/MP/cleaned/cifs/MP-mp-23143.cif,True,,data/final/MP/graphs/Ca1.8Cl2Cu1K0.2O2-MP-mp-23143-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Si1.9Y1,2,0.0229885057471264,2.0,False,Si3.8Y2,Si4Y2,0.0,Other,True,Si65.517Y34.483,Si-Y,2,Supercon,Si1.9Y1,MP-mp-12769,Y2Si4,Si-Y,Si66.667Y33.333,I 41/a m d,tetragonal,3.995300002194591,3.995300002194591,7.819317710000001,data/final/MP/cifs/Si1.9Y1-MP-mp-12769-synth_doped.cif,data/source/MP/raw/cifs/mp-12769.cif,mp-12769,0.0,,2011-05-27 23:41:56,4.139842478163755,10.17188/1189176,"@misc{osti_1189176,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YSi2 (SG:141) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189176"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698596'}},0.0438692750000004,7.01000549,520.0,-37.92151639,-6.320252731666667,{'tags': ['Yttrium silicide (1/2) - HT']},-37.92151639,-6.320252731666667,-0.5005530138888888,"['xas', 'elasticity', 'bandstructure']",True,[150662],True,2021-05-12 10:56:12.755000,NM,6,14,mp-12769,,YSi2,"{'functional': 'PBE', 'labels': ['Y_sv', 'Si'], 'pot_type': 'paw'}","{'Y': 1.0, 'Si': 2.0}",GGA,mp-12769,"['mp-919587', 'mp-918579', 'mp-905391', 'mp-12769', 'mp-1071778', 'mp-1071760', 'mp-1071798', 'mp-1077276', 'mp-1143579', 'mp-1440469', 'mp-1698596', 'mp-1803016', 'mp-1586173', 'mp-1071796']",0.00013215,"{'Y': 2.0, 'Si': 4.0}",116.38403072337334,[],NM,False,141,0,"[0, 0, 0, 0, 0, 0]",2.2709301126389048e-06,0.00013215,0,0.0002643,MP,data/source/MP/cleaned/cifs/MP-mp-12769.cif,True,,data/final/MP/graphs/Si1.9Y1-MP-mp-12769-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As1Co1,1,0.0,4.0,False,As4Co4,As4Co4,0.0,Other,True,As50Co50,As-Co,2,Supercon,As1Co1,MP-mp-583,Co4As4,As-Co,As50Co50,P n m a,orthorhombic,3.468962,5.315718,5.824986,data/final/MP/cifs/As1Co1-MP-mp-583.cif,data/source/MP/raw/cifs/mp-583.cif,mp-583,0.0,,2011-05-13 06:03:36,8.277261201203343,10.17188/1277026,"@misc{osti_1277026,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CoAs (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277026"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668628'}},0.0,7.31502589,520.0,-49.47226812,-6.184033515,"{'tags': ['High pressure experimental phase', 'Modderite', 'Cobalt arsenide (1/1)', 'Cobalt(III) arsenide']}",-49.47226812,-6.184033515,-0.3003154150000009,"['xas', 'elasticity', 'bandstructure']",True,"[610033, 603795, 610038, 48028, 48027, 48026, 48030, 48029]",True,2021-05-12 10:56:27.046000,NM,8,10,mp-583,,CoAs,"{'functional': 'PBE', 'labels': ['Co', 'As'], 'pot_type': 'paw'}","{'Co': 1.0, 'As': 1.0}",GGA,mp-583,"['mp-910347', 'mp-624974', 'mp-926187', 'mp-583', 'mp-21004', 'mp-1439908', 'mp-1668628', 'mp-1867852', 'mp-926719', 'mp-1588534']",0.000236125,"{'Co': 4.0, 'As': 4.0}",107.41288015263828,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0]",8.793172649851911e-06,0.000236125,0,0.0009445,MP,data/source/MP/cleaned/cifs/MP-mp-583.cif,False,,data/final/MP/graphs/As1Co1-MP-mp-583.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ba2Cu3Gd0.2Pr0.8O7,3,0.0307692307692307,1.0,True,Ba2Cu3Gd0.2Pr0.8O7,Ba2Cu3Pr1O7,0.0,Cuprate,True,Ba15.385Cu23.077Gd1.538Pr6.154O53.84615384615385,Ba-Cu-Gd-Pr-O,5,Supercon,Gd0.2Pr0.8Ba2Cu3O7,MP-mp-20936,Ba2Pr1Cu3O7,Ba-Cu-Pr-O,Ba15.385Cu23.077Pr7.692O53.84615384615385,P m m m,orthorhombic,3.903923,3.95568,11.916432,data/final/MP/cifs/Ba2Cu3Gd0.2Pr0.8O7-MP-mp-20936-synth_doped.cif,data/source/MP/raw/cifs/mp-20936.cif,mp-20936,0.0,,2014-02-22 14:41:55,6.480717836004672,10.17188/1196129,"@misc{osti_1196129,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2PrCu3O7 (SG:47) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196129"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698257'}},0.0256000172756332,3.18514576,520.0,-78.62827906,-6.048329158461538,"{'tags': ['Dibarium praseodymium tricopper heptaoxide', 'Praseodymium dibarium dicopper copper(III) oxide', 'Praseodymium dibarium tricopper heptaoxide', 'Praseodymium dibarium copper(III) dicopper oxide']}",-78.62827906,-6.048329158461538,-2.145007016153845,"['xas', 'bandstructure']",True,"[41452, 94377, 81168, 173910, 89221]",True,2021-05-12 10:56:57.051000,NM,13,8,mp-20936,oxide,Ba2PrCu3O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Pr_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Pr': 1.0, 'Cu': 3.0, 'O': 7.0}",GGA,mp-20936,"['mp-988090', 'mp-987725', 'mp-20936', 'mp-1417367', 'mp-1698257', 'mp-1833655', 'mp-988324', 'mp-1602318']",0.0007234,"{'Ba': 2.0, 'Pr': 1.0, 'Cu': 3.0, 'O': 7.0}",184.02152853403555,[],NM,False,47,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.931061793491212e-06,0.0007234,0,0.0007234,MP,data/source/MP/cleaned/cifs/MP-mp-20936.cif,True,,data/final/MP/graphs/Ba2Cu3Gd0.2Pr0.8O7-MP-mp-20936-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Cu1La1.836Sr0.164O4,3,0.0468571428571428,1.0,True,Cu1La1.836Sr0.164O4,Cu1La2O4,36.9,Cuprate,True,Cu14.286La26.229Sr2.343O57.142857142857146,Cu-La-Sr-O,4,Supercon,La1.836Sr0.164Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La1.836Sr0.164O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La1.836Sr0.164O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B2V0.01Zr0.99,2,0.0066666666666666,1.0,True,B2V0.01Zr0.99,B2Zr1,6.4,Other,True,B66.667V0.333Zr33,B-V-Zr,3,Supercon,Zr0.99V0.01B2,MP-mp-1472,Zr1B2,B-Zr,B66.667Zr33.333,P 6/m m m,hexagonal,3.180490001982521,3.18049075,3.545484,data/final/MP/cifs/B2V0.01Zr0.99-MP-mp-1472-synth_doped.cif,data/source/MP/raw/cifs/mp-1472.cif,mp-1472,0.0,,2011-05-12 18:15:42,6.03310523000882,10.17188/1190849,"@misc{osti_1190849,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrB2 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1190849"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668779'}},0.0,7.16960984,520.0,-24.86855078,-8.289516926666666,{'tags': ['Zirconium boride (1/2)']},-24.86855078,-8.289516926666666,-0.9873555361111102,"['xas', 'elasticity', 'bandstructure']",True,"[615772, 30327, 44492, 615765, 615751, 615754, 169458, 44603, 615771, 615766, 615755, 186559]",True,2021-05-12 10:56:12.755000,NM,3,13,mp-1472,,ZrB2,"{'functional': 'PBE', 'labels': ['Zr_sv', 'B'], 'pot_type': 'paw'}","{'Zr': 1.0, 'B': 2.0}",GGA,mp-1472,"['mp-921664', 'mp-907184', 'mp-920651', 'mp-1472', 'mp-1063554', 'mp-1063589', 'mp-1063503', 'mp-1440931', 'mp-1668779', 'mp-1790527', 'mp-1588229', 'mp-1587116', 'mp-1063573']",0.0002305,"{'Zr': 1.0, 'B': 2.0}",31.0594933066118,[],NM,False,191,0,"[0, 0, 0]",7.421241477591401e-06,0.0002305,0,0.0002305,MP,data/source/MP/cleaned/cifs/MP-mp-1472.cif,True,,data/final/MP/graphs/B2V0.01Zr0.99-MP-mp-1472-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ce1Sn3,1,0.0,1.0,True,Ce1Sn3,Ce1Sn3,0.0,Heavy_fermion,True,Ce25Sn75,Ce-Sn,2,Supercon,Ce1Sn3,MP-mp-1911,Ce1Sn3,Ce-Sn,Ce25Sn75,P m -3 m,cubic,4.72026,4.72026,4.72026,data/final/MP/cifs/Ce1Sn3-MP-mp-1911.cif,data/source/MP/raw/cifs/mp-1911.cif,mp-1911,0.0,,2011-05-13 04:57:44,7.835168734786578,10.17188/1193931,"@misc{osti_1193931,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeSn3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1193931"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686800'}},0.0,8.90829042,520.0,-20.10422646,-5.026056615,{'tags': ['Cerium tin (1/3)']},-20.10422646,-5.026056615,-0.5356054349999999,"['xas', 'elasticity', 'bandstructure']",True,"[622223, 622247, 622248, 622217, 622246, 622240, 102284, 622229, 102285, 622239]",True,2021-05-12 10:56:14.760000,FM,4,9,mp-1911,,CeSn3,"{'functional': 'PBE', 'labels': ['Ce', 'Sn_d'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Sn': 3.0}",GGA,mp-1911,"['mp-912233', 'mp-928196', 'mp-928796', 'mp-1911', 'mp-1442239', 'mp-1686800', 'mp-1796476', 'mp-1589999', 'mp-1591271']",0.2043805,"{'Ce': 1.0, 'Sn': 3.0}",105.17142610923356,[],FM,True,221,1,"[0.2, 0.0, 0.0, 0.0]",0.0019433082497875,0.2043805,1,0.2043805,MP,data/source/MP/cleaned/cifs/MP-mp-1911.cif,False,,data/final/MP/graphs/Ce1Sn3-MP-mp-1911.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ca0.01Cu1Y0.99O2.58,3,0.0733624454148471,1.0,True,Ca0.01Cu1Y0.99O2.58,Cu1Y1O3,0.0,Cuprate,True,Ca0.218Cu21.834Y21.616O56.33187772925764,Ca-Cu-Y-O,4,Supercon,Y0.99Ca0.01Cu1O2.58,MP-mvc-11697,Y1Cu1O3,Cu-Y-O,Cu20Y20O60,P m -3 m,cubic,3.782154,3.782154,3.782154,data/final/MP/cifs/Ca0.01Cu1Y0.99O2.58-MP-mvc-11697-synth_doped.cif,data/source/MP/raw/cifs/mvc-11697.cif,mvc-11697,0.0,,2014-02-03 16:44:08,6.15230194191815,10.17188/1318302,"@misc{osti_1318302,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YCuO3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1318302"",
    place = ""United States"",
    year = ""2014"",
    month = ""9"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1767057'}},0.2224574458068184,5.28242166,520.0,-34.43613767,-6.887227534,{'tags': []},-34.43613767,-6.887227534,-2.217515374333334,"['bandstructure', 'elasticity']",True,[],True,2021-05-12 10:56:37.246000,NM,5,5,mvc-11697,oxide,YCuO3,"{'functional': 'PBE', 'labels': ['Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Y': 1.0, 'Cu': 1.0, 'O': 3.0}",GGA,mvc-11697,"['mvc-11697', 'mp-1432347', 'mp-1767057', 'mp-1792243', 'mp-1615717']",0.0007474,"{'Y': 1.0, 'Cu': 1.0, 'O': 3.0}",54.10253626517338,[],NM,False,221,0,"[0, 0, 0, 0, 0]",1.3814509477647404e-05,0.0007474,0,0.0007474,MP,data/source/MP/cleaned/cifs/MP-mvc-11697.cif,True,,data/final/MP/graphs/Ca0.01Cu1Y0.99O2.58-MP-mvc-11697-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Si2W1,1,0.0,1.0,True,Si2W1,Si2W1,0.0,Other,True,Si66.667W33.333,Si-W,2,Supercon,Si2W1,MP-mp-1620,Si2W1,Si-W,Si66.667W33.333,I 4/m m m,tetragonal,3.233556001902502,3.233556001902502,4.549971950000001,data/final/MP/cifs/Si2W1-MP-mp-1620.cif,data/source/MP/raw/cifs/mp-1620.cif,mp-1620,0.0,,2011-05-12 18:45:39,9.689780275080768,10.17188/1191630,"@misc{osti_1191630,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Si2W (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191630"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686718'}},0.0,10.18703093,520.0,-24.84675693,-8.28225231,"{'tags': ['Tungsten silicide (1/2)', 'Tungsten disilicide (1/2)']}",-24.84675693,-8.28225231,-0.3460008066666671,"['xas', 'elasticity', 'bandstructure']",True,"[71501, 96024, 26869, 73599, 652548, 652556, 652560, 652553, 652559]",True,2021-05-12 10:56:12.755000,NM,3,11,mp-1620,,Si2W,"{'functional': 'PBE', 'labels': ['Si', 'W_pv'], 'pot_type': 'paw'}","{'Si': 2.0, 'W': 1.0}",GGA,mp-1620,"['mp-922805', 'mp-908479', 'mp-923586', 'mp-1620', 'mp-1125203', 'mp-1138255', 'mp-1440851', 'mp-1686718', 'mp-1794620', 'mp-1589886', 'mp-1587365']",4.18e-05,"{'Si': 2.0, 'W': 1.0}",41.13072026397528,[],NM,False,139,0,"[0, 0, 0]",1.0162720159464582e-06,4.18e-05,0,4.18e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1620.cif,False,,data/final/MP/graphs/Si2W1-MP-mp-1620.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ir2Zr1,1,0.0,2.0,False,Ir4Zr2,Ir4Zr2,4.1,Other,True,Ir66.667Zr33.333,Ir-Zr,2,Supercon,Ir2Zr1,MP-mp-715,Zr2Ir4,Ir-Zr,Ir66.667Zr33.333,F d -3 m,cubic,5.25899213,5.25899213,5.25899213,data/final/MP/cifs/Ir2Zr1-MP-mp-715.cif,data/source/MP/raw/cifs/mp-715.cif,mp-715,0.0,,2011-05-13 08:17:04,15.359650468177955,10.17188/1286659,"@misc{osti_1286659,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrIr2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1286659"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703512'}},0.0779634912499993,7.65273849,520.0,-56.60807919,-9.434679865,{'tags': ['Iridium zirconium (2/1)']},-56.60807919,-9.434679865,-0.6931593750000005,"['bandstructure', 'elasticity']",True,"[104608, 641210, 641198, 104609]",True,2021-05-12 10:56:29.056000,NM,6,8,mp-715,,ZrIr2,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Ir'], 'pot_type': 'paw'}","{'Zr': 1.0, 'Ir': 2.0}",GGA,mp-715,"['mp-929402', 'mp-929011', 'mp-912635', 'mp-715', 'mp-1441551', 'mp-1703512', 'mp-1796056', 'mp-1593981']",3.09e-05,"{'Zr': 2.0, 'Ir': 4.0}",102.8472220741256,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",6.008912905344062e-07,3.09e-05,0,6.18e-05,MP,data/source/MP/cleaned/cifs/MP-mp-715.cif,False,,data/final/MP/graphs/Ir2Zr1-MP-mp-715.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Fe1Sb1,1,0.0,2.0,False,Fe2Sb2,Fe2Sb2,0.0,Ferrite,True,Fe50Sb50,Fe-Sb,2,Supercon,Fe1Sb1,MP-mp-2619,Fe2Sb2,Fe-Sb,Fe50Sb50,P 63/m m c,hexagonal,4.01480600311928,4.01480688,5.019758,data/final/MP/cifs/Fe1Sb1-MP-mp-2619.cif,data/source/MP/raw/cifs/mp-2619.cif,mp-2619,0.0,,2011-05-12 22:14:58,8.417664522643756,10.17188/1201120,"@misc{osti_1201120,
    author = ""Persson, Kristin"",
    title = ""Materials Data on FeSb (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201120"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688022'}},0.0403614174999988,8.29893286,520.0,-25.12059787,-6.2801494675,"{'tags': ['Iron antimonide (1/1)', 'Iron(III) antimonide']}",-25.12059787,-6.2801494675,-0.0766446225000008,"['xas', 'elasticity', 'bandstructure']",True,"[633396, 53971, 53535]",True,2021-05-12 10:56:18.721000,FM,4,8,mp-2619,,FeSb,"{'functional': 'PBE', 'labels': ['Fe_pv', 'Sb'], 'pot_type': 'paw'}","{'Fe': 1.0, 'Sb': 1.0}",GGA,mp-2619,"['mp-927724', 'mp-927307', 'mp-911281', 'mp-2619', 'mp-1438646', 'mp-1688022', 'mp-1801831', 'mp-1587445']",1.22820155,"{'Fe': 2.0, 'Sb': 2.0}",70.07170222337793,[],FM,True,194,1,"[1.3, 1.3, 0.0, 0.0]",0.035055564829428,1.22820155,2,2.4564031,MP,data/source/MP/cleaned/cifs/MP-mp-2619.cif,False,,data/final/MP/graphs/Fe1Sb1-MP-mp-2619.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ag0.1In0.9Te1,3,0.0999999999999999,1.0,True,Ag0.1In0.9Te1,In1Te1,1.2,Other,True,Ag5In45Te50,Ag-In-Te,3,Supercon,Ag0.1In0.9Te1,MP-mp-2597,In1Te1,In-Te,In50Te50,F m -3 m,cubic,4.44363296,4.44363296,4.44363296,data/final/MP/cifs/Ag0.1In0.9Te1-MP-mp-2597-synth_doped.cif,data/source/MP/raw/cifs/mp-2597.cif,mp-2597,0.0,,2011-05-12 18:35:42,6.488053472608879,10.17188/1201088,"@misc{osti_1201088,
    author = ""Persson, Kristin"",
    title = ""Materials Data on InTe (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201088"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668520'}},0.0,6.3140604,520.0,-6.47268679,-3.236343395,"{'tags': ['Indium telluride (1/1)', 'Indium tellurium (1/1) - HP, HT', 'High pressure experimental phase', 'Indium telluride  - II']}",-6.47268679,-3.236343395,-0.4998510649999996,"['xas', 'elasticity', 'bandstructure']",True,"[169425, 44653, 169422, 59547, 169428, 640620, 640614, 169431, 169419, 640622]",True,2021-05-12 10:56:18.721000,NM,2,9,mp-2597,,InTe,"{'functional': 'PBE', 'labels': ['In_d', 'Te'], 'pot_type': 'paw'}","{'In': 1.0, 'Te': 1.0}",GGA,mp-2597,"['mp-1000805', 'mp-1007252', 'mp-2597', 'mp-1440879', 'mp-1668520', 'mp-1793575', 'mp-1011993', 'mp-1588148', 'mp-1589064']",0.0001824,"{'In': 1.0, 'Te': 1.0}",62.04396451824765,[],NM,False,225,0,"[0, 0]",2.939850820563773e-06,0.0001824,0,0.0001824,MP,data/source/MP/cleaned/cifs/MP-mp-2597.cif,True,,data/final/MP/graphs/Ag0.1In0.9Te1-MP-mp-2597-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ni1Sb3,1,0.0,4.0,False,Ni4Sb12,Ni4Sb12,0.0,Ferrite,True,Ni25Sb75,Ni-Sb,2,Supercon,Ni1Sb3,MP-mp-1106023,Ni4Sb12,Ni-Sb,Ni25Sb75,I m -3,cubic,8.012865411776326,8.01286541,8.01286541,data/final/MP/cifs/Ni1Sb3-MP-mp-1106023.cif,data/source/MP/raw/cifs/mp-1106023.cif,mp-1106023,0.0,,2018-07-19 07:25:47,7.110596678522262,,,{'GGA': {'task_id': 'mp-1670082'}},0.0,7.562122,520.0,-74.92546891,-4.682841806875,{'tags': ['Nickel antimonide (1/3)']},-74.92546891,-4.682841806875,-0.2850567068750003,['bandstructure'],True,"[190327, 190324]",True,2021-05-12 10:58:22.271000,NM,16,6,mp-1106023,,NiSb3,"{'functional': 'PBE', 'labels': ['Ni_pv', 'Sb'], 'pot_type': 'paw'}","{'Ni': 1.0, 'Sb': 3.0}",GGA,mp-1106023,"['mp-1106023', 'mp-1189671', 'mp-1425856', 'mp-1670082', 'mp-1838316', 'mp-1637784']",0.009351175,"{'Ni': 4.0, 'Sb': 12.0}",396.0423720983934,[],NM,False,204,0,"[-0.0, -0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",9.444620736365836e-05,0.009351175,0,0.0374047,MP,data/source/MP/cleaned/cifs/MP-mp-1106023.cif,False,,data/final/MP/graphs/Ni1Sb3-MP-mp-1106023.json,0,True,m-3,2,0,0,0,0,0,0,0,0,1,0,1.0,False
B1Fe2,1,0.0,2.0,False,B2Fe4,B2Fe4,0.0,Other,True,B33.333Fe66.667,B-Fe,2,Supercon,B1Fe2,MP-mp-1915,Fe4B2,B-Fe,B33.333Fe66.667,I 4/m c m,tetragonal,4.160264039375824,4.16026404,4.16026404,data/final/MP/cifs/B1Fe2-MP-mp-1915.cif,data/source/MP/raw/cifs/mp-1915.cif,mp-1915,0.0,,2011-05-13 09:21:15,7.490316494309652,10.17188/1193974,"@misc{osti_1193974,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Fe2B (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1193974"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668770'}},0.0,6.78337188,520.0,-49.08380326,-8.180633876666667,{'tags': ['Iron boride (2/1)']},-49.08380326,-8.180633876666667,-0.307497653055556,"['xas', 'elasticity', 'bandstructure']",True,"[613896, 391330, 613906, 613883, 160791, 613891, 160789, 42530, 613907, 613876, 30446, 391328, 603829, 613880, 160788]",True,2021-05-12 10:56:14.760000,FM,6,21,mp-1915,,Fe2B,"{'functional': 'PBE', 'labels': ['Fe_pv', 'B'], 'pot_type': 'paw'}","{'Fe': 2.0, 'B': 1.0}",GGA,mp-1915,"['mp-906146', 'mp-918981', 'mp-919984', 'mp-8105', 'mp-1915', 'mp-568649', 'mp-1072027', 'mp-1072056', 'mp-1072174', 'mp-1072849', 'mp-1072876', 'mp-1072955', 'mp-1077364', 'mp-1077337', 'mp-1440845', 'mp-1668770', 'mp-1781724', 'mp-1594653', 'mp-1587251', 'mp-1072121', 'mp-1072917']",3.6924313,"{'Fe': 4.0, 'B': 2.0}",54.31484673634333,[],FM,True,140,1,"[1.9, 1.9, 1.9, 1.9, 0.0, 0.0]",0.1359639775078038,3.6924313,4,7.3848626,MP,data/source/MP/cleaned/cifs/MP-mp-1915.cif,False,,data/final/MP/graphs/B1Fe2-MP-mp-1915.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As2Fe1.9Ni0.1Sr1,2,0.04,1.0,True,As2Fe1.9Ni0.1Sr1,As2Fe2Sr1,5.5,Ferrite,True,As40Fe38Ni2Sr20,As-Fe-Ni-Sr,4,Supercon,Sr1Fe1.9Ni0.1As2,MP-mp-4488,Sr1Fe2As2,As-Fe-Sr,As40Fe40Sr20,I 4/m m m,tetragonal,3.9729799997357778,3.9729799997357778,6.45523327,data/final/MP/cifs/As2Fe1.9Ni0.1Sr1-MP-mp-4488-synth_doped.cif,data/source/MP/raw/cifs/mp-4488.cif,mp-4488,0.0,,2011-05-13 03:37:13,6.319998834487784,10.17188/1208187,"@misc{osti_1208187,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr(FeAs)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208187"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672865'}},0.0,5.13397273,520.0,-30.61898897,-6.123797794,"{'tags': ['Strontium diiron arsenide - HT', 'Strontium diiron arsenide', 'Strontium diiron diarsenide', 'Iron strontium arsenide (2/1/2)', 'Strontium diiron arsenide - LT']}",-30.61898897,-6.123797794,-0.5342483613333335,"['xas', 'elasticity', 'bandstructure']",True,"[182330, 181993, 610527, 163209, 163208, 163869]",True,2021-05-12 10:56:20.740000,NM,5,8,mp-4488,,Sr(FeAs)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Fe': 2.0, 'As': 2.0}",GGA,mp-4488,"['mp-906356', 'mp-920135', 'mp-919110', 'mp-4488', 'mp-1439153', 'mp-1672865', 'mp-1873948', 'mp-1592272']",0.0029206,"{'Sr': 1.0, 'Fe': 2.0, 'As': 2.0}",91.7377588211838,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",3.183640016422098e-05,0.0029206,0,0.0029206,MP,data/source/MP/cleaned/cifs/MP-mp-4488.cif,True,,data/final/MP/graphs/As2Fe1.9Ni0.1Sr1-MP-mp-4488-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Sb0.223V0.777,3,0.054,8.0,False,Sb1.784V6.216,Sb2V6,0.0,Other,True,Sb22.3V77.7,Sb-V,2,Supercon,Sb0.223V0.777,MP-mp-1555,V6Sb2,Sb-V,Sb25V75,P m -3 n,cubic,4.935,4.935,4.935,data/final/MP/cifs/Sb0.223V0.777-MP-mp-1555-synth_doped.cif,data/source/MP/raw/cifs/mp-1555.cif,mp-1555,0.0,,2011-05-13 19:31:48,7.587411530928405,10.17188/1191232,"@misc{osti_1191232,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Sb (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191232"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699451'}},0.0,8.2538452,520.0,-64.48303092,-8.060378865,"{'tags': ['Vanadium antimonide (1/3)', 'Vanadium antimonide (3/1)']}",-64.48303092,-8.060378865,-0.2631990025000004,"['xas', 'elasticity', 'bandstructure']",True,"[651731, 52330, 106037, 651717]",True,2021-05-12 10:56:12.755000,NM,8,8,mp-1555,,V3Sb,"{'functional': 'PBE', 'labels': ['V_pv', 'Sb'], 'pot_type': 'paw'}","{'V': 3.0, 'Sb': 1.0}",GGA,mp-1555,"['mp-926619', 'mp-927153', 'mp-911044', 'mp-1555', 'mp-1413633', 'mp-1699451', 'mp-1805224', 'mp-1596724']",0.0044149,"{'V': 6.0, 'Sb': 2.0}",120.18810037499998,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",7.34665076862856e-05,0.0044149,0,0.0088298,MP,data/source/MP/cleaned/cifs/MP-mp-1555.cif,True,,data/final/MP/graphs/Sb0.223V0.777-MP-mp-1555-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Bi2Ca2Cu2Sr1O8.229,2,0.0140346269179416,1.9443686353141327,False,Bi3.889Ca3.889Cu3.889Sr1.944O16,Bi4Ca4Cu4Sr2O16,76.4,Cuprate,True,Bi13.133Ca13.133Cu13.133Sr6.566O54.03506467923041,Bi-Ca-Cu-Sr-O,5,Supercon,Bi2Sr1Ca2Cu2O8.229,MP-mp-1208800,Sr2Ca4Cu4Bi4O16,Bi-Ca-Cu-Sr-O,Bi13.333Ca13.333Cu13.333Sr6.667O53.333333333333336,C c c m,orthorhombic,5.25962,5.5031419991973936,15.85086115,data/final/MP/cifs/Bi2Ca2Cu2Sr1O8.229-MP-mp-1208800-synth_doped.cif,data/source/MP/raw/cifs/mp-1208800.cif,mp-1208800,0.0,,2019-01-12 11:38:54.528000,6.180311424597208,,,,0.1180340782222231,4.65922206,520.0,-171.83251846,-5.727750615333333,"{'tags': ['Sr1.9CaCu2Bi2.1O8.22', 'high-Tc cuprate family', 'Sr2CaCu2Bi2O8 rt']}",-171.83251846,-5.727750615333333,-2.009959734444444,[],False,[],True,2021-05-12 11:00:21.818000,NM,30,3,mp-1208800,oxide,SrCa2Cu2(BiO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Ca': 2.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",GGA,mp-1208800,"['mp-1208800', 'mp-1379386', 'mp-1821614']",0.0001039,"{'Sr': 2.0, 'Ca': 4.0, 'Cu': 4.0, 'Bi': 4.0, 'O': 16.0}",451.82872001498686,[],NM,False,66,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.599087902006482e-07,0.0001039,0,0.0002078,MP,data/source/MP/cleaned/cifs/MP-mp-1208800.cif,True,,data/final/MP/graphs/Bi2Ca2Cu2Sr1O8.229-MP-mp-1208800-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ho1Re2,1,0.0,4.0,False,Ho4Re8,Ho4Re8,0.0,Other,True,Ho33.333Re66.667,Ho-Re,2,Supercon,Ho1Re2,MP-mp-1102328,Ho4Re8,Ho-Re,Ho33.333Re66.667,P 63/m m c,hexagonal,5.433692001270578,5.4336926,8.831295,data/final/MP/cifs/Ho1Re2-MP-mp-1102328.cif,data/source/MP/raw/cifs/mp-1102328.cif,mp-1102328,0.0,,2018-07-18 14:01:25,15.805805327180227,,,{'GGA': {'task_id': 'mp-1696410'}},0.0,5.49414034,520.0,-120.84843746,-10.070703121666666,"{'tags': ['HoRe2', 'MgZn2', 'Friauf-Laves phase, Frank-Kasper phase', 'Holmium rhenium (1/2)']}",-120.84843746,-10.070703121666666,-0.2468820416666671,['bandstructure'],True,"[639615, 639616]",True,2021-05-12 10:58:20.361000,NM,12,6,mp-1102328,,HoRe2,"{'functional': 'PBE', 'labels': ['Ho_3', 'Re_pv'], 'pot_type': 'paw'}","{'Ho': 1.0, 'Re': 2.0}",GGA,mp-1102328,"['mp-1102328', 'mp-1103477', 'mp-1427650', 'mp-1696410', 'mp-1932852', 'mp-1602079']",4.08e-05,"{'Ho': 4.0, 'Re': 8.0}",225.81101490379936,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",7.227282516290312e-07,4.08e-05,0,0.0001632,MP,data/source/MP/cleaned/cifs/MP-mp-1102328.cif,False,,data/final/MP/graphs/Ho1Re2-MP-mp-1102328.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Al20La1V2,1,0.0,2.0,False,Al40La2V4,Al40La2V4,0.0,Other,True,Al86.957La4.348V8.696,Al-La-V,3,Supercon,La1V2Al20,MP-mp-1195666,La2Al40V4,Al-La-V,Al86.957La4.348V8.696,F d -3 m,cubic,10.324382670000002,10.32438267,10.32438267,data/final/MP/cifs/Al20La1V2-MP-mp-1195666.cif,data/source/MP/raw/cifs/mp-1195666.cif,mp-1195666,0.0,,2019-01-12 00:59:35.858000,3.3306560004844985,,,{'GGA': {'task_id': 'mp-1680093'}},0.0,8.06632974,520.0,-205.79527091,-4.473810237173913,{'tags': ['Lanthanum vanadium aluminide (1/2/20)']},-205.79527091,-4.473810237173913,-0.2122738960869567,[],False,[236261],True,2021-05-12 10:59:59.077000,NM,46,4,mp-1195666,,La(Al10V)2,"{'functional': 'PBE', 'labels': ['La', 'Al', 'V_pv'], 'pot_type': 'paw'}","{'La': 1.0, 'Al': 20.0, 'V': 2.0}",GGA,mp-1195666,"['mp-1195666', 'mp-1368925', 'mp-1680093', 'mp-1893968']",0.0265062,"{'La': 2.0, 'Al': 40.0, 'V': 4.0}",778.1750138584395,[],NM,False,227,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",6.812400688265181e-05,0.0265062,0,0.0530124,MP,data/source/MP/cleaned/cifs/MP-mp-1195666.cif,False,,data/final/MP/graphs/Al20La1V2-MP-mp-1195666.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
C1Mg1Ni2.995Ru0.005,2,0.0019999999999999,1.0,True,C1Mg1Ni2.995Ru0.005,C1Mg1Ni3,6.92,Other,True,C20Mg20Ni59.9Ru0.1,C-Mg-Ni-Ru,4,Supercon,Mg1C1Ni2.995Ru0.005,MP-mp-10700,Mg1Ni3C1,C-Mg-Ni,C20Mg20Ni60,P m -3 m,cubic,3.810209,3.810209,3.810209,data/final/MP/cifs/C1Mg1Ni2.995Ru0.005-MP-mp-10700-synth_doped.cif,data/source/MP/raw/cifs/mp-10700.cif,mp-10700,0.0,,2011-05-28 10:04:44,6.376007671789427,10.17188/1187303,"@misc{osti_1187303,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MgNi3C (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187303"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678621'}},0.0,6.64260176,520.0,-28.85099542,-5.770199084,{'tags': ['Magnesium nickel carbide (1/3/1)']},-28.85099542,-5.770199084,-0.1367049259999994,"['xas', 'elasticity', 'bandstructure']",True,[77152],True,2021-05-12 10:56:10.715000,NM,5,8,mp-10700,,MgNi3C,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Ni_pv', 'C'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",GGA,mp-10700,"['mp-927245', 'mp-927653', 'mp-911184', 'mp-10700', 'mp-1438083', 'mp-1678621', 'mp-1791467', 'mp-1591421']",0.0387875,"{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",55.31544309398296,[],NM,False,221,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",0.0007012056277683,0.0387875,0,0.0387875,MP,data/source/MP/cleaned/cifs/MP-mp-10700.cif,True,,data/final/MP/graphs/C1Mg1Ni2.995Ru0.005-MP-mp-10700-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
La1Ru4Sb12,1,0.0,1.0,True,La1Ru4Sb12,La1Ru4Sb12,3.293333333,Other,True,La5.882Ru23.529Sb70.588,La-Ru-Sb,3,Supercon,La1Ru4Sb12,MP-mp-1188603,La1Sb12Ru4,La-Ru-Sb,La5.882Ru23.529Sb70.588,I m -3,cubic,8.136168371803661,8.13616837,8.13616837,data/final/MP/cifs/La1Ru4Sb12-MP-mp-1188603.cif,data/source/MP/raw/cifs/mp-1188603.cif,mp-1188603,0.0,,2019-01-11 19:34:03.129000,8.027403946460424,,,{'GGA': {'task_id': 'mp-1705708'}},0.0,7.72019932,520.0,-97.73855692,-5.749326877647058,"{'tags': ['Lanthanum ruthenium antimonide (1/4/12)', 'LaFe4P12', 'LaRu4Sb12']}",-97.73855692,-5.749326877647058,-0.4977044891176468,['bandstructure'],True,[641783],True,2021-05-12 10:58:33.577000,NM,17,5,mp-1188603,,La(Sb3Ru)4,"{'functional': 'PBE', 'labels': ['La', 'Sb', 'Ru_pv'], 'pot_type': 'paw'}","{'La': 1.0, 'Sb': 12.0, 'Ru': 4.0}",GGA,mp-1188603,"['mp-1188603', 'mp-1432429', 'mp-1705708', 'mp-1816685', 'mp-1629986']",0.0024212,"{'La': 1.0, 'Sb': 12.0, 'Ru': 4.0}",414.6082041632664,[],NM,False,204,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.839730076944084e-06,0.0024212,0,0.0024212,MP,data/source/MP/cleaned/cifs/MP-mp-1188603.cif,False,,data/final/MP/graphs/La1Ru4Sb12-MP-mp-1188603.json,0,True,m-3,2,0,0,0,0,0,0,0,0,1,0,1.0,False
La0.28Pt0.72,3,0.1066666666666666,6.0,False,La1.68Pt4.32,La2Pt4,0.54,Other,True,La28Pt72,La-Pt,2,Supercon,La0.28Pt0.72,MP-mp-912,La2Pt4,La-Pt,La33.333Pt66.667,F d -3 m,cubic,5.56329271,5.56329271,5.56329271,data/final/MP/cifs/La0.28Pt0.72-MP-mp-912-synth_doped.cif,data/source/MP/raw/cifs/mp-912.cif,mp-912,0.0,,2011-05-13 09:34:39,14.431595371680295,10.17188/1312990,"@misc{osti_1312990,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaPt2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1312990"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696947'}},0.0,8.92501839,520.0,-40.61300026,-6.768833376666667,{'tags': ['Lanthanum platinum (1/2)']},-40.61300026,-6.768833376666667,-1.0762258683333326,"['xas', 'bandstructure']",True,"[104700, 641696, 641702, 641687]",True,2021-05-12 10:57:55.580000,NM,6,8,mp-912,,LaPt2,"{'functional': 'PBE', 'labels': ['La', 'Pt'], 'pot_type': 'paw'}","{'La': 1.0, 'Pt': 2.0}",GGA,mp-912,"['mp-930048', 'mp-930529', 'mp-913762', 'mp-912', 'mp-1441098', 'mp-1696947', 'mp-1803269', 'mp-1588835']",0.00010075,"{'La': 2.0, 'Pt': 4.0}",121.75329801175435,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",1.6549859699122622e-06,0.00010075,0,0.0002015,MP,data/source/MP/cleaned/cifs/MP-mp-912.cif,True,,data/final/MP/graphs/La0.28Pt0.72-MP-mp-912-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Cu2Gd1Rh0.075Ru0.925Sr2O8,2,0.0107142857142857,2.0,False,Cu4Gd2Rh0.15Ru1.85Sr4O16,Cu4Gd2Ru2Sr4O16,29.8,Cuprate,True,Cu14.286Gd7.143Rh0.536Ru6.607Sr14.286O57.142857142857146,Cu-Gd-Rh-Ru-Sr-O,6,Supercon,Ru0.925Rh0.075Sr2Gd1Cu2O8,MP-mp-1194240,Sr4Gd2Cu4Ru2O16,Cu-Gd-Ru-Sr-O,Cu14.286Gd7.143Ru7.143Sr14.286O57.142857142857146,P 4/m b m,tetragonal,5.472451,5.472451,11.740702,data/final/MP/cifs/Cu2Gd1Rh0.075Ru0.925Sr2O8-MP-mp-1194240-synth_doped.cif,data/source/MP/raw/cifs/mp-1194240.cif,mp-1194240,0.0,,2019-01-11 23:51:58.932000,6.504561898971391,,,{'GGA': {'task_id': 'mp-1765260'}},0.0213449239285443,3.93502801,520.0,-201.55352223,-7.198340079642857,"{'tags': ['Sr2Cu2GdRuO8 orth', 'Sr2Cu2GdRuO8', 'Ruthenium distrontium gadolinium dicopper octaoxide']}",-201.55352223,-7.198340079642857,-2.268654352380952,['bandstructure'],True,[245741],True,2021-05-12 10:58:35.561000,FiM,28,6,mp-1194240,oxide,Sr2GdCu2RuO8,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Gd', 'Cu_pv', 'Ru_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Gd': 1.0, 'Cu': 2.0, 'Ru': 1.0, 'O': 8.0}",GGA,mp-1194240,"['mp-1194240', 'mp-1396976', 'mp-1659973', 'mp-1765260', 'mp-1841948', 'mp-1638264']",4.23696715,"{'Sr': 4.0, 'Gd': 2.0, 'Cu': 4.0, 'Ru': 2.0, 'O': 16.0}",351.6072554818909,[],FiM,True,127,2,"[-0.0, -0.0, -0.0, -0.0, 6.9, 6.9, 0.0, 0.0, 0.0, 0.0, -1.8, -1.8, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0241005672319991,4.23696715,4,8.4739343,MP,data/source/MP/cleaned/cifs/MP-mp-1194240.cif,True,,data/final/MP/graphs/Cu2Gd1Rh0.075Ru0.925Sr2O8-MP-mp-1194240-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Co1Sc3,1,0.0,8.0,False,Co8Sc24,Co8Sc24,0.0,Other,True,Co25Sc75,Co-Sc,2,Supercon,Co1Sc3,MP-mp-27162,Sc24Co8,Co-Sc,Co25Sc75,P n m a,orthorhombic,5.814247,8.590644,13.016756,data/final/MP/cifs/Co1Sc3-MP-mp-27162.cif,data/source/MP/raw/cifs/mp-27162.cif,mp-27162,0.0,,2014-02-17 23:50:35,3.9597975255492113,10.17188/1201375,"@misc{osti_1201375,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sc3Co (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201375"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1731523'}},0.0,4.20621002,520.0,-215.95972764,-6.74874148875,{'tags': ['Cobalt Scandium (1:3)']},-215.95972764,-6.74874148875,-0.2223102112499999,"['xas', 'bandstructure']",True,[2407],True,2021-05-12 10:57:01.079000,NM,32,7,mp-27162,,Sc3Co,"{'functional': 'PBE', 'labels': ['Sc_sv', 'Co'], 'pot_type': 'paw'}","{'Sc': 3.0, 'Co': 1.0}",GGA,mp-27162,"['mp-924764', 'mp-925407', 'mp-909682', 'mp-27162', 'mp-1405268', 'mp-1731523', 'mp-1886994']",0.14322415,"{'Sc': 24.0, 'Co': 8.0}",650.1625701669004,[],NM,False,62,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0, -0.0, -0.0]",0.0017623179994902,0.14322415,0,1.1457932,MP,data/source/MP/cleaned/cifs/MP-mp-27162.cif,False,,data/final/MP/graphs/Co1Sc3-MP-mp-27162.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
B4Er1Rh4,1,0.0,6.0,False,B24Er6Rh24,B24Er6Rh24,7.795,Other,True,B44.444Er11.111Rh44.444,B-Er-Rh,3,Supercon,Er1Rh4B4,MP-mp-1200942,Er6B24Rh24,B-Er-Rh,B44.444Er11.111Rh44.444,C c c a,orthorhombic,7.530163,7.537462,11.81607244954174,data/final/MP/cifs/B4Er1Rh4-MP-mp-1200942.cif,data/source/MP/raw/cifs/mp-1200942.cif,mp-1200942,0.0,,2019-01-12 05:15:14.198000,9.75150414505358,,,,0.0111425801851847,6.90962433,520.0,-395.87963255,-7.331104306481482,{'tags': ['Erbium rhodium boride (1/4/4)']},-395.87963255,-7.331104306481482,-0.581935709444444,[],False,[613801],True,2021-05-12 11:00:10.451000,NM,54,3,mp-1200942,,Er(BRh)4,"{'functional': 'PBE', 'labels': ['Er_3', 'B', 'Rh_pv'], 'pot_type': 'paw'}","{'Er': 1.0, 'B': 4.0, 'Rh': 4.0}",GGA,mp-1200942,"['mp-1200942', 'mp-1875389', 'mp-1986608']",0.0017076166666666,"{'Er': 6.0, 'B': 24.0, 'Rh': 24.0}",635.6329350477954,[],NM,False,68,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.611889415269143e-05,0.0017076166666666,0,0.0102457,MP,data/source/MP/cleaned/cifs/MP-mp-1200942.cif,False,,data/final/MP/graphs/B4Er1Rh4-MP-mp-1200942.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
B2C1Ni1.8Pd0.2Y1,3,0.0666666666666666,1.0,True,B2C1Ni1.8Pd0.2Y1,B2C1Ni2Y1,14.0,Other,True,B33.333C16.667Ni30Pd3.333Y16.667,B-C-Ni-Pd-Y,5,Supercon,Y1Ni1.8Pd0.2B2C1,MP-mp-6576,Y1Ni2B2C1,B-C-Ni-Y,B33.333C16.667Ni33.333Y16.667,I 4/m m m,tetragonal,3.548790000501972,3.548790000501972,5.76144136,data/final/MP/cifs/B2C1Ni1.8Pd0.2Y1-MP-mp-6576-synth_doped.cif,data/source/MP/raw/cifs/mp-6576.cif,mp-6576,0.0,,2011-05-13 05:21:43,6.099730998852292,10.17188/1281366,"@misc{osti_1281366,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281366"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688230'}},0.0,6.81083016,520.0,-43.677878,-7.279646333333333,{'tags': []},-43.677878,-7.279646333333333,-0.5109282141666659,"['xas', 'bandstructure']",True,"[75816, 89142, 83231, 79574, 41549]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6576,,YNi2B2C,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6576,"['mp-6576', 'mp-1007054', 'mp-1000583', 'mp-1439516', 'mp-1688230', 'mp-1794280', 'mp-1011792', 'mp-1597064']",0.0006603,"{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.3152437079014,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",1.010943177297096e-05,0.0006603,0,0.0006603,MP,data/source/MP/cleaned/cifs/MP-mp-6576.cif,True,,data/final/MP/graphs/B2C1Ni1.8Pd0.2Y1-MP-mp-6576-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Au1Ga2,1,0.0,1.0,True,Au1Ga2,Au1Ga2,1.062,Other,True,Au33.333Ga66.667,Au-Ga,2,Supercon,Au1Ga2,MP-mp-2776,Ga2Au1,Au-Ga,Au33.333Ga66.667,F m -3 m,cubic,4.40327555,4.40327555,4.40327555,data/final/MP/cifs/Au1Ga2-MP-mp-2776.cif,data/source/MP/raw/cifs/mp-2776.cif,mp-2776,0.0,,2011-05-12 21:57:19,9.253557284351938,10.17188/1201942,"@misc{osti_1201942,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ga2Au (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201942"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687524'}},0.0,3.58527429,520.0,-10.04441228,-3.3481374266666664,"{'tags': ['Gold gallium (1/2)', 'Gallium gold (2/1)']}",-10.04441228,-3.3481374266666664,-0.2381128983333328,"['xas', 'elasticity', 'bandstructure']",True,"[611874, 611864, 150958, 58458]",True,2021-05-12 10:56:18.721000,NM,3,8,mp-2776,,Ga2Au,"{'functional': 'PBE', 'labels': ['Ga_d', 'Au'], 'pot_type': 'paw'}","{'Ga': 2.0, 'Au': 1.0}",GGA,mp-2776,"['mp-991379', 'mp-2776', 'mp-993315', 'mp-1439079', 'mp-1687524', 'mp-1795480', 'mp-994626', 'mp-1589089']",0.000866,"{'Ga': 2.0, 'Au': 1.0}",60.36880695215696,[],NM,False,225,0,"[0, 0, 0]",1.4345156774198237e-05,0.000866,0,0.000866,MP,data/source/MP/cleaned/cifs/MP-mp-2776.cif,False,,data/final/MP/graphs/Au1Ga2-MP-mp-2776.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ce0.8Ru2Tb0.2,3,0.1333333333333333,2.0,False,Ce1.6Ru4Tb0.4,Ce2Ru4,2.56,Heavy_fermion,True,Ce26.667Ru66.667Tb6.667,Ce-Ru-Tb,3,Supercon,Ce0.8Tb0.2Ru2,MP-mp-607,Ce2Ru4,Ce-Ru,Ce33.333Ru66.667,F d -3 m,cubic,5.35903077,5.35903077,5.35903077,data/final/MP/cifs/Ce0.8Ru2Tb0.2-MP-mp-607-synth_doped.cif,data/source/MP/raw/cifs/mp-607.cif,mp-607,0.0,,2011-05-13 22:34:26,10.444470046690055,10.17188/1277529,"@misc{osti_1277529,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeRu2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277529"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686879'}},0.0,8.61419203,520.0,-50.66413619,-8.444022698333333,"{'tags': ['Cerium ruthenium (1/2)', 'Cerium ruthenium hydride (1/2/4)']}",-50.66413619,-8.444022698333333,-0.2833998766666663,"['xas', 'elasticity', 'bandstructure']",True,"[621326, 656077, 621978, 621973, 621980, 621984, 102277, 621972, 621976, 621979, 604113, 621977, 621982, 621983, 102276, 656078]",True,2021-05-12 10:56:27.046000,NM,6,14,mp-607,,CeRu2,"{'functional': 'PBE', 'labels': ['Ce', 'Ru_pv'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Ru': 2.0}",GGA,mp-607,"['mp-928203', 'mp-912221', 'mp-928809', 'mp-607', 'mp-1071462', 'mp-1071593', 'mp-1071613', 'mp-1077792', 'mp-1440763', 'mp-1686879', 'mp-1803198', 'mp-1591928', 'mp-1591642', 'mp-1071635']",1.005e-05,"{'Ce': 2.0, 'Ru': 4.0}",108.82877852828122,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",1.846937939745105e-07,1.005e-05,0,2.01e-05,MP,data/source/MP/cleaned/cifs/MP-mp-607.cif,True,,data/final/MP/graphs/Ce0.8Ru2Tb0.2-MP-mp-607-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
S1,1,0.0,32.0,False,S32,S32,13.0,Other,True,S100,S,1,Supercon,S1,MP-mp-96,S32,S,S100,P 1 2/c 1,monoclinic,9.248054,9.7210962831338,13.642061,data/final/MP/cifs/S1-MP-mp-96.cif,data/source/MP/raw/cifs/mp-96.cif,mp-96,2.7405,,2011-05-19 10:56:57,1.47775290358732,10.17188/1313363,"@misc{osti_1313363,
    author = ""Persson, Kristin"",
    title = ""Materials Data on S (SG:13) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1313363"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-678281'}},0.0,-0.65927505,520.0,-132.36639574,-4.136449866875,"{'tags': ['Rosickyite', 'Sulfur - gamma', 'Sulphur gamma']}",-132.36639574,-4.136449866875,0.0,"['eos', 'surfaces', 'xas']",False,"[82372, 66517, 2091]",True,2021-05-12 10:56:51.169000,NM,32,5,mp-96,,S,"{'functional': 'PBE', 'labels': ['S'], 'pot_type': 'paw'}",{'S': 1.0},GGA,mp-96,"['mp-663141', 'mp-96', 'mp-678281', 'mp-1347426', 'mp-1851417']",0.0,{'S': 32.0},1152.997853241063,[],NM,False,13,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0,0.0,0,0.0,MP,data/source/MP/cleaned/cifs/MP-mp-96.cif,False,,data/final/MP/graphs/S1-MP-mp-96.json,0,True,2/m,0,0,3,0,0,0,0,1,0,0,0,1.0,False
Cr0.1Cu1Sr1.9Tl1O5,2,0.0222222222222222,1.0,True,Cr0.1Cu1Sr1.9Tl1O5,Cu1Sr2Tl1O5,37.5,Cuprate,True,Cr1.111Cu11.111Sr21.111Tl11.111O55.55555555555556,Cr-Cu-Sr-Tl-O,5,Supercon,Tl1Sr1.9Cr0.1Cu1O5,MP-mp-620290,Sr2Tl1Cu1O5,Cu-Sr-Tl-O,Cu11.111Sr22.222Tl11.111O55.55555555555556,P 4/m m m,tetragonal,3.740781,3.740781,9.120042,data/final/MP/cifs/Cr0.1Cu1Sr1.9Tl1O5-MP-mp-620290-synth_doped.cif,data/source/MP/raw/cifs/mp-620290.cif,mp-620290,0.0,,2013-06-10 20:36:13,6.807183418489958,10.17188/1278018,"@misc{osti_1278018,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr2TlCuO5 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278018"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688212'}},0.0150626706944256,2.9352323,520.0,-49.02279836,-5.446977595555556,{'tags': []},-49.02279836,-5.446977595555556,-1.98635073462963,"['xas', 'elasticity', 'bandstructure']",True,[],True,2021-05-12 10:56:27.046000,NM,9,11,mp-620290,oxide,Sr2TlCuO5,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Tl_d', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Tl': 1.0, 'Cu': 1.0, 'O': 5.0}",GGA,mp-620290,"['mp-931763', 'mp-662520', 'mp-620290', 'mp-937195', 'mp-916489', 'mp-1079736', 'mp-1179105', 'mp-1300946', 'mp-1688212', 'mp-1805203', 'mp-1590970']",0.0238853,"{'Sr': 2.0, 'Tl': 1.0, 'Cu': 1.0, 'O': 5.0}",127.6207832330289,[],NM,False,123,0,"[0.0, 0.0, 0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001871583874891,0.0238853,0,0.0238853,MP,data/source/MP/cleaned/cifs/MP-mp-620290.cif,True,,data/final/MP/graphs/Cr0.1Cu1Sr1.9Tl1O5-MP-mp-620290-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B2C1Ce0.1Ni2Y0.9,2,0.0333333333333333,1.0,True,B2C1Ce0.1Ni2Y0.9,B2C1Ni2Y1,11.9,Other,True,B33.333C16.667Ce1.667Ni33.333Y15,B-C-Ce-Ni-Y,5,Supercon,Y0.9Ce0.1Ni2B2C1,MP-mp-6576,Y1Ni2B2C1,B-C-Ni-Y,B33.333C16.667Ni33.333Y16.667,I 4/m m m,tetragonal,3.548790000501972,3.548790000501972,5.76144136,data/final/MP/cifs/B2C1Ce0.1Ni2Y0.9-MP-mp-6576-synth_doped.cif,data/source/MP/raw/cifs/mp-6576.cif,mp-6576,0.0,,2011-05-13 05:21:43,6.099730998852292,10.17188/1281366,"@misc{osti_1281366,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281366"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688230'}},0.0,6.81083016,520.0,-43.677878,-7.279646333333333,{'tags': []},-43.677878,-7.279646333333333,-0.5109282141666659,"['xas', 'bandstructure']",True,"[75816, 89142, 83231, 79574, 41549]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6576,,YNi2B2C,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6576,"['mp-6576', 'mp-1007054', 'mp-1000583', 'mp-1439516', 'mp-1688230', 'mp-1794280', 'mp-1011792', 'mp-1597064']",0.0006603,"{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.3152437079014,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",1.010943177297096e-05,0.0006603,0,0.0006603,MP,data/source/MP/cleaned/cifs/MP-mp-6576.cif,True,,data/final/MP/graphs/B2C1Ce0.1Ni2Y0.9-MP-mp-6576-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ga0.2V0.8,3,0.1,8.0,False,Ga1.6V6.4,Ga2V6,12.5,Other,True,Ga20V80,Ga-V,2,Supercon,Ga0.2V0.8,MP-mp-22568,V6Ga2,Ga-V,Ga25V75,P m -3 n,cubic,4.789645,4.789645,4.789645,data/final/MP/cifs/Ga0.2V0.8-MP-mp-22568-synth_doped.cif,data/source/MP/raw/cifs/mp-22568.cif,mp-22568,0.0,,2014-02-22 11:36:40,6.726541666276222,10.17188/1198793,"@misc{osti_1198793,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Ga (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198793"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686867'}},0.0,5.67452231,520.0,-61.95244347,-7.74405543375,{'tags': ['Gallium vanadium (1/3)']},-61.95244347,-7.74405543375,-0.1741018756249994,"['xas', 'elasticity', 'bandstructure']",True,"[635643, 635628, 635619, 635634, 104021, 635646, 635604, 635610, 635617, 635624, 635626, 635605, 635631, 635625, 635636, 635603, 104020, 635616, 635607]",True,2021-05-12 10:56:16.728000,FM,8,9,mp-22568,,V3Ga,"{'functional': 'PBE', 'labels': ['V_pv', 'Ga_d'], 'pot_type': 'paw'}","{'V': 3.0, 'Ga': 1.0}",GGA,mp-22568,"['mp-941343', 'mp-941663', 'mp-934924', 'mp-22568', 'mp-1440749', 'mp-1686867', 'mp-1804076', 'mp-1593784', 'mp-1595713']",0.09063635,"{'V': 6.0, 'Ga': 2.0}",109.87780534443452,[],FM,True,131,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.0, -0.0, -0.0]",0.0016497662965852,0.09063635,2,0.1812727,MP,data/source/MP/cleaned/cifs/MP-mp-22568.cif,True,,data/final/MP/graphs/Ga0.2V0.8-MP-mp-22568-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ga0.9Sn0.1V3,2,0.0499999999999999,2.0,False,Ga1.8Sn0.2V6,Ga2V6,10.7,Other,True,Ga22.5Sn2.5V75,Ga-Sn-V,3,Supercon,V3Ga0.9Sn0.1,MP-mp-22568,V6Ga2,Ga-V,Ga25V75,P m -3 n,cubic,4.789645,4.789645,4.789645,data/final/MP/cifs/Ga0.9Sn0.1V3-MP-mp-22568-synth_doped.cif,data/source/MP/raw/cifs/mp-22568.cif,mp-22568,0.0,,2014-02-22 11:36:40,6.726541666276222,10.17188/1198793,"@misc{osti_1198793,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Ga (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198793"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686867'}},0.0,5.67452231,520.0,-61.95244347,-7.74405543375,{'tags': ['Gallium vanadium (1/3)']},-61.95244347,-7.74405543375,-0.1741018756249994,"['xas', 'elasticity', 'bandstructure']",True,"[635643, 635628, 635619, 635634, 104021, 635646, 635604, 635610, 635617, 635624, 635626, 635605, 635631, 635625, 635636, 635603, 104020, 635616, 635607]",True,2021-05-12 10:56:16.728000,FM,8,9,mp-22568,,V3Ga,"{'functional': 'PBE', 'labels': ['V_pv', 'Ga_d'], 'pot_type': 'paw'}","{'V': 3.0, 'Ga': 1.0}",GGA,mp-22568,"['mp-941343', 'mp-941663', 'mp-934924', 'mp-22568', 'mp-1440749', 'mp-1686867', 'mp-1804076', 'mp-1593784', 'mp-1595713']",0.09063635,"{'V': 6.0, 'Ga': 2.0}",109.87780534443452,[],FM,True,131,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.0, -0.0, -0.0]",0.0016497662965852,0.09063635,2,0.1812727,MP,data/source/MP/cleaned/cifs/MP-mp-22568.cif,True,,data/final/MP/graphs/Ga0.9Sn0.1V3-MP-mp-22568-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
B2Er1Ru3,1,0.0,1.0,True,B2Er1Ru3,B2Er1Ru3,0.0,Other,True,B33.333Er16.667Ru50,B-Er-Ru,3,Supercon,Er1Ru3B2,MP-mp-3093,Er1B2Ru3,B-Er-Ru,B33.333Er16.667Ru50,P 6/m m m,hexagonal,3.034553,5.493333999163129,5.49333331,data/final/MP/cifs/B2Er1Ru3-MP-mp-3093.cif,data/source/MP/raw/cifs/mp-3093.cif,mp-3093,0.0,,2011-05-13 07:02:36,10.303795313932886,10.17188/1205271,"@misc{osti_1205271,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ErB2Ru3 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1205271"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1705097'}},0.0,6.45698511,520.0,-48.64005296,-8.106675493333332,{'tags': ['Erbium ruthenium boride (1/3/2)']},-48.64005296,-8.106675493333332,-0.4817302738888891,"['xas', 'elasticity', 'bandstructure']",True,"[44238, 613816]",True,2021-05-12 10:56:18.721000,NM,6,8,mp-3093,,ErB2Ru3,"{'functional': 'PBE', 'labels': ['Er_3', 'B', 'Ru_pv'], 'pot_type': 'paw'}","{'Er': 1.0, 'B': 2.0, 'Ru': 3.0}",GGA,mp-3093,"['mp-1007246', 'mp-1000786', 'mp-3093', 'mp-1441962', 'mp-1705097', 'mp-1798981', 'mp-1011989', 'mp-1587746']",0.0139183,"{'Er': 1.0, 'B': 2.0, 'Ru': 3.0}",79.30440239989252,[],NM,False,65,0,"[0.0, 0.0, 0.0, -0.0, 0.0, -0.0]",0.0001755047586112,0.0139183,0,0.0139183,MP,data/source/MP/cleaned/cifs/MP-mp-3093.cif,False,,data/final/MP/graphs/B2Er1Ru3-MP-mp-3093.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Bi2Ni3Se2,1,0.0,2.0,False,Bi4Ni6Se4,Bi4Ni6Se4,0.73,Ferrite,True,Bi28.571Ni42.857Se28.571,Bi-Ni-Se,3,Supercon,Bi2Ni3Se2,MP-mp-30973,Ni6Bi4Se4,Bi-Ni-Se,Bi28.571Ni42.857Se28.571,C 1 2/m 1,monoclinic,6.974506210000001,6.97450621,7.225199388597095,data/final/MP/cifs/Bi2Ni3Se2-MP-mp-30973.cif,data/source/MP/raw/cifs/mp-30973.cif,mp-30973,0.0,,2014-02-20 17:25:05,9.074049679779309,10.17188/1205309,"@misc{osti_1205309,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ni3(BiSe)2 (SG:12) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1205309"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1673672'}},0.0,6.61416325,520.0,-67.47995022,-4.819996444285715,{'tags': ['Nickel bismuth selenide (3/2/2)']},-67.47995022,-4.819996444285715,-0.3673819278125003,"['xas', 'bandstructure']",True,"[1024, 616879]",True,2021-05-12 10:57:04.957000,NM,14,7,mp-30973,,Ni3(BiSe)2,"{'functional': 'PBE', 'labels': ['Ni_pv', 'Bi', 'Se'], 'pot_type': 'paw'}","{'Ni': 3.0, 'Bi': 2.0, 'Se': 2.0}",GGA,mp-30973,"['mp-929609', 'mp-912967', 'mp-930100', 'mp-30973', 'mp-1416228', 'mp-1673672', 'mp-1598341']",0.0002005,"{'Ni': 6.0, 'Bi': 4.0, 'Se': 4.0}",275.21573302428106,[],NM,False,12,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.4570387949609753e-06,0.0002005,0,0.000401,MP,data/source/MP/cleaned/cifs/MP-mp-30973.cif,False,,data/final/MP/graphs/Bi2Ni3Se2-MP-mp-30973.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
Ir3Te8,1,0.0,1.0,True,Ir3Te8,Ir3Te8,1.8,Other,True,Ir27.273Te72.727,Ir-Te,2,Supercon,Ir3Te8,MP-mp-1217357,Te8Ir3,Ir-Te,Ir27.273Te72.727,R -3,trigonal,6.52222488,6.52222488,6.52222535,data/final/MP/cifs/Ir3Te8-MP-mp-1217357.cif,data/source/MP/raw/cifs/mp-1217357.cif,mp-1217357,0.0,,2019-01-12 18:42:25.881000,9.564033671940267,,,{'GGA': {'task_id': 'mp-1736922'}},0.0,8.17849821,520.0,-54.4671156,-4.951555963636364,{'tags': []},-54.4671156,-4.951555963636364,-0.5619469909090905,[],False,[],True,2021-05-12 11:00:40.103000,NM,11,4,mp-1217357,,Te8Ir3,"{'functional': 'PBE', 'labels': ['Te', 'Ir'], 'pot_type': 'paw'}","{'Te': 8.0, 'Ir': 3.0}",GGA,mp-1217357,"['mp-1217357', 'mp-1412611', 'mp-1736922', 'mp-1924368']",0.0009307,"{'Te': 8.0, 'Ir': 3.0}",277.3547107285637,[],NM,False,148,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.3556307645008416e-06,0.0009307,0,0.0009307,MP,data/source/MP/cleaned/cifs/MP-mp-1217357.cif,False,,data/final/MP/graphs/Ir3Te8-MP-mp-1217357.json,0,True,-3,0,0,0,0,0,0,2,1,0,0,0,1.0,False
In0.2Nb3Sn0.8,3,0.0999999999999999,2.0,False,In0.4Nb6Sn1.6,Nb6Sn2,17.8,Other,True,In5Nb75Sn20,In-Nb-Sn,3,Supercon,Nb3Sn0.8In0.2,MP-mp-1326,Nb6Sn2,Nb-Sn,Nb75Sn25,P m -3 n,cubic,5.334611,5.334611,5.334611,data/final/MP/cifs/In0.2Nb3Sn0.8-MP-mp-1326-synth_doped.cif,data/source/MP/raw/cifs/mp-1326.cif,mp-1326,0.0,,2011-05-14 09:51:48,8.694218121896231,10.17188/1189484,"@misc{osti_1189484,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Sn (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189484"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668415'}},0.0,6.59372491,520.0,-69.93787048,-8.74223381,{'tags': ['Niobium tin (3/1)']},-69.93787048,-8.74223381,-0.163862066250001,"['xas', 'elasticity', 'bandstructure']",True,"[105230, 645503, 645489, 105231, 645498, 645485, 645474, 645496, 645480, 645488, 645482, 645487, 645500, 645493, 645477, 645484, 645502, 645483, 150878, 645479, 645481, 645486, 645473]",True,2021-05-12 10:56:12.755000,NM,8,9,mp-1326,,Nb3Sn,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Sn_d'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Sn': 1.0}",GGA,mp-1326,"['mp-930046', 'mp-913770', 'mp-930577', 'mp-1326', 'mp-1440651', 'mp-1668415', 'mp-1880085', 'mp-1594093', 'mp-1594507']",0.62023085,"{'Nb': 6.0, 'Sn': 2.0}",151.81275738025872,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0081709977567491,0.62023085,0,1.2404617,MP,data/source/MP/cleaned/cifs/MP-mp-1326.cif,True,,data/final/MP/graphs/In0.2Nb3Sn0.8-MP-mp-1326-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Cu1Sr2O3,1,0.0,1.0,True,Cu1Sr2O3,Cu1Sr2O3,0.0,Cuprate,True,Cu16.667Sr33.333O50,Cu-Sr-O,3,Supercon,Sr2Cu1O3,MP-mp-5456,Sr2Cu1O3,Cu-Sr-O,Cu16.667Sr33.333O50,I m m m,orthorhombic,3.5486719996916936,3.973221999464672,6.882681430000001,data/final/MP/cifs/Cu1Sr2O3-MP-mp-5456.cif,data/source/MP/raw/cifs/mp-5456.cif,mp-5456,0.0,,2011-05-13 06:08:08,5.321943242365502,10.17188/1267081,"@misc{osti_1267081,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr2CuO3 (SG:71) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1267081"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668116'}},0.0,3.61711129,520.0,-34.88196178,-5.813660296666666,"{'tags': ['Distrontium cuprate', 'Distrontium copper oxide', 'Distrontium cuprate(II)', 'High pressure experimental phase']}",-34.88196178,-5.813660296666666,-2.4368141980555555,"['xas', 'elasticity', 'bandstructure']",True,"[151807, 151808, 151812, 151809, 151810, 202993, 246686, 15127, 151811]",True,2021-05-12 10:56:22.739000,NM,6,9,mp-5456,oxide,Sr2CuO3,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Cu': 1.0, 'O': 3.0}",GGA,mp-5456,"['mp-990251', 'mp-990223', 'mp-5456', 'mp-1142034', 'mp-1440170', 'mp-1668116', 'mp-1782763', 'mp-990260', 'mp-1588501']",0.0018128,"{'Sr': 2.0, 'Cu': 1.0, 'O': 3.0}",89.48166977668829,[],NM,False,71,0,"[0, 0, 0, 0, 0, 0]",2.0258897766705173e-05,0.0018128,0,0.0018128,MP,data/source/MP/cleaned/cifs/MP-mp-5456.cif,False,,data/final/MP/graphs/Cu1Sr2O3-MP-mp-5456.json,0,True,mmm,0,0,0,7,0,0,0,0,0,1,0,1.0,False
Ca1.85Cl2Cu1Na0.15O2,2,0.0428571428571428,1.0,True,Ca1.85Cl2Cu1Na0.15O2,Ca2Cl2Cu1O2,24.225,Cuprate,True,Ca26.429Cl28.571Cu14.286Na2.143O28.571428571428573,Ca-Cl-Cu-Na-O,5,Supercon,Ca1.85Na0.15Cu1Cl2O2,MP-mp-23143,Ca2Cu1Cl2O2,Ca-Cl-Cu-O,Ca28.571Cl28.571Cu14.286O28.571428571428573,I 4/m m m,tetragonal,3.88024600076171,3.880246000761709,8.12907187,data/final/MP/cifs/Ca1.85Cl2Cu1Na0.15O2-MP-mp-23143-synth_doped.cif,data/source/MP/raw/cifs/mp-23143.cif,mp-23143,0.0,,2014-02-21 09:50:06,3.554337150605878,10.17188/1199263,"@misc{osti_1199263,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ca2Cu(ClO)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199263"",
    place = ""United States"",
    year = ""2016"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700223'}},0.0191527683333321,4.19679796,520.0,-35.95348475,-5.136212107142858,"{'tags': ['Dicalcium copper dioxide dichloride', 'Dicalcium dichlorodioxocuprate']}",-35.95348475,-5.136212107142858,-2.407440427142858,"['xas', 'elasticity', 'bandstructure']",True,"[1027, 83117, 41581]",True,2021-05-12 10:56:16.728000,NM,7,8,mp-23143,oxide,Ca2Cu(ClO)2,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Cu_pv', 'Cl', 'O'], 'pot_type': 'paw'}","{'Ca': 2.0, 'Cu': 1.0, 'Cl': 2.0, 'O': 2.0}",GGA,mp-23143,"['mp-992231', 'mp-990553', 'mp-23143', 'mp-1436301', 'mp-1700223', 'mp-1803462', 'mp-993865', 'mp-1592909']",0.0134962,"{'Ca': 2.0, 'Cu': 1.0, 'Cl': 2.0, 'O': 2.0}",115.21141865211318,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001171429026557,0.0134962,0,0.0134962,MP,data/source/MP/cleaned/cifs/MP-mp-23143.cif,True,,data/final/MP/graphs/Ca1.85Cl2Cu1Na0.15O2-MP-mp-23143-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ce0.987Co1In5Yb0.013,2,0.0037142857142857,1.0,True,Ce0.987Co1In5Yb0.013,Ce1Co1In5,2.13,Heavy_fermion,True,Ce14.1Co14.286In71.429Yb0.186,Ce-Co-In-Yb,4,Supercon,Ce0.987Yb0.013Co1In5,MP-mp-19961,Ce1In5Co1,Ce-Co-In,Ce14.286Co14.286In71.429,P 4/m m m,tetragonal,4.635989,4.635989,7.564124,data/final/MP/cifs/Ce0.987Co1In5Yb0.013-MP-mp-19961-synth_doped.cif,data/source/MP/raw/cifs/mp-19961.cif,mp-19961,0.0,,2014-02-21 14:08:25,7.897022127398995,10.17188/1195145,"@misc{osti_1195145,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeIn5Co (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195145"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701944'}},0.0,7.80626318,520.0,-28.52795357,-4.075421938571429,{'tags': ['Cerium cobalt indium (1/1/5)']},-28.52795357,-4.075421938571429,-0.2468754242857146,"['xas', 'bandstructure']",True,[102108],True,2021-05-12 10:56:57.051000,FM,7,8,mp-19961,,CeIn5Co,"{'functional': 'PBE', 'labels': ['Ce', 'In_d', 'Co'], 'pot_type': 'paw'}","{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",GGA,mp-19961,"['mp-928775', 'mp-912209', 'mp-928270', 'mp-19961', 'mp-1504062', 'mp-1701944', 'mp-1785253', 'mp-1593180']",0.9310323,"{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",162.57113333428427,[],FM,True,123,1,"[0.7, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0057269226147644,0.9310323,1,0.9310323,MP,data/source/MP/cleaned/cifs/MP-mp-19961.cif,True,,data/final/MP/graphs/Ce0.987Co1In5Yb0.013-MP-mp-19961-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B2Cu0.018Mg0.982,2,0.012,1.0,True,B2Cu0.018Mg0.982,B2Mg1,37.8,Other,True,B66.667Cu0.6Mg32.733,B-Cu-Mg,3,Supercon,Mg0.982Cu0.018B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B2Cu0.018Mg0.982-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B2Cu0.018Mg0.982-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ce1In5Ir0.932Pt0.068,2,0.0194285714285714,1.0,True,Ce1In5Ir0.932Pt0.068,Ce1In5Ir1,0.0,Heavy_fermion,True,Ce14.286In71.429Ir13.314Pt0.971,Ce-In-Ir-Pt,4,Supercon,Ce1Ir0.932Pt0.068In5,MP-mp-20975,Ce1In5Ir1,Ce-In-Ir,Ce14.286In71.429Ir14.286,P 4/m m m,tetragonal,4.724199,4.724199,7.575801,data/final/MP/cifs/Ce1In5Ir0.932Pt0.068-MP-mp-20975-synth_doped.cif,data/source/MP/raw/cifs/mp-20975.cif,mp-20975,0.0,,2014-02-21 16:15:16,8.902153726103897,10.17188/1196209,"@misc{osti_1196209,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeIn5Ir (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196209"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688300'}},0.0,8.1498488,520.0,-31.20695684,-4.458136691428572,{'tags': ['Cerium iridium indide (1/1/5)']},-31.20695684,-4.458136691428572,-0.3824312307142854,"['xas', 'bandstructure']",True,[150225],True,2021-05-12 10:56:57.051000,FM,7,8,mp-20975,,CeIn5Ir,"{'functional': 'PBE', 'labels': ['Ce', 'In_d', 'Ir'], 'pot_type': 'paw'}","{'Ce': 1.0, 'In': 5.0, 'Ir': 1.0}",GGA,mp-20975,"['mp-919528', 'mp-918523', 'mp-905302', 'mp-20975', 'mp-1300982', 'mp-1688300', 'mp-1832383', 'mp-1591628']",0.1040192,"{'Ce': 1.0, 'In': 5.0, 'Ir': 1.0}",169.077152414387,[],FM,True,123,1,"[0.1, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0006152173638757,0.1040192,1,0.1040192,MP,data/source/MP/cleaned/cifs/MP-mp-20975.cif,True,,data/final/MP/graphs/Ce1In5Ir0.932Pt0.068-MP-mp-20975-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Cu0.81Sb0.19,3,0.12,4.0,False,Cu3.24Sb0.76,Cu3Sb1,0.07,Other,True,Cu81Sb19,Cu-Sb,2,Supercon,Cu0.81Sb0.19,MP-mp-1183969,Cu3Sb1,Cu-Sb,Cu75Sb25,P m -3 m,cubic,3.897337,3.897337,3.897337,data/final/MP/cifs/Cu0.81Sb0.19-MP-mp-1183969-synth_doped.cif,data/source/MP/raw/cifs/mp-1183969.cif,mp-1183969,0.0,,2019-01-11 12:25:50.087000,8.763013093741133,,,{'GGA': {'task_id': 'mp-1732807'}},0.066506673750001,8.48039287,520.0,-16.09072252,-4.02268063,{'tags': []},-16.09072252,-4.02268063,0.0359746825,['bandstructure'],True,[],True,2021-05-12 10:58:27.755000,NM,4,5,mp-1183969,,Cu3Sb,"{'functional': 'PBE', 'labels': ['Cu_pv', 'Sb'], 'pot_type': 'paw'}","{'Cu': 3.0, 'Sb': 1.0}",GGA,mp-1183969,"['mp-1183969', 'mp-1430317', 'mp-1732807', 'mp-1791597', 'mp-1617901']",0.0006487,"{'Cu': 3.0, 'Sb': 1.0}",59.197570262472446,[],NM,False,221,0,"[0, 0, 0, 0]",1.0958220027000587e-05,0.0006487,0,0.0006487,MP,data/source/MP/cleaned/cifs/MP-mp-1183969.cif,True,,data/final/MP/graphs/Cu0.81Sb0.19-MP-mp-1183969-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ce1Os2,1,0.0,4.0,False,Ce4Os8,Ce4Os8,0.0,Heavy_fermion,True,Ce33.333Os66.667,Ce-Os,2,Supercon,Ce1Os2,MP-mp-1102302,Ce4Os8,Ce-Os,Ce33.333Os66.667,P 63/m m c,hexagonal,5.356958003040291,5.35695825,8.947549,data/final/MP/cifs/Ce1Os2-MP-mp-1102302.cif,data/source/MP/raw/cifs/mp-1102302.cif,mp-1102302,0.0,,2018-07-18 13:59:58,15.549699629011007,,,{'GGA': {'task_id': 'mp-1697816'}},0.0,8.60268234,520.0,-116.52396448,-9.710330373333331,{'tags': ['Cerium osmium (1/2)']},-116.52396448,-9.710330373333331,-0.2477231516666667,['bandstructure'],True,"[621728, 621725]",True,2021-05-12 10:58:20.361000,NM,12,6,mp-1102302,,CeOs2,"{'functional': 'PBE', 'labels': ['Ce', 'Os_pv'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Os': 2.0}",GGA,mp-1102302,"['mp-1102302', 'mp-1103040', 'mp-1504460', 'mp-1697816', 'mp-1929353', 'mp-1598053']",0.012077775,"{'Ce': 4.0, 'Os': 8.0}",222.3674555157543,[],NM,False,194,0,"[0.0, 0.0, 0.0, 0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0002172579610984,0.012077775,0,0.0483111,MP,data/source/MP/cleaned/cifs/MP-mp-1102302.cif,False,,data/final/MP/graphs/Ce1Os2-MP-mp-1102302.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Mo5O2,3,0.0952380952380952,0.4,False,Mo2O0.8,Mo2O1,0.0,Oxide,True,Mo71.429O28.571428571428573,Mo-O,2,Supercon,Mo5O2,MP-mp-1221492,Mo2O1,Mo-O,Mo66.667O33.333333333333336,F m -3 m,cubic,3.94904995,3.94904995,3.94904995,data/final/MP/cifs/Mo5O2-MP-mp-1221492-synth_doped.cif,data/source/MP/raw/cifs/mp-1221492.cif,mp-1221492,0.0,,2019-01-12 22:10:34.226000,7.926795760829189,,,{'GGA+U': {'task_id': 'mp-1730079'}},2.457859197916666,7.31800682,520.0,-15.20692124,-5.068973746666667,{'tags': []},-15.20692124,-5.068973746666667,1.4471086083333329,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,FM,3,5,mp-1221492,oxide,Mo2O,"{'functional': 'PBE', 'labels': ['Mo_pv', 'O'], 'pot_type': 'paw'}","{'Mo': 2.0, 'O': 1.0}",GGA+U,mp-1221492,"['mp-1221492', 'mp-1414070', 'mp-1730079', 'mp-1794142', 'mp-1612070']",2.9666704,"{'Mo': 2.0, 'O': 1.0}",43.54746549004801,[],FM,True,225,1,"[1.4, 1.4, -0.0]",0.0681249842353736,2.9666704,2,2.9666704,MP,data/source/MP/cleaned/cifs/MP-mp-1221492.cif,True,,data/final/MP/graphs/Mo5O2-MP-mp-1221492-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
B2C1Er1Fe0.06Ni1.94,2,0.02,1.0,True,B2C1Er1Fe0.06Ni1.94,B2C1Er1Ni2,8.5,Other,True,B33.333C16.667Er16.667Fe1Ni32.333,B-C-Er-Fe-Ni,5,Supercon,Er1Ni1.94Fe0.06B2C1,MP-mp-6098,Er1Ni2B2C1,B-C-Er-Ni,B33.333C16.667Er16.667Ni33.333,I 4/m m m,tetragonal,3.5122880026935177,3.5122880026935173,5.77805085,data/final/MP/cifs/B2C1Er1Fe0.06Ni1.94-MP-mp-6098-synth_doped.cif,data/source/MP/raw/cifs/mp-6098.cif,mp-6098,0.0,,2011-05-13 04:24:02,8.212015229638553,10.17188/1277667,"@misc{osti_1277667,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ErNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277667"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700042'}},0.0,6.72687579,520.0,-41.84324782,-6.973874636666667,{'tags': []},-41.84324782,-6.973874636666667,-0.5216152347222227,"['xas', 'elasticity', 'bandstructure']",True,"[246431, 79576, 56651]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-6098,,ErNi2B2C,"{'functional': 'PBE', 'labels': ['Er_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Er': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6098,"['mp-1006980', 'mp-1000513', 'mp-6098', 'mp-1441533', 'mp-1700042', 'mp-1793903', 'mp-1011723', 'mp-1589040']",0.0020747,"{'Er': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",64.35860973581151,[],NM,False,139,0,"[0.0, -0.0, -0.0, 0.0, 0.0, 0.0]",3.2236557136900987e-05,0.0020747,0,0.0020747,MP,data/source/MP/cleaned/cifs/MP-mp-6098.cif,True,,data/final/MP/graphs/B2C1Er1Fe0.06Ni1.94-MP-mp-6098-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B2Dy1Rh3,1,0.0,1.0,True,B2Dy1Rh3,B2Dy1Rh3,0.0,Other,True,B33.333Dy16.667Rh50,B-Dy-Rh,3,Supercon,Dy1Rh3B2,MP-mp-1025143,Dy1B2Rh3,B-Dy-Rh,B33.333Dy16.667Rh50,P 6/m m m,hexagonal,3.128198,5.443251996285127,5.44325242,data/final/MP/cifs/B2Dy1Rh3-MP-mp-1025143.cif,data/source/MP/raw/cifs/mp-1025143.cif,mp-1025143,0.0,,2016-10-01 14:08:40,10.195579893572331,10.17188/1355253,"@article{osti_1355253,
    author = ""Persson, Kristin"",
    title = ""Materials Data on DyB2Rh3 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1355253"",
    place = ""United States"",
    year = ""2017"",
    month = ""5""
}
",{'GGA': {'task_id': 'mp-1700285'}},0.0060188599019648,6.39154159,520.0,-44.28268164,-7.38044694,"{'tags': ['Dysprosium rhodium boride (1/3/2)', 'ErIr3B2', 'DyRh3B2']}",-44.28268164,-7.38044694,-0.7040312747222224,['bandstructure'],True,[613675],True,2021-05-12 10:58:09.072000,NM,6,5,mp-1025143,,DyB2Rh3,"{'functional': 'PBE', 'labels': ['Dy_3', 'B', 'Rh_pv'], 'pot_type': 'paw'}","{'Dy': 1.0, 'B': 2.0, 'Rh': 3.0}",GGA,mp-1025143,"['mp-1025143', 'mp-1430754', 'mp-1700285', 'mp-1781576', 'mp-1586157']",0.0007128,"{'Dy': 1.0, 'B': 2.0, 'Rh': 3.0}",80.26787993593963,[],NM,False,191,0,"[0, 0, 0, 0, 0, 0]",8.88026444162812e-06,0.0007128,0,0.0007128,MP,data/source/MP/cleaned/cifs/MP-mp-1025143.cif,False,,data/final/MP/graphs/B2Dy1Rh3-MP-mp-1025143.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Cu1Hg1O4.081,2,0.0100235119415914,0.9800379808870374,True,Ba1.96Cu0.98Hg0.98O4,Ba2Cu1Hg1O4,98.0,Cuprate,True,Ba24.749Cu12.375Hg12.375O50.50117559707958,Ba-Cu-Hg-O,4,Supercon,Hg1Ba2Cu1O4.081,MP-mp-6562,Ba2Cu1Hg1O4,Ba-Cu-Hg-O,Ba25Cu12.5Hg12.5O50,P 4/m m m,tetragonal,3.933714,3.933714,9.827602,data/final/MP/cifs/Ba2Cu1Hg1O4.081-MP-mp-6562-synth_doped.cif,data/source/MP/raw/cifs/mp-6562.cif,mp-6562,0.0,,2011-05-13 18:18:06,6.582036471328142,10.17188/1281336,"@misc{osti_1281336,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2CuHgO4 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281336"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697135'}},0.0234340381250053,2.58068675,520.0,-40.91481298,-5.1143516225,"{'tags': ['Mercury dibarium copper oxide', 'High pressure experimental phase']}",-40.91481298,-5.1143516225,-1.953767533125,"['xas', 'bandstructure']",True,"[75722, 75720, 75724, 75721, 75723]",True,2021-05-12 10:57:32.679000,NM,8,8,mp-6562,oxide,Ba2CuHgO4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Cu_pv', 'Hg', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",GGA,mp-6562,"['mp-6562', 'mp-990899', 'mp-992892', 'mp-1435690', 'mp-1697135', 'mp-1878488', 'mp-994198', 'mp-1592659']",0.0003984,"{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",152.07335344042525,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0, 0, 0]",2.619788352047311e-06,0.0003984,0,0.0003984,MP,data/source/MP/cleaned/cifs/MP-mp-6562.cif,True,,data/final/MP/graphs/Ba2Cu1Hg1O4.081-MP-mp-6562-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B2Lu1Ru3,1,0.0,1.0,True,B2Lu1Ru3,B2Lu1Ru3,0.0,Other,True,B33.333Lu16.667Ru50,B-Lu-Ru,3,Supercon,Lu1Ru3B2,MP-mp-5578,Lu1B2Ru3,B-Lu-Ru,B33.333Lu16.667Ru50,P 6/m m m,hexagonal,3.027179,5.476481997703762,5.4764824,data/final/MP/cifs/B2Lu1Ru3-MP-mp-5578.cif,data/source/MP/raw/cifs/mp-5578.cif,mp-5578,0.0,,2011-05-13 07:16:17,10.55534359582512,10.17188/1270018,"@misc{osti_1270018,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LuB2Ru3 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1270018"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702418'}},0.0,6.40442722,520.0,-48.61939617,-8.103232695,{'tags': ['Lutetium ruthenium boride (1/3/2)']},-48.61939617,-8.103232695,-0.4860821905555556,"['xas', 'elasticity', 'bandstructure']",True,"[108063, 44439]",True,2021-05-12 10:56:22.739000,NM,6,8,mp-5578,,LuB2Ru3,"{'functional': 'PBE', 'labels': ['Lu_3', 'B', 'Ru_pv'], 'pot_type': 'paw'}","{'Lu': 1.0, 'B': 2.0, 'Ru': 3.0}",GGA,mp-5578,"['mp-1000803', 'mp-5578', 'mp-1007263', 'mp-1441868', 'mp-1702418', 'mp-1798581', 'mp-1012019', 'mp-1590481']",0.0013308,"{'Lu': 1.0, 'B': 2.0, 'Ru': 3.0}",78.62707238406448,[],NM,False,191,0,"[0, 0, 0, 0, 0, 0]",1.6925468030903264e-05,0.0013308,0,0.0013308,MP,data/source/MP/cleaned/cifs/MP-mp-5578.cif,False,,data/final/MP/graphs/B2Lu1Ru3-MP-mp-5578.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
B2C1Gd0.25Ni2Y0.75,3,0.0833333333333333,1.0,True,B2C1Gd0.25Ni2Y0.75,B2C1Ni2Y1,4.52,Other,True,B33.333C16.667Gd4.167Ni33.333Y12.5,B-C-Gd-Ni-Y,5,Supercon,Y0.75Gd0.25Ni2B2C1,MP-mp-6576,Y1Ni2B2C1,B-C-Ni-Y,B33.333C16.667Ni33.333Y16.667,I 4/m m m,tetragonal,3.548790000501972,3.548790000501972,5.76144136,data/final/MP/cifs/B2C1Gd0.25Ni2Y0.75-MP-mp-6576-synth_doped.cif,data/source/MP/raw/cifs/mp-6576.cif,mp-6576,0.0,,2011-05-13 05:21:43,6.099730998852292,10.17188/1281366,"@misc{osti_1281366,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281366"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688230'}},0.0,6.81083016,520.0,-43.677878,-7.279646333333333,{'tags': []},-43.677878,-7.279646333333333,-0.5109282141666659,"['xas', 'bandstructure']",True,"[75816, 89142, 83231, 79574, 41549]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6576,,YNi2B2C,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6576,"['mp-6576', 'mp-1007054', 'mp-1000583', 'mp-1439516', 'mp-1688230', 'mp-1794280', 'mp-1011792', 'mp-1597064']",0.0006603,"{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.3152437079014,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",1.010943177297096e-05,0.0006603,0,0.0006603,MP,data/source/MP/cleaned/cifs/MP-mp-6576.cif,True,,data/final/MP/graphs/B2C1Gd0.25Ni2Y0.75-MP-mp-6576-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ir0.5Te0.5,1,0.0,4.0,False,Ir2Te2,Ir2Te2,1.5,Other,True,Ir50Te50,Ir-Te,2,Supercon,Ir0.5Te0.5,MP-mp-10187,Te2Ir2,Ir-Te,Ir50Te50,P 63/m m c,hexagonal,4.111408003625232,4.1114082,5.664143,data/final/MP/cifs/Ir0.5Te0.5-MP-mp-10187.cif,data/source/MP/raw/cifs/mp-10187.cif,mp-10187,0.0,,2011-05-27 20:00:56,12.809571921440073,10.17188/1186714,"@misc{osti_1186714,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TeIr (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1186714"",
    place = ""United States"",
    year = ""2015"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704785'}},0.4961022587499997,9.27708846,520.0,-23.72121706,-5.930304265,{'tags': ['Iridium telluride (1/1)']},-23.72121706,-5.930304265,0.06056141,"['xas', 'elasticity', 'bandstructure']",True,[44870],True,2021-05-12 10:56:08.727000,NM,4,8,mp-10187,,TeIr,"{'functional': 'PBE', 'labels': ['Te', 'Ir'], 'pot_type': 'paw'}","{'Te': 1.0, 'Ir': 1.0}",GGA,mp-10187,"['mp-10187', 'mp-921170', 'mp-942570', 'mp-942978', 'mp-1438070', 'mp-1704785', 'mp-1798920', 'mp-1587495']",1.225e-05,"{'Te': 2.0, 'Ir': 2.0}",82.91746608236515,[],NM,False,194,0,"[0, 0, 0, 0]",2.95474538207224e-07,1.225e-05,0,2.45e-05,MP,data/source/MP/cleaned/cifs/MP-mp-10187.cif,False,,data/final/MP/graphs/Ir0.5Te0.5-MP-mp-10187.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Pb1Pd2Sc1,1,0.0,1.0,True,Pb1Pd2Sc1,Pb1Pd2Sc1,2.4,Other,True,Pb25Pd50Sc25,Pb-Pd-Sc,3,Supercon,Pd2Sc1Pb1,MP-mp-1206369,Sc1Pd2Pb1,Pb-Pd-Sc,Pb25Pd50Sc25,F m -3 m,cubic,4.73804253,4.73804253,4.73804253,data/final/MP/cifs/Pb1Pd2Sc1-MP-mp-1206369.cif,data/source/MP/raw/cifs/mp-1206369.cif,mp-1206369,0.0,,2019-01-12 09:41:39.677000,10.26635710838581,,,{'GGA': {'task_id': 'mp-1732836'}},0.0,6.60573133,520.0,-23.04387663,-5.7609691575,"{'tags': ['b.c.c. atom arrangement', 'Cu2MnAl', 'ScPd2Pb']}",-23.04387663,-5.7609691575,-0.6597492087500001,['bandstructure'],True,[],True,2021-05-12 10:58:37.524000,NM,4,5,mp-1206369,,ScPd2Pb,"{'functional': 'PBE', 'labels': ['Sc_sv', 'Pd', 'Pb_d'], 'pot_type': 'paw'}","{'Sc': 1.0, 'Pd': 2.0, 'Pb': 1.0}",GGA,mp-1206369,"['mp-1206369', 'mp-1418544', 'mp-1732836', 'mp-1781944', 'mp-1615224']",0.0001143,"{'Sc': 1.0, 'Pd': 2.0, 'Pb': 1.0}",75.2110870032555,[],NM,False,225,0,"[0, 0, 0, 0]",1.5197227503845616e-06,0.0001143,0,0.0001143,MP,data/source/MP/cleaned/cifs/MP-mp-1206369.cif,False,,data/final/MP/graphs/Pb1Pd2Sc1-MP-mp-1206369.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
C2Ce1,3,0.1333333333333334,6.0,False,C12Ce6,C12Ce8,0.0,Carbon,True,C66.667Ce33.333,C-Ce,2,Supercon,C2Ce1,MP-mp-20181,Ce8C12,C-Ce,C60Ce40,I -4 3 d,cubic,7.279310711613709,7.27931071,7.27931071,data/final/MP/cifs/C2Ce1-MP-mp-20181-synth_doped.cif,data/source/MP/raw/cifs/mp-20181.cif,mp-20181,0.0,,2014-02-22 20:16:07,7.074733811619405,10.17188/1195321,"@misc{osti_1195321,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ce2C3 (SG:220) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195321"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1707985'}},0.0,8.31466064,520.0,-163.32154712,-8.166077355999999,{'tags': ['Cerium carbide (2/3)']},-163.32154712,-8.166077355999999,-0.2567732739999983,"['xas', 'elasticity', 'bandstructure']",True,"[617322, 617314, 617308, 74661]",True,2021-05-12 10:56:14.760000,NM,20,8,mp-20181,,Ce2C3,"{'functional': 'PBE', 'labels': ['Ce', 'C'], 'pot_type': 'paw'}","{'Ce': 2.0, 'C': 3.0}",GGA,mp-20181,"['mp-922937', 'mp-923722', 'mp-908702', 'mp-20181', 'mp-1423890', 'mp-1707985', 'mp-1806632', 'mp-1604917']",0.0003261,"{'Ce': 8.0, 'C': 12.0}",296.926446928964,[],NM,False,220,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.393007135238653e-06,0.0003261,0,0.0013044,MP,data/source/MP/cleaned/cifs/MP-mp-20181.cif,True,,data/final/MP/graphs/C2Ce1-MP-mp-20181-synth_doped.json,0,True,-43m,5,0,0,0,0,0,0,0,0,1,0,1.0,False
Ba0.024Cu1La1.976O4,2,0.0068571428571428,1.0,True,Ba0.024Cu1La1.976O4,Cu1La2O4,0.0,Cuprate,True,Ba0.343Cu14.286La28.229O57.142857142857146,Ba-Cu-La-O,4,Supercon,La1.976Ba0.024Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ba0.024Cu1La1.976O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ba0.024Cu1La1.976O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Cu0.815Ge0.185,3,0.1299999999999999,8.0,False,Cu6.52Ge1.48,Cu6Ge2,0.175,Other,True,Cu81.5Ge18.5,Cu-Ge,2,Supercon,Cu0.815Ge0.185,MP-mp-1184021,Cu6Ge2,Cu-Ge,Cu75Ge25,P 63/m m c,hexagonal,4.213635,5.291476003465905,5.29147545,data/final/MP/cifs/Cu0.815Ge0.185-MP-mp-1184021-synth_doped.cif,data/source/MP/raw/cifs/mp-1184021.cif,mp-1184021,0.0,,2019-01-11 12:28:15.987000,8.557610547331103,,,{'GGA': {'task_id': 'mp-1754560'}},0.003112765,7.74811247,520.0,-33.8620493,-4.2327561625,{'tags': []},-33.8620493,-4.2327561625,-0.0025941962500004,['bandstructure'],True,[],True,2021-05-12 10:58:27.755000,NM,8,5,mp-1184021,,Cu3Ge,"{'functional': 'PBE', 'labels': ['Cu_pv', 'Ge_d'], 'pot_type': 'paw'}","{'Cu': 3.0, 'Ge': 1.0}",GGA,mp-1184021,"['mp-1184021', 'mp-1388052', 'mp-1754560', 'mp-1921698', 'mp-1621911']",0.00074355,"{'Cu': 6.0, 'Ge': 2.0}",102.17417629799968,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.4554558244372302e-05,0.00074355,0,0.0014871,MP,data/source/MP/cleaned/cifs/MP-mp-1184021.cif,True,,data/final/MP/graphs/Cu0.815Ge0.185-MP-mp-1184021-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ce0.5La0.5Ru2,1,0.0,2.0,False,Ce1La1Ru4,Ce1La1Ru4,0.449,Heavy_fermion,True,Ce16.667La16.667Ru66.667,Ce-La-Ru,3,Supercon,La0.5Ce0.5Ru2,MP-mp-1222913,La1Ce1Ru4,Ce-La-Ru,Ce16.667La16.667Ru66.667,F -4 3 m,cubic,5.407204540000001,5.40720454,5.40720454,data/final/MP/cifs/Ce0.5La0.5Ru2-MP-mp-1222913.cif,data/source/MP/raw/cifs/mp-1222913.cif,mp-1222913,0.0,,2019-01-12 23:22:50.626000,10.149813335401207,,,{'GGA': {'task_id': 'mp-1717130'}},0.0,8.64426336,520.0,-49.23252279,-8.205420465,{'tags': []},-49.23252279,-8.205420465,-0.2109779849999995,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,6,5,mp-1222913,,LaCeRu4,"{'functional': 'PBE', 'labels': ['La', 'Ce', 'Ru_pv'], 'pot_type': 'paw'}","{'La': 1.0, 'Ce': 1.0, 'Ru': 4.0}",GGA,mp-1222913,"['mp-1222913', 'mp-1394759', 'mp-1717130', 'mp-1804881', 'mp-1626317']",0.0208777,"{'La': 1.0, 'Ce': 1.0, 'Ru': 4.0}",111.79011354255184,[],NM,False,216,0,"[0.0, -0.0, 0.0, 0.0, 0.0, 0.0]",0.0001867580176672,0.0208777,0,0.0208777,MP,data/source/MP/cleaned/cifs/MP-mp-1222913.cif,False,,data/final/MP/graphs/Ce0.5La0.5Ru2-MP-mp-1222913.json,0,True,-43m,5,0,0,0,0,0,0,0,0,0,1,1.0,False
Rh3Sn5Tb2,1,0.0,2.0,False,Rh6Sn10Tb4,Rh6Sn10Tb4,0.0,Other,True,Rh30Sn50Tb20,Rh-Sn-Tb,3,Supercon,Tb2Rh3Sn5,MP-mp-1189471,Tb4Sn10Rh6,Rh-Sn-Tb,Rh30Sn50Tb20,C m c 21,orthorhombic,4.46572599820008,7.24214,13.445237110000004,data/final/MP/cifs/Rh3Sn5Tb2-MP-mp-1189471.cif,data/source/MP/raw/cifs/mp-1189471.cif,mp-1189471,0.0,,2019-01-11 20:13:11.768000,9.449876808758107,,,{'GGA': {'task_id': 'mp-1711631'}},0.0,7.56741051,520.0,-117.02849692,-5.851424846,"{'tags': ['Terbium rhodium stannide (2/3/5)', 'Tb2Rh3Sn5', 'Y2Rh3Sn5']}",-117.02849692,-5.851424846,-0.7104733374999995,['bandstructure'],True,[650392],True,2021-05-12 10:58:33.577000,NM,20,5,mp-1189471,,Tb2Sn5Rh3,"{'functional': 'PBE', 'labels': ['Tb_3', 'Sn_d', 'Rh_pv'], 'pot_type': 'paw'}","{'Tb': 2.0, 'Sn': 5.0, 'Rh': 3.0}",GGA,mp-1189471,"['mp-1189471', 'mp-1504476', 'mp-1711631', 'mp-1822774', 'mp-1584399']",0.0001244,"{'Tb': 4.0, 'Sn': 10.0, 'Rh': 6.0}",428.79972245836433,[],NM,False,36,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.802242561482954e-07,0.0001244,0,0.0002488,MP,data/source/MP/cleaned/cifs/MP-mp-1189471.cif,False,,data/final/MP/graphs/Rh3Sn5Tb2-MP-mp-1189471.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Ru1Zr1,1,0.0,1.0,True,Ru1Zr1,Ru1Zr1,0.0,Other,True,Ru50Zr50,Ru-Zr,2,Supercon,Ru1Zr1,MP-mp-214,Zr1Ru1,Ru-Zr,Ru50Zr50,P m -3 m,cubic,3.282356,3.282356,3.282356,data/final/MP/cifs/Ru1Zr1-MP-mp-214.cif,data/source/MP/raw/cifs/mp-214.cif,mp-214,0.0,,2011-05-12 19:42:29,9.02937695427734,10.17188/1196847,"@misc{osti_1196847,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrRu (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196847"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668120'}},0.0,6.23973897,520.0,-19.13700874,-9.56850437,"{'tags': ['Zirconium ruthenium (1/1) - B2', 'Ruthenium zirconium (1/1)']}",-19.13700874,-9.56850437,-0.6574592274999986,"['xas', 'elasticity', 'bandstructure']",True,"[106022, 650789, 181289]",True,2021-05-12 10:56:16.728000,NM,2,8,mp-214,,ZrRu,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Ru_pv'], 'pot_type': 'paw'}","{'Zr': 1.0, 'Ru': 1.0}",GGA,mp-214,"['mp-663498', 'mp-664116', 'mp-663083', 'mp-214', 'mp-1440141', 'mp-1668120', 'mp-1774415', 'mp-1595706']",0.0,"{'Zr': 1.0, 'Ru': 1.0}",35.36364700351977,[],NM,False,221,0,"[0.0, -0.0]",0.0,0.0,0,0.0,MP,data/source/MP/cleaned/cifs/MP-mp-214.cif,False,,data/final/MP/graphs/Ru1Zr1-MP-mp-214.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ge1Th1,1,0.0,1.0,True,Ge1Th1,Ge1Th1,0.0,Other,True,Ge50Th50,Ge-Th,2,Supercon,Ge1Th1,MP-mp-1093,Th1Ge1,Ge-Th,Ge50Th50,F m -3 m,cubic,4.30417878,4.30417878,4.30417878,data/final/MP/cifs/Ge1Th1-MP-mp-1093.cif,data/source/MP/raw/cifs/mp-1093.cif,mp-1093,0.0,,2011-05-12 19:48:16,8.972931905191997,10.17188/1187468,"@misc{osti_1187468,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ThGe (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187468"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688320'}},0.0,5.05360306,520.0,-13.57048955,-6.785244775,"{'tags': ['Thorium germanide', 'Thorium germanide (1/1)', 'Thorium germanium (1/1)']}",-13.57048955,-6.785244775,-0.7668017224999994,"['xas', 'elasticity', 'bandstructure']",True,"[99110, 44502, 56044, 638029, 638036]",True,2021-05-12 10:56:10.715000,NM,2,8,mp-1093,,ThGe,"{'functional': 'PBE', 'labels': ['Th', 'Ge_d'], 'pot_type': 'paw'}","{'Th': 1.0, 'Ge': 1.0}",GGA,mp-1093,"['mp-926131', 'mp-925730', 'mp-910281', 'mp-1093', 'mp-1442228', 'mp-1688320', 'mp-1793931', 'mp-1588001']",0.0008815,"{'Th': 1.0, 'Ge': 1.0}",56.38400321227817,[],NM,False,225,0,"[0, 0]",1.5633866873220607e-05,0.0008815,0,0.0008815,MP,data/source/MP/cleaned/cifs/MP-mp-1093.cif,False,,data/final/MP/graphs/Ge1Th1-MP-mp-1093.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
As1Ca1Co0.15F1Fe0.85,3,0.075,2.0,False,As2Ca2Co0.3F2Fe1.7,As2Ca2F2Fe2,20.8,Ferrite,True,As25Ca25Co3.75F25Fe21.25,As-Ca-Co-F-Fe,5,Supercon,Ca1Fe0.85Co0.15As1F1,MP-mp-1079859,Ca2Fe2As2F2,As-Ca-F-Fe,As25Ca25F25Fe25,P m m n,orthorhombic,3.933336,3.981276,9.018918,data/final/MP/cifs/As1Ca1Co0.15F1Fe0.85-MP-mp-1079859-synth_doped.cif,data/source/MP/raw/cifs/mp-1079859.cif,mp-1079859,0.0,,2018-04-16 14:43:21,4.464120586611354,,,{'GGA+U': {'task_id': 'mp-1695365'}},0.2859614887499973,4.27317878,520.0,-41.71531675,-5.21441459375,"{'tags': ['Calcium iron arsenide fluoride', 'High pressure experimental phase']}",-41.71531675,-5.21441459375,-1.632363168125,['bandstructure'],True,[186505],True,2021-05-12 10:58:16.596000,FM,8,6,mp-1079859,,CaFeAsF,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Fe_pv', 'As', 'F'], 'pot_type': 'paw'}","{'Ca': 1.0, 'Fe': 1.0, 'As': 1.0, 'F': 1.0}",GGA+U,mp-1079859,"['mp-1079859', 'mp-1475687', 'mp-1695365', 'mp-1785040', 'mp-1938652', 'mp-1594699']",3.7150606,"{'Ca': 2.0, 'Fe': 2.0, 'As': 2.0, 'F': 2.0}",141.2335160836522,[],FM,True,59,1,"[0.0, 0.0, 3.6, 3.6, 0.0, 0.0, 0.0, 0.0]",0.0526087674231601,3.7150606,2,7.4301212,MP,data/source/MP/cleaned/cifs/MP-mp-1079859.cif,True,,data/final/MP/graphs/As1Ca1Co0.15F1Fe0.85-MP-mp-1079859-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ni45Zr55,3,0.1,0.0363595959595959,False,Ni1.636Zr2,Ni2Zr2,2.0,Other,True,Ni45Zr55,Ni-Zr,2,Supercon,Ni45Zr55,MP-mp-556,Zr2Ni2,Ni-Zr,Ni50Zr50,C m c m,orthorhombic,3.3056900015751496,4.085559,5.25112139,data/final/MP/cifs/Ni45Zr55-MP-mp-556-synth_doped.cif,data/source/MP/raw/cifs/mp-556.cif,mp-556,0.0,,2011-05-13 06:53:32,7.396409208909017,10.17188/1269106,"@misc{osti_1269106,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrNi (SG:63) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1269106"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671699'}},0.0,5.61506989,520.0,-30.47860946,-7.619652365,"{'tags': ['Nickel zirconium (1/1)', 'Zirconium nickel (1/1)']}",-30.47860946,-7.619652365,-0.4557337100000005,"['xas', 'elasticity', 'bandstructure']",True,"[105478, 647164, 96322, 647153]",True,2021-05-12 10:56:22.739000,NM,4,12,mp-556,,ZrNi,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Ni_pv'], 'pot_type': 'paw'}","{'Zr': 1.0, 'Ni': 1.0}",GGA,mp-556,"['mp-911948', 'mp-928588', 'mp-928072', 'mp-556', 'mp-1066818', 'mp-1066904', 'mp-1067036', 'mp-1438985', 'mp-1671699', 'mp-1782717', 'mp-1592086', 'mp-1066951']",0.00462725,"{'Zr': 2.0, 'Ni': 2.0}",67.31474488005468,[],NM,False,63,0,"[0.0, 0.0, -0.0, -0.0]",0.000137481023162,0.00462725,0,0.0092545,MP,data/source/MP/cleaned/cifs/MP-mp-556.cif,True,,data/final/MP/graphs/Ni45Zr55-MP-mp-556-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Cu1Se1,1,0.0,6.0,False,Cu6Se6,Cu6Se6,0.0,Other,True,Cu50Se50,Cu-Se,2,Supercon,Cu1Se1,MP-mp-571486,Cu6Se6,Cu-Se,Cu50Se50,C m c m,orthorhombic,4.008691995800701,4.0303732,17.434923,data/final/MP/cifs/Cu1Se1-MP-mp-571486.cif,data/source/MP/raw/cifs/mp-571486.cif,mp-571486,0.0,,2014-02-16 04:36:45,5.80977890091332,10.17188/1276285,"@misc{osti_1276285,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CuSe (SG:63) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1276285"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695749'}},0.0,3.58469463,520.0,-47.0511896,-3.9209324666666654,"{'tags': ['Copper selenide - HT', 'Klockmannite']}",-47.0511896,-3.9209324666666654,-0.3593733928385418,['bandstructure'],True,[82330],True,2021-05-12 10:58:51.532000,NM,12,9,mp-571486,,CuSe,"{'functional': 'PBE', 'labels': ['Cu_pv', 'Se'], 'pot_type': 'paw'}","{'Cu': 1.0, 'Se': 1.0}",GGA,mp-571486,"['mp-924607', 'mp-924015', 'mp-909096', 'mp-571486', 'mp-1418948', 'mp-1695749', 'mp-1777126', 'mp-1875067', 'mp-1597210']",0.0002122499999999,"{'Cu': 6.0, 'Se': 6.0}",244.3846324558403,[],NM,False,63,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.211047794628078e-06,0.0002122499999999,0,0.0012735,MP,data/source/MP/cleaned/cifs/MP-mp-571486.cif,False,,data/final/MP/graphs/Cu1Se1-MP-mp-571486.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ni2Se2Tl1,1,0.0,1.0,True,Ni2Se2Tl1,Ni2Se2Tl1,3.7,Ferrite,True,Ni40Se40Tl20,Ni-Se-Tl,3,Supercon,Tl1Ni2Se2,MP-mp-4354,Tl1Ni2Se2,Ni-Se-Tl,Ni40Se40Tl20,I 4/m m m,tetragonal,3.891230002532773,3.891230002532773,7.27059338,data/final/MP/cifs/Ni2Se2Tl1-MP-mp-4354.cif,data/source/MP/raw/cifs/mp-4354.cif,mp-4354,0.0,,2011-05-13 07:37:49,7.816846231881057,10.17188/1208092,"@misc{osti_1208092,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Tl(NiSe)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208092"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698044'}},0.0223067351666648,5.55433213,520.0,-22.25284175,-4.45056835,{'tags': ['Nickel thallium selenide (2/1/2)']},-22.25284175,-4.45056835,-0.4564204576041668,"['xas', 'elasticity', 'bandstructure']",True,"[646551, 646550]",True,2021-05-12 10:56:20.740000,NM,5,8,mp-4354,,Tl(NiSe)2,"{'functional': 'PBE', 'labels': ['Tl_d', 'Ni_pv', 'Se'], 'pot_type': 'paw'}","{'Tl': 1.0, 'Ni': 2.0, 'Se': 2.0}",GGA,mp-4354,"['mp-1001994', 'mp-1008364', 'mp-4354', 'mp-1441807', 'mp-1698044', 'mp-1930423', 'mp-1012657', 'mp-1596427']",0.0082661,"{'Tl': 1.0, 'Ni': 2.0, 'Se': 2.0}",101.90096200978728,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",8.111895939908857e-05,0.0082661,0,0.0082661,MP,data/source/MP/cleaned/cifs/MP-mp-4354.cif,False,,data/final/MP/graphs/Ni2Se2Tl1-MP-mp-4354.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Cu1.8S1,2,0.0476190476190475,4.0,False,Cu7.2S4,Cu8S4,0.0,Other,True,Cu64.286S35.714,Cu-S,2,Supercon,Cu1.8S1,MP-mp-618991,Cu8S4,Cu-S,Cu66.667S33.333,P 43 21 2,tetragonal,3.99359,3.99359,11.237167,data/final/MP/cifs/Cu1.8S1-MP-mp-618991-synth_doped.cif,data/source/MP/raw/cifs/mp-618991.cif,mp-618991,0.5023,,2013-06-10 08:11:02,5.89862851138292,10.17188/1277958,"@misc{osti_1277958,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Cu2S (SG:96) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277958"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696018'}},0.0477811810416666,6.18577316,520.0,-50.41653652,-4.201378043333333,"{'tags': ['Chalcocite-Q', 'Copper(I) sulfide']}",-50.41653652,-4.201378043333333,-0.257423641041667,"['piezo', 'xas', 'bandstructure', 'diel', 'elasticity']",True,[16550],True,2021-05-12 10:56:27.046000,NM,12,14,mp-618991,,Cu2S,"{'functional': 'PBE', 'labels': ['Cu_pv', 'S'], 'pot_type': 'paw'}","{'Cu': 2.0, 'S': 1.0}",GGA,mp-618991,"['mp-661139', 'mp-851340', 'mp-670689', 'mp-850063', 'mp-618991', 'mp-852123', 'mp-1117054', 'mp-1119571', 'mp-1428377', 'mp-1696018', 'mp-1835015', 'mp-852201', 'mp-1599323', 'mp-687635']",0.000517125,"{'Cu': 8.0, 'S': 4.0}",179.2188917900814,[],NM,False,96,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.1541751984622404e-05,0.000517125,0,0.0020685,MP,data/source/MP/cleaned/cifs/MP-mp-618991.cif,True,,data/final/MP/graphs/Cu1.8S1-MP-mp-618991-synth_doped.json,0,True,422,0,0,0,0,4,0,0,1,0,0,0,1.0,False
Ag5Cd8,1,0.0,2.0,False,Ag10Cd16,Ag10Cd16,0.0,Other,True,Ag38.462Cd61.538,Ag-Cd,2,Supercon,Ag5Cd8,MP-mp-567857,Cd16Ag10,Ag-Cd,Ag38.462Cd61.538,I -4 3 m,cubic,8.811067171953276,8.811067170000001,8.81106717,data/final/MP/cifs/Ag5Cd8-MP-mp-567857.cif,data/source/MP/raw/cifs/mp-567857.cif,mp-567857,0.0,,2015-02-14 22:25:12,9.073278864219391,10.17188/1274083,"@misc{osti_1274083,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Cd8Ag5 (SG:217) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1274083"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1758980'}},0.0,2.61224487,520.0,-44.89097997,-1.7265761526923076,{'tags': ['Silver cadmium (5/8)']},-44.89097997,-1.7265761526923076,-0.0691993760256407,"['xas', 'bandstructure']",True,[604897],True,2021-05-12 10:57:23.123000,NM,26,8,mp-567857,,Cd8Ag5,"{'functional': 'PBE', 'labels': ['Cd', 'Ag'], 'pot_type': 'paw'}","{'Cd': 8.0, 'Ag': 5.0}",GGA,mp-567857,"['mp-933413', 'mp-943664', 'mp-944321', 'mp-567857', 'mp-1409313', 'mp-1758980', 'mp-1926149', 'mp-1624024']",0.0036061,"{'Cd': 16.0, 'Ag': 10.0}",526.5791325480697,[],NM,False,217,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.3696327017557275e-05,0.0036061,0,0.0072122,MP,data/source/MP/cleaned/cifs/MP-mp-567857.cif,False,,data/final/MP/graphs/Ag5Cd8-MP-mp-567857.json,0,True,-43m,5,0,0,0,0,0,0,0,0,1,0,1.0,False
Co0.85Ni0.15Zr2,3,0.1,2.0,False,Co1.7Ni0.3Zr4,Co2Zr4,5.98,Other,True,Co28.333Ni5Zr66.667,Co-Ni-Zr,3,Supercon,Zr2Co0.85Ni0.15,MP-mp-628,Zr4Co2,Co-Zr,Co33.333Zr66.667,I 4/m c m,tetragonal,5.27792884001752,5.27792884,5.277928840000001,data/final/MP/cifs/Co0.85Ni0.15Zr2-MP-mp-628-synth_doped.cif,data/source/MP/raw/cifs/mp-628.cif,mp-628,0.0,,2011-05-13 12:16:44,7.17077101131263,10.17188/1278899,"@misc{osti_1278899,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Zr2Co (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278899"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677545'}},0.0,4.51380976,520.0,-49.95120762,-8.325201269999999,"{'tags': ['Cobalt zirconium (1/2)', 'Zirconium cobalt (2/1)']}",-49.95120762,-8.325201269999999,-0.2572949183333328,"['xas', 'elasticity', 'bandstructure']",True,"[625671, 191386, 625688, 102740, 625665]",True,2021-05-12 10:56:27.046000,NM,6,20,mp-628,,Zr2Co,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Co'], 'pot_type': 'paw'}","{'Zr': 2.0, 'Co': 1.0}",GGA,mp-628,"['mp-928347', 'mp-912327', 'mp-928866', 'mp-628', 'mp-1071352', 'mp-1071381', 'mp-1071431', 'mp-1071762', 'mp-1071803', 'mp-1071859', 'mp-1071883', 'mp-1071742', 'mp-1071925', 'mp-1441633', 'mp-1677545', 'mp-1802810', 'mp-1591799', 'mp-1071792', 'mp-1071416', 'mp-1071915']",0.0001226,"{'Zr': 4.0, 'Co': 2.0}",111.79353060019714,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0]",2.1933290654975308e-06,0.0001226,0,0.0002452,MP,data/source/MP/cleaned/cifs/MP-mp-628.cif,True,,data/final/MP/graphs/Co0.85Ni0.15Zr2-MP-mp-628-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As1Fe1Nd1O1,1,0.0,2.0,False,As2Fe2Nd2O2,As2Fe2Nd2O2,0.0,Ferrite,True,As25Fe25Nd25O25,As-Fe-Nd-O,4,Supercon,Nd1Fe1As1O1,MP-mp-622621,Nd2Fe2As2O2,As-Fe-Nd-O,As25Fe25Nd25O25,P 4/n m m,tetragonal,4.074653,4.074653,9.170967,data/final/MP/cifs/As1Fe1Nd1O1-MP-mp-622621.cif,data/source/MP/raw/cifs/mp-622621.cif,mp-622621,0.0,,2014-02-16 22:28:25,6.347279619112142,10.17188/1278150,"@misc{osti_1278150,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NdFeAsO (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278150"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-1677677'}},0.2809314202083302,3.74777613,520.0,-52.70842543,-6.58855317875,{'tags': ['Neodymium iron arsenic oxide (1/1/1/1)']},-52.70842543,-6.58855317875,-1.61299541125,"['xas', 'bandstructure']",True,"[163547, 164679, 422001, 163546, 236651, 236650, 602466, 164680, 164676]",True,2021-05-12 10:57:28.836000,FM,8,8,mp-622621,oxide,NdFeAsO,"{'functional': 'PBE', 'labels': ['Nd_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Nd': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-622621,"['mp-622621', 'mp-1079381', 'mp-1173401', 'mp-1438697', 'mp-1677677', 'mp-1772072', 'mp-1926310', 'mp-1592869']",3.83954265,"{'Nd': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",152.26370404041757,[],FM,True,129,1,"[0.0, 0.0, 3.6, 3.6, -0.0, -0.0, -0.0, -0.0]",0.0504328024094411,3.83954265,2,7.6790853,MP,data/source/MP/cleaned/cifs/MP-mp-622621.cif,False,,data/final/MP/graphs/As1Fe1Nd1O1-MP-mp-622621.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Na0.23W1O3,2,0.045099108928896,3.0,False,Na0.69W3O9,Na1W3O9,2.16,Oxide,True,Na5.437W23.641O70.92198581560282,Na-W-O,3,Supercon,Na0.23W1O3,MP-mp-1221403,Na1W3O9,Na-W-O,Na7.692W23.077O69.23076923076923,P -3 m 1,trigonal,5.507389995326316,5.5073903,6.742919,data/final/MP/cifs/Na0.23W1O3-MP-mp-1221403-synth_doped.cif,data/source/MP/raw/cifs/mp-1221403.cif,mp-1221403,0.0,,2019-01-12 22:06:05.901000,6.736095585172406,,,{'GGA+U': {'task_id': 'mp-1743310'}},0.0076796096029791,2.826287,520.0,-93.73276137,-7.210212413076923,{'tags': []},-93.73276137,-7.210212413076923,-2.192400586273211,[],False,[],True,2021-05-12 11:00:47.244000,FM,13,4,mp-1221403,oxide,Na(WO3)3,"{'functional': 'PBE', 'labels': ['Na_pv', 'W_pv', 'O'], 'pot_type': 'paw'}","{'Na': 1.0, 'W': 3.0, 'O': 9.0}",GGA+U,mp-1221403,"['mp-1221403', 'mp-1390704', 'mp-1743310', 'mp-1828967']",0.9993041,"{'Na': 1.0, 'W': 3.0, 'O': 9.0}",177.12108737567684,[],FM,True,164,2,"[0.0, 0.5, 0.4, 0.4, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0056419261805933,0.9993041,3,0.9993041,MP,data/source/MP/cleaned/cifs/MP-mp-1221403.cif,True,,data/final/MP/graphs/Na0.23W1O3-MP-mp-1221403-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
B1V1,1,0.0,2.0,False,B2V2,B2V2,0.0,Other,True,B50V50,B-V,2,Supercon,B1V1,MP-mp-9973,V2B2,B-V,B50V50,C m c m,orthorhombic,2.969258,3.052877998200183,4.29754956,data/final/MP/cifs/B1V1-MP-mp-9973.cif,data/source/MP/raw/cifs/mp-9973.cif,mp-9973,0.0,,2011-05-27 19:05:22,5.631694260998425,10.17188/1317210,"@misc{osti_1317210,
    author = ""Persson, Kristin"",
    title = ""Materials Data on VB (SG:63) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1317210"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688099'}},0.0,7.55378249,520.0,-34.9153388,-8.7288347,{'tags': ['Vanadium boride (1/1)']},-34.9153388,-8.7288347,-0.8471857795833335,"['xas', 'elasticity', 'bandstructure']",True,"[615658, 42952]",True,2021-05-12 10:56:37.246000,NM,4,8,mp-9973,,VB,"{'functional': 'PBE', 'labels': ['V_pv', 'B'], 'pot_type': 'paw'}","{'V': 1.0, 'B': 1.0}",GGA,mp-9973,"['mp-925450', 'mp-909904', 'mp-925867', 'mp-9973', 'mp-1439479', 'mp-1688099', 'mp-1791177', 'mp-1595638']",0.0011365,"{'V': 2.0, 'B': 2.0}",36.41619518316573,[],NM,False,63,0,"[0, 0, 0, 0]",6.241728408383391e-05,0.0011365,0,0.002273,MP,data/source/MP/cleaned/cifs/MP-mp-9973.cif,False,,data/final/MP/graphs/B1V1-MP-mp-9973.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Se2Ta1,1,0.0,1.0,True,Se2Ta1,Se2Ta1,0.125,Other,True,Se66.667Ta33.333,Se-Ta,2,Supercon,Se2Ta1,MP-mp-8954,Ta1Se2,Se-Ta,Se66.667Ta33.333,F m m 2,orthorhombic,3.474241998042351,3.475490163854172,12.353225546845009,data/final/MP/cifs/Se2Ta1-MP-mp-8954.cif,data/source/MP/raw/cifs/mp-8954.cif,mp-8954,0.0,,2011-05-27 18:32:34,4.399236768583485,10.17188/1312860,"@misc{osti_1312860,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TaSe2 (SG:42) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1312860"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704770'}},0.0,-0.44056206,520.0,-21.30501369,-7.10167123,"{'tags': ['Tantalum(IV) selenide', 'Bismuth tantalum selenide (1.09/1/3.09)']}",-21.30501369,-7.10167123,-1.133137701562499,"['xas', 'bandstructure']",True,"[72198, 41272]",True,2021-05-12 10:57:55.580000,NM,3,8,mp-8954,,TaSe2,"{'functional': 'PBE', 'labels': ['Ta_pv', 'Se'], 'pot_type': 'paw'}","{'Ta': 1.0, 'Se': 2.0}",GGA,mp-8954,"['mp-1000657', 'mp-1007121', 'mp-8954', 'mp-1441647', 'mp-1704770', 'mp-1931981', 'mp-1011867', 'mp-1588380']",0.0002924,"{'Ta': 1.0, 'Se': 2.0}",127.90931308230228,[],NM,False,42,0,"[0, 0, 0]",2.285994607850466e-06,0.0002924,0,0.0002924,MP,data/source/MP/cleaned/cifs/MP-mp-8954.cif,False,,data/final/MP/graphs/Se2Ta1-MP-mp-8954.json,0,True,mm2,0,0,0,6,0,0,0,0,0,0,1,1.0,False
Ge0.3Tl0.7,3,0.1,8.0,False,Ge2.4Tl5.6,Ge2Tl6,0.0,Other,True,Ge30Tl70,Ge-Tl,2,Supercon,Ge0.3Tl0.7,MP-mp-981310,Tl6Ge2,Ge-Tl,Ge25Tl75,P 63/m m c,hexagonal,5.349991,7.047540003748888,7.04753942,data/final/MP/cifs/Ge0.3Tl0.7-MP-mp-981310-synth_doped.cif,data/source/MP/raw/cifs/mp-981310.cif,mp-981310,0.0,,2015-10-11 17:54:45,9.897179427396765,10.17188/1316325,"@misc{osti_1316325,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Tl3Ge (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1316325"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1742670'}},0.1689757387499999,5.59255637,520.0,-22.07010868,-2.758763585,{'tags': []},-22.07010868,-2.758763585,0.1689757387499999,"['xas', 'bandstructure']",True,[],True,2021-05-12 10:57:57.486000,NM,8,6,mp-981310,,Tl3Ge,"{'functional': 'PBE', 'labels': ['Tl_d', 'Ge_d'], 'pot_type': 'paw'}","{'Tl': 3.0, 'Ge': 1.0}",GGA,mp-981310,"['mp-981467', 'mp-981310', 'mp-1388750', 'mp-1742670', 'mp-1776997', 'mp-1623680']",0.00209275,"{'Tl': 6.0, 'Ge': 2.0}",230.1223149046696,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.818815355535549e-05,0.00209275,0,0.0041855,MP,data/source/MP/cleaned/cifs/MP-mp-981310.cif,True,,data/final/MP/graphs/Ge0.3Tl0.7-MP-mp-981310-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Cu1La1.945Rb0.055O4,2,0.0157142857142857,1.0,True,Cu1La1.945Rb0.055O4,Cu1La2O4,22.0,Cuprate,True,Cu14.286La27.786Rb0.786O57.142857142857146,Cu-La-Rb-O,4,Supercon,La1.945Rb0.055Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La1.945Rb0.055O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La1.945Rb0.055O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B2Rh3Tm1,1,0.0,1.0,True,B2Rh3Tm1,B2Rh3Tm1,0.0,Other,True,B33.333Rh50Tm16.667,B-Rh-Tm,3,Supercon,Tm1Rh3B2,MP-mp-1076960,Tm1B2Rh3,B-Rh-Tm,B33.333Rh50Tm16.667,P 6/m m m,hexagonal,3.122488,5.410946001130111,5.4109454,data/final/MP/cifs/B2Rh3Tm1-MP-mp-1076960.cif,data/source/MP/raw/cifs/mp-1076960.cif,mp-1076960,0.0,,2018-04-07 12:24:39,10.471506844005992,,,{'GGA': {'task_id': 'mp-1702836'}},0.0156765734166688,6.34170532,520.0,-44.18477937,-7.364129895,"{'tags': ['TmRh3B2', 'ErIr3B2', 'Thulium rhodium boride (1/3/2)']}",-44.18477937,-7.364129895,-0.7095394658333328,['bandstructure'],True,[615331],True,2021-05-12 10:58:14.654000,NM,6,5,mp-1076960,,TmB2Rh3,"{'functional': 'PBE', 'labels': ['Tm_3', 'B', 'Rh_pv'], 'pot_type': 'paw'}","{'Tm': 1.0, 'B': 2.0, 'Rh': 3.0}",GGA,mp-1076960,"['mp-1076960', 'mp-1432724', 'mp-1702836', 'mp-1798507', 'mp-1596080']",2.25e-05,"{'Tm': 1.0, 'B': 2.0, 'Rh': 3.0}",79.17311731661779,[],NM,False,191,0,"[0, 0, 0, 0, 0, 0]",2.841873701905815e-07,2.25e-05,0,2.25e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1076960.cif,False,,data/final/MP/graphs/B2Rh3Tm1-MP-mp-1076960.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Al0.83Ge0.17Nb3,3,0.085,2.0,False,Al1.66Ge0.34Nb6,Al2Nb6,19.6,Other,True,Al20.75Ge4.25Nb75,Al-Ge-Nb,3,Supercon,Nb3Al0.83Ge0.17,MP-mp-796,Nb6Al2,Al-Nb,Al25Nb75,P m -3 n,cubic,5.215254,5.215254,5.215254,data/final/MP/cifs/Al0.83Ge0.17Nb3-MP-mp-796-synth_doped.cif,data/source/MP/raw/cifs/mp-796.cif,mp-796,0.0,,2011-05-13 16:07:37,7.157298025966356,,,{'GGA': {'task_id': 'mp-1686893'}},0.0460773865000003,5.52947534,520.0,-69.48918494,-8.6861481175,"{'tags': ['Aluminium niobium (1/3)', 'Niobium aluminide (3/1)', 'Aluminum niobium (1/3)']}",-69.48918494,-8.6861481175,-0.1737753800000003,"['bandstructure', 'elasticity']",True,"[608675, 608654, 608688, 608668, 608669, 608685, 608676, 608683, 58014, 608657, 107856, 608655, 608666, 608691, 608656, 608665, 608673, 608653, 608661]",True,2021-05-12 10:56:31.128000,NM,8,10,mp-796,,Nb3Al,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Al': 1.0}",GGA,mp-796,"['mp-911586', 'mp-927906', 'mp-796', 'mp-927472', 'mp-1260512', 'mp-1440919', 'mp-1686893', 'mp-1927652', 'mp-1591599', 'mp-1587739']",0.16323955,"{'Nb': 6.0, 'Al': 2.0}",141.8490379078192,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0023015954483396,0.16323955,0,0.3264791,MP,data/source/MP/cleaned/cifs/MP-mp-796.cif,True,,data/final/MP/graphs/Al0.83Ge0.17Nb3-MP-mp-796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Th70.2Tm29.8,3,0.0959999999999999,0.0399999999999999,False,Th2.808Tm1.192,Th3Tm1,0.67,Other,True,Th70.2Tm29.8,Th-Tm,2,Supercon,Th70.2Tm29.8,MP-mp-980014,Tm1Th3,Th-Tm,Th75Tm25,P m -3 m,cubic,5.037142,5.037142,5.037142,data/final/MP/cifs/Th70.2Tm29.8-MP-mp-980014-synth_doped.cif,data/source/MP/raw/cifs/mp-980014.cif,mp-980014,0.0,,2015-10-10 13:24:48,11.239239284742627,10.17188/1316211,"@misc{osti_1316211,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TmTh3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1316211"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1759433'}},0.033376698333333,6.52926197,520.0,-26.58390338,-6.645975845,{'tags': []},-26.58390338,-6.645975845,0.033376698333333,"['xas', 'elasticity', 'bandstructure']",True,[],True,2021-05-12 10:56:37.246000,NM,4,8,mp-980014,,TmTh3,"{'functional': 'PBE', 'labels': ['Tm_3', 'Th'], 'pot_type': 'paw'}","{'Tm': 1.0, 'Th': 3.0}",GGA,mp-980014,"['mp-980295', 'mp-980711', 'mp-980014', 'mp-1391570', 'mp-1759433', 'mp-1803898', 'mp-981218', 'mp-1627487']",0.0040846,"{'Tm': 1.0, 'Th': 3.0}",127.80639416089508,[],NM,False,221,0,"[0, 0, 0, 0]",3.1959277364933006e-05,0.0040846,0,0.0040846,MP,data/source/MP/cleaned/cifs/MP-mp-980014.cif,True,,data/final/MP/graphs/Th70.2Tm29.8-MP-mp-980014-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Bi1.1K0.9O3,2,0.04,1.0,True,Bi1.1K0.9O3,Bi1K1O3,8.35,Oxide,True,Bi22K18O60,Bi-K-O,3,Supercon,K0.9Bi1.1O3,MP-mp-982040,K1Bi1O3,Bi-K-O,Bi20K20O60,P m -3 m,cubic,4.284204,4.284204,4.284204,data/final/MP/cifs/Bi1.1K0.9O3-MP-mp-982040-synth_doped.cif,data/source/MP/raw/cifs/mp-982040.cif,mp-982040,0.0,,2015-10-12 11:25:13,6.252348761231978,10.17188/1316390,"@misc{osti_1316390,
    author = ""Persson, Kristin"",
    title = ""Materials Data on KBiO3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1316390"",
    place = ""United States"",
    year = ""2016"",
    month = ""9"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1717462'}},0.0928686834999998,1.80216133,520.0,-25.20286901,-5.040573802,{'tags': []},-25.20286901,-5.040573802,-1.4839105476,"['xas', 'elasticity']",False,[],True,2021-05-12 10:56:37.246000,NM,5,9,mp-982040,oxide,KBiO3,"{'functional': 'PBE', 'labels': ['K_sv', 'Bi', 'O'], 'pot_type': 'paw'}","{'K': 1.0, 'Bi': 1.0, 'O': 3.0}",GGA,mp-982040,"['mp-982222', 'mp-1006156', 'mp-982040', 'mp-1006117', 'mp-1431172', 'mp-1717462', 'mp-1798749', 'mp-1011221', 'mp-1585048']",0.0005425,"{'K': 1.0, 'Bi': 1.0, 'O': 3.0}",78.63401066432932,[],NM,False,221,0,"[0, 0, 0, 0, 0]",6.899050365315956e-06,0.0005425,0,0.0005425,MP,data/source/MP/cleaned/cifs/MP-mp-982040.cif,True,,data/final/MP/graphs/Bi1.1K0.9O3-MP-mp-982040-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Pt1Sn2,1,0.0,1.0,True,Pt1Sn2,Pt1Sn2,0.0,Other,True,Pt33.333Sn66.667,Pt-Sn,2,Supercon,Pt1Sn2,MP-mp-19962,Sn2Pt1,Pt-Sn,Pt33.333Sn66.667,F m -3 m,cubic,4.63495626,4.63495626,4.63495626,data/final/MP/cifs/Pt1Sn2-MP-mp-19962.cif,data/source/MP/raw/cifs/mp-19962.cif,mp-19962,0.0,,2014-02-21 07:43:01,10.200402387588715,10.17188/1195146,"@misc{osti_1195146,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sn2Pt (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195146"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672921'}},0.0,8.04015219,520.0,-15.43284116,-5.144280386666667,{'tags': ['Platinum tin (1/2)']},-15.43284116,-5.144280386666667,-0.4475965800000002,"['xas', 'elasticity', 'bandstructure']",True,"[105792, 183078, 658328, 649679, 105791, 649678]",True,2021-05-12 10:56:14.760000,NM,3,12,mp-19962,,Sn2Pt,"{'functional': 'PBE', 'labels': ['Sn_d', 'Pt'], 'pot_type': 'paw'}","{'Sn': 2.0, 'Pt': 1.0}",GGA,mp-19962,"['mp-913860', 'mp-930620', 'mp-19962', 'mp-1062183', 'mp-1062196', 'mp-1062214', 'mp-1440246', 'mp-1672921', 'mp-1869740', 'mp-977648', 'mp-1588936', 'mp-1062224']",0.0002468,"{'Sn': 2.0, 'Pt': 1.0}",70.40798599618185,[],NM,False,225,0,"[0, 0, 0]",3.5052841876968854e-06,0.0002468,0,0.0002468,MP,data/source/MP/cleaned/cifs/MP-mp-19962.cif,False,,data/final/MP/graphs/Pt1Sn2-MP-mp-19962.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Pb1Se1,1,0.0,1.0,True,Pb1Se1,Pb1Se1,0.0,Other,True,Pb50Se50,Pb-Se,2,Supercon,Pb1Se1,MP-mp-2201,Pb1Se1,Pb-Se,Pb50Se50,F m -3 m,cubic,4.40047541,4.400475409999999,4.400475409999999,data/final/MP/cifs/Pb1Se1-MP-mp-2201.cif,data/source/MP/raw/cifs/mp-2201.cif,mp-2201,0.9081,,2011-05-12 18:58:21,7.886316965624365,10.17188/1197285,"@misc{osti_1197285,
    author = ""Persson, Kristin"",
    title = ""Materials Data on PbSe (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197285"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686599'}},0.0,4.28146088,520.0,-8.3298399,-4.16491995,"{'tags': ['Lead selenide', 'Selenium sulfide', 'Lead(II) selenide', 'Lead selenide (1/1)', 'Clausthalite', 'High pressure experimental phase', 'Lead selenide - rock salt type']}",-8.3298399,-4.16491995,-0.7966406761718745,"['eos', 'xas', 'bandstructure', 'diel', 'phonons', 'elasticity']",True,"[238502, 238609, 63097, 600252, 63096, 648528, 186790, 648516, 600730, 76644, 648517, 648519, 648518, 38294, 648512, 62195, 600599, 248493, 648527, 648520, 648521, 648515, 53933, 648525, 648522, 657561, 187699, 603893, 248492, 648524, 183008, 290054, 62196, 648513]",True,2021-05-12 10:56:16.728000,NM,2,43,mp-2201,,PbSe,"{'functional': 'PBE', 'labels': ['Pb_d', 'Se'], 'pot_type': 'paw'}","{'Pb': 1.0, 'Se': 1.0}",GGA,mp-2201,"['mp-656588', 'mp-656586', 'mp-656585', 'mp-2201', 'mp-20667', 'mp-1056902', 'mp-1056914', 'mp-1056915', 'mp-1056896', 'mp-1056927', 'mp-1056932', 'mp-1057330', 'mp-1057351', 'mp-1057323', 'mp-1058654', 'mp-1058646', 'mp-1058675', 'mp-1060366', 'mp-1060378', 'mp-1060402', 'mp-1060932', 'mp-1060953', 'mp-1061136', 'mp-1060992', 'mp-1061184', 'mp-1061200', 'mp-1061089', 'mp-1061241', 'mp-1061103', 'mp-1140706', 'mp-1440670', 'mp-1686599', 'mp-1781484', 'mp-1592398', 'mp-1592713', 'mp-1061254', 'mp-1058681', 'mp-1056935', 'mp-1057356', 'mp-1056937', 'mp-1060416', 'mp-1061008', 'mp-1061143']",0.0018509,"{'Pb': 1.0, 'Se': 1.0}",60.25371049242828,[],NM,False,225,0,"[0, 0]",3.0718440157018905e-05,0.0018509,0,0.0018509,MP,data/source/MP/cleaned/cifs/MP-mp-2201.cif,False,,data/final/MP/graphs/Pb1Se1-MP-mp-2201.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ga1Hf2,1,0.0,2.0,False,Ga2Hf4,Ga2Hf4,0.21,Other,True,Ga33.333Hf66.667,Ga-Hf,2,Supercon,Ga1Hf2,MP-mp-30572,Hf4Ga2,Ga-Hf,Ga33.333Hf66.667,I 4/m c m,tetragonal,5.291513999265731,5.433778159423841,5.433778159999999,data/final/MP/cifs/Ga1Hf2-MP-mp-30572.cif,data/source/MP/raw/cifs/mp-30572.cif,mp-30572,0.0,,2014-02-19 20:37:33,11.888919843182242,10.17188/1204963,"@misc{osti_1204963,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Hf2Ga (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1204963"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704453'}},0.0,4.27569421,520.0,-48.27361124,-8.045601873333334,{'tags': ['Gallium hafnium (1/2)']},-48.27361124,-8.045601873333334,-0.3981106324999999,"['xas', 'elasticity', 'bandstructure']",True,"[634302, 102809]",True,2021-05-12 10:56:18.721000,NM,6,12,mp-30572,,Hf2Ga,"{'functional': 'PBE', 'labels': ['Hf_pv', 'Ga_d'], 'pot_type': 'paw'}","{'Hf': 2.0, 'Ga': 1.0}",GGA,mp-30572,"['mp-912342', 'mp-928857', 'mp-928354', 'mp-30572', 'mp-1072246', 'mp-1072265', 'mp-1072305', 'mp-1435979', 'mp-1704453', 'mp-1804859', 'mp-1592642', 'mp-1072300']",0.0003868,"{'Hf': 4.0, 'Ga': 2.0}",119.1961945545028,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0]",6.490140082838543e-06,0.0003868,0,0.0007736,MP,data/source/MP/cleaned/cifs/MP-mp-30572.cif,False,,data/final/MP/graphs/Ga1Hf2-MP-mp-30572.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Hg2K1,1,0.0,2.0,False,Hg4K2,Hg4K2,1.2,Other,True,Hg66.667K33.333,Hg-K,2,Supercon,Hg2K1,MP-mp-30717,K2Hg4,Hg-K,Hg66.667K33.333,I m m a,orthorhombic,5.298788003161588,6.80163616,6.801636161018472,data/final/MP/cifs/Hg2K1-MP-mp-30717.cif,data/source/MP/raw/cifs/mp-30717.cif,mp-30717,0.0,,2014-02-19 20:37:48,7.097527233874118,10.17188/1205076,"@misc{osti_1205076,
    author = ""Persson, Kristin"",
    title = ""Materials Data on KHg2 (SG:74) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1205076"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695498'}},0.0,1.31924713,520.0,-5.12057237,-0.8534287283333333,{'tags': ['Mercury potassium (2/1)']},-5.12057237,-0.8534287283333333,-0.2808421693333332,"['xas', 'elasticity', 'bandstructure']",True,[104303],True,2021-05-12 10:56:18.721000,NM,6,8,mp-30717,,KHg2,"{'functional': 'PBE', 'labels': ['K_sv', 'Hg'], 'pot_type': 'paw'}","{'K': 1.0, 'Hg': 2.0}",GGA,mp-30717,"['mp-941713', 'mp-935019', 'mp-941863', 'mp-30717', 'mp-1420442', 'mp-1695498', 'mp-1833643', 'mp-1591907']",4.05e-06,"{'K': 2.0, 'Hg': 4.0}",206.0152200154845,[],NM,False,74,0,"[0, 0, 0, 0, 0, 0]",3.9317483433462784e-08,4.05e-06,0,8.1e-06,MP,data/source/MP/cleaned/cifs/MP-mp-30717.cif,False,,data/final/MP/graphs/Hg2K1-MP-mp-30717.json,0,True,mmm,0,0,0,7,0,0,0,0,0,1,0,1.0,False
Ca1Cu2Nd0.16Pb0.5Sr1.84Tl0.5O7,3,0.0246153846153846,2.0,False,Ca2Cu4Nd0.32Pb1Sr3.68Tl1O14,Ca2Cu4Pb1Sr4Tl1O14,102.0,Cuprate,True,Ca7.692Cu15.385Nd1.231Pb3.846Sr14.154Tl3.846O53.84615384615385,Ca-Cu-Nd-Pb-Sr-Tl-O,7,Supercon,Tl0.5Pb0.5Sr1.84Nd0.16Ca1Cu2O7,MP-mp-1173221,Sr4Ca2Tl1Cu4Pb1O14,Ca-Cu-Pb-Sr-Tl-O,Ca7.692Cu15.385Pb3.846Sr15.385Tl3.846O53.84615384615385,I 4/m m m,tetragonal,5.374731999708263,5.374731999708263,12.82905816,data/final/MP/cifs/Ca1Cu2Nd0.16Pb0.5Sr1.84Tl0.5O7-MP-mp-1173221-synth_doped.cif,data/source/MP/raw/cifs/mp-1173221.cif,mp-1173221,0.0,,2019-01-11 01:27:33.089000,6.194266073733895,,,,0.0254255932211506,3.8256747,520.0,-146.89191057,-5.649688868076923,{'tags': []},-146.89191057,-5.649688868076923,-2.0768140780769224,[],False,[],True,2021-05-12 10:59:37.456000,NM,26,4,mp-1173221,oxide,Sr4Ca2TlCu4PbO14,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Tl_d', 'Cu_pv', 'Pb_d', 'O'], 'pot_type': 'paw'}","{'Sr': 4.0, 'Ca': 2.0, 'Tl': 1.0, 'Cu': 4.0, 'Pb': 1.0, 'O': 14.0}",GGA,mp-1173221,"['mp-1173221', 'mp-1218598', 'mp-1366452', 'mp-1839546']",0.0074263,"{'Sr': 4.0, 'Ca': 2.0, 'Tl': 1.0, 'Cu': 4.0, 'Pb': 1.0, 'O': 14.0}",353.9672478853857,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",2.098018967677097e-05,0.0074263,0,0.0074263,MP,data/source/MP/cleaned/cifs/MP-mp-1173221.cif,True,,data/final/MP/graphs/Ca1Cu2Nd0.16Pb0.5Sr1.84Tl0.5O7-MP-mp-1173221-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ag5Pb2O6,1,0.0,1.0,True,Ag5Pb2O6,Ag5Pb2O6,0.0502,Oxide,True,Ag38.462Pb15.385O46.15384615384615,Ag-Pb-O,3,Supercon,Ag5Pb2O6,MP-mp-22286,Ag5Pb2O6,Ag-Pb-O,Ag38.462Pb15.385O46.15384615384615,P -3 1 m,trigonal,6.07129599742349,6.071296370000001,6.527926,data/final/MP/cifs/Ag5Pb2O6-MP-mp-22286.cif,data/source/MP/raw/cifs/mp-22286.cif,mp-22286,0.0,,2014-02-22 14:12:22,8.36490598369441,10.17188/1197507,"@misc{osti_1197507,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ag5(PbO3)2 (SG:162) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197507"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698889'}},0.0,3.52542578,520.0,-57.6351196,-4.433470738461539,"{'tags': ['Pentasilver dilead hexaoxide', 'Silver lead oxide (5/2/6)']}",-57.6351196,-4.433470738461539,-0.8062522625641025,['bandstructure'],True,"[155043, 155044, 79667, 40058]",True,2021-05-12 10:58:49.477000,NM,13,8,mp-22286,oxide,Ag5(PbO3)2,"{'functional': 'PBE', 'labels': ['Ag', 'Pb_d', 'O'], 'pot_type': 'paw'}","{'Ag': 5.0, 'Pb': 2.0, 'O': 6.0}",GGA,mp-22286,"['mp-991127', 'mp-993118', 'mp-22286', 'mp-1414376', 'mp-1698889', 'mp-1790277', 'mp-994444', 'mp-1600588']",0.0011516,"{'Ag': 5.0, 'Pb': 2.0, 'O': 6.0}",208.3860793855865,[],NM,False,162,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.526280850407194e-06,0.0011516,0,0.0011516,MP,data/source/MP/cleaned/cifs/MP-mp-22286.cif,False,,data/final/MP/graphs/Ag5Pb2O6-MP-mp-22286.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
In0.18Mg0.82,3,0.1399999999999999,4.0,False,In0.72Mg3.28,In1Mg3,0.0,Other,True,In18Mg82,In-Mg,2,Supercon,In0.18Mg0.82,MP-mp-569125,Mg3In1,In-Mg,In25Mg75,P m -3 m,cubic,4.496935,4.496935,4.496935,data/final/MP/cifs/In0.18Mg0.82-MP-mp-569125-synth_doped.cif,data/source/MP/raw/cifs/mp-569125.cif,mp-569125,0.0,,2014-02-16 09:17:28,3.4279926902346705,10.17188/1274948,"@misc{osti_1274948,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Mg3In (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1274948"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678262'}},0.0,4.08472535,520.0,-7.8818188,-1.9704547,{'tags': ['Indium magnesium (1/3)']},-7.8818188,-1.9704547,-0.0823237299999999,"['xas', 'elasticity', 'bandstructure']",True,[51975],True,2021-05-12 10:56:22.739000,NM,4,8,mp-569125,,Mg3In,"{'functional': 'PBE', 'labels': ['Mg_pv', 'In_d'], 'pot_type': 'paw'}","{'Mg': 3.0, 'In': 1.0}",GGA,mp-569125,"['mp-569125', 'mp-1001156', 'mp-1007529', 'mp-1441117', 'mp-1678262', 'mp-1796434', 'mp-1012291', 'mp-1592084']",0.00106,"{'Mg': 3.0, 'In': 1.0}",90.9389280432442,[],NM,False,221,0,"[0, 0, 0, 0]",1.1656174344785968e-05,0.00106,0,0.00106,MP,data/source/MP/cleaned/cifs/MP-mp-569125.cif,True,,data/final/MP/graphs/In0.18Mg0.82-MP-mp-569125-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
As2Ca1Pd2,1,0.0,1.0,True,As2Ca1Pd2,As2Ca1Pd2,1.27,Other,True,As40Ca20Pd40,As-Ca-Pd,3,Supercon,Ca1Pd2As2,MP-mp-5166,Ca1As2Pd2,As-Ca-Pd,As40Ca20Pd40,I 4/m m m,tetragonal,4.358534002507343,4.358534002507342,5.99160357,data/final/MP/cifs/As2Ca1Pd2-MP-mp-5166.cif,data/source/MP/raw/cifs/mp-5166.cif,mp-5166,0.0,,2011-05-12 23:28:51,6.851827936329905,10.17188/1263119,"@misc{osti_1263119,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ca(AsPd)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1263119"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1069002'}},0.0,5.2053521,520.0,-25.39018387,-5.078036774,"{'tags': ['Calcium palladium arsenide (1/2/2)', 'Calcium dipalladium arsenide', 'High pressure experimental phase']}",-25.39018387,-5.078036774,-0.7413167119999997,"['xas', 'elasticity', 'bandstructure']",True,"[36372, 188177, 188178, 604341, 190703]",True,2021-05-12 10:56:20.740000,NM,5,19,mp-5166,,Ca(AsPd)2,"{'functional': 'PBE', 'labels': ['Ca_sv', 'As', 'Pd'], 'pot_type': 'paw'}","{'Ca': 1.0, 'As': 2.0, 'Pd': 2.0}",GGA,mp-5166,"['mp-921828', 'mp-907401', 'mp-5166', 'mp-920791', 'mp-1069002', 'mp-1068876', 'mp-1068903', 'mp-1068928', 'mp-1068952', 'mp-1068961', 'mp-1070760', 'mp-1070741', 'mp-1070792', 'mp-1439743', 'mp-1797460', 'mp-1587438', 'mp-1068940', 'mp-1068989', 'mp-1070786']",9.5e-06,"{'Ca': 1.0, 'As': 2.0, 'Pd': 2.0}",97.6090925407754,[],NM,False,139,0,"[0, 0, 0, 0, 0]",9.7326998466167e-08,9.5e-06,0,9.5e-06,MP,data/source/MP/cleaned/cifs/MP-mp-5166.cif,False,,data/final/MP/graphs/As2Ca1Pd2-MP-mp-5166.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Bi4Cu4Sr4Tm2O17.14,2,0.0341682723185613,0.4666988914819137,False,Bi1.867Cu1.867Sr1.867Tm0.933O8,Bi2Cu2Sr2Tm1O8,0.0,Cuprate,True,Bi12.845Cu12.845Sr12.845Tm6.423O55.0417469492614,Bi-Cu-Sr-Tm-O,5,Supercon,Bi4Sr4Tm2Cu4O17.14,MP-mp-1208757,Sr2Tm1Cu2Bi2O8,Bi-Cu-Sr-Tm-O,Bi13.333Cu13.333Sr13.333Tm6.667O53.333333333333336,I 4/m m m,tetragonal,3.76273400015672,3.76273400015672,15.41639261,data/final/MP/cifs/Bi4Cu4Sr4Tm2O17.14-MP-mp-1208757-synth_doped.cif,data/source/MP/raw/cifs/mp-1208757.cif,mp-1208757,0.0,,2019-01-12 11:36:48.931000,7.856721433865473,,,{'GGA': {'task_id': 'mp-1737311'}},0.1196561682500165,5.37929453,520.0,-90.4160243,-6.027734953333334,"{'tags': ['Ba2CaCu2Tl2O8', 'high-Tc cuprate family', 'Sr2Cu2TmBi2O8']}",-90.4160243,-6.027734953333334,-2.1663354646666666,[],False,[],True,2021-05-12 11:00:21.818000,NM,15,4,mp-1208757,oxide,Sr2TmCu2(BiO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Tm_3', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Tm': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",GGA,mp-1208757,"['mp-1208757', 'mp-1388891', 'mp-1737311', 'mp-1833938']",0.0359539,"{'Sr': 2.0, 'Tm': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",214.99263189316628,[],NM,False,139,0,"[0.0, 0.0, 0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001672331729855,0.0359539,0,0.0359539,MP,data/source/MP/cleaned/cifs/MP-mp-1208757.cif,True,,data/final/MP/graphs/Bi4Cu4Sr4Tm2O17.14-MP-mp-1208757-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B4Er0.91Gd0.09Rh4,2,0.0199999999999999,2.0,False,B8Er1.82Gd0.18Rh8,B8Er2Rh8,6.87,Other,True,B44.444Er10.111Gd1Rh44.444,B-Er-Gd-Rh,4,Supercon,Er0.91Gd0.09Rh4B4,MP-mp-8408,Er2B8Rh8,B-Er-Rh,B44.444Er11.111Rh44.444,P 42/n m c,tetragonal,5.336304,5.336304,7.44528,data/final/MP/cifs/B4Er0.91Gd0.09Rh4-MP-mp-8408-synth_doped.cif,data/source/MP/raw/cifs/mp-8408.cif,mp-8408,0.0,,2011-06-07 02:27:50,9.745285939793032,10.17188/1308086,"@misc{osti_1308086,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Er(BRh)4 (SG:137) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1308086"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1673724'}},0.0133402750000009,6.84272912,520.0,-131.92031901,-7.328906611666666,{'tags': ['Erbium rhodium boride (1/4/4)']},-131.92031901,-7.328906611666666,-0.5797380146296286,"['xas', 'bandstructure']",True,"[613809, 601530, 49631]",True,2021-05-12 10:57:51.871000,NM,18,8,mp-8408,,Er(BRh)4,"{'functional': 'PBE', 'labels': ['Er_3', 'B', 'Rh_pv'], 'pot_type': 'paw'}","{'Er': 1.0, 'B': 4.0, 'Rh': 4.0}",GGA,mp-8408,"['mp-932384', 'mp-931412', 'mp-8408', 'mp-915879', 'mp-1434188', 'mp-1673724', 'mp-1785064', 'mp-1597242']",7.985e-05,"{'Er': 2.0, 'B': 8.0, 'Rh': 8.0}",212.01283845150363,[],NM,False,137,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",7.532562705467018e-07,7.985e-05,0,0.0001597,MP,data/source/MP/cleaned/cifs/MP-mp-8408.cif,True,,data/final/MP/graphs/B4Er0.91Gd0.09Rh4-MP-mp-8408-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Nb50Zr50,1,0.0,0.02,False,Nb1Zr1,Nb1Zr1,10.161,Other,True,Nb50Zr50,Nb-Zr,2,Supercon,Nb50Zr50,MP-mp-1215202,Zr1Nb1,Nb-Zr,Nb50Zr50,C m m m,orthorhombic,2.98504275,2.98504275,4.869488,data/final/MP/cifs/Nb50Zr50-MP-mp-1215202.cif,data/source/MP/raw/cifs/mp-1215202.cif,mp-1215202,0.0,,2019-01-12 16:55:57.224000,7.481256512512194,,,{'GGA': {'task_id': 'mp-1674632'}},0.1108282250000005,4.5080935,520.0,-18.42734922,-9.21367461,{'tags': []},-18.42734922,-9.21367461,0.1108282250000005,['bandstructure'],True,[],True,2021-05-12 10:58:39.488000,NM,2,5,mp-1215202,,ZrNb,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Nb_pv'], 'pot_type': 'paw'}","{'Zr': 1.0, 'Nb': 1.0}",GGA,mp-1215202,"['mp-1215202', 'mp-1425572', 'mp-1674632', 'mp-1795245', 'mp-1612009']",0.0037446,"{'Zr': 1.0, 'Nb': 1.0}",40.86956366574724,[],NM,False,65,0,"[0, 0]",9.162319496790583e-05,0.0037446,0,0.0037446,MP,data/source/MP/cleaned/cifs/MP-mp-1215202.cif,False,,data/final/MP/graphs/Nb50Zr50-MP-mp-1215202.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
C0.85Mg1Ni3,2,0.0494845360824742,1.0,True,C0.85Mg1Ni3,C1Mg1Ni3,0.0,Other,True,C17.526Mg20.619Ni61.856,C-Mg-Ni,3,Supercon,Mg1C0.85Ni3,MP-mp-10700,Mg1Ni3C1,C-Mg-Ni,C20Mg20Ni60,P m -3 m,cubic,3.810209,3.810209,3.810209,data/final/MP/cifs/C0.85Mg1Ni3-MP-mp-10700-synth_doped.cif,data/source/MP/raw/cifs/mp-10700.cif,mp-10700,0.0,,2011-05-28 10:04:44,6.376007671789427,10.17188/1187303,"@misc{osti_1187303,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MgNi3C (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187303"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678621'}},0.0,6.64260176,520.0,-28.85099542,-5.770199084,{'tags': ['Magnesium nickel carbide (1/3/1)']},-28.85099542,-5.770199084,-0.1367049259999994,"['xas', 'elasticity', 'bandstructure']",True,[77152],True,2021-05-12 10:56:10.715000,NM,5,8,mp-10700,,MgNi3C,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Ni_pv', 'C'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",GGA,mp-10700,"['mp-927245', 'mp-927653', 'mp-911184', 'mp-10700', 'mp-1438083', 'mp-1678621', 'mp-1791467', 'mp-1591421']",0.0387875,"{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",55.31544309398296,[],NM,False,221,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",0.0007012056277683,0.0387875,0,0.0387875,MP,data/source/MP/cleaned/cifs/MP-mp-10700.cif,True,,data/final/MP/graphs/C0.85Mg1Ni3-MP-mp-10700-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
P1Pd3,1,0.0,4.0,False,P4Pd12,P4Pd12,0.35,Other,True,P25Pd75,P-Pd,2,Supercon,P1Pd3,MP-mp-19879,P4Pd12,P-Pd,P25Pd75,P n m a,orthorhombic,5.262463,6.054275,7.552832,data/final/MP/cifs/P1Pd3-MP-mp-19879.cif,data/source/MP/raw/cifs/mp-19879.cif,mp-19879,0.0,,2014-02-22 15:53:01,9.667319545308365,10.17188/1195068,"@misc{osti_1195068,
    author = ""Persson, Kristin"",
    title = ""Materials Data on PPd3 (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195068"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1705413'}},0.0,6.34212531,520.0,-91.47948279,-5.717467674375,"{'tags': ['Palladium(III) phosphide', 'Palladium phosphide (3/1)']}",-91.47948279,-5.717467674375,-0.4792306902083334,"['xas', 'bandstructure']",True,"[647918, 85525, 647921]",True,2021-05-12 10:56:57.051000,NM,16,8,mp-19879,,PPd3,"{'functional': 'PBE', 'labels': ['P', 'Pd'], 'pot_type': 'paw'}","{'P': 1.0, 'Pd': 3.0}",GGA,mp-19879,"['mp-924299', 'mp-909337', 'mp-925077', 'mp-19879', 'mp-1429459', 'mp-1705413', 'mp-1777981', 'mp-1604534']",0.000546625,"{'P': 4.0, 'Pd': 12.0}",240.6362349015476,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",9.086329001509564e-06,0.000546625,0,0.0021865,MP,data/source/MP/cleaned/cifs/MP-mp-19879.cif,False,,data/final/MP/graphs/P1Pd3-MP-mp-19879.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
B12Er1,1,0.0,1.0,True,B12Er1,B12Er1,0.0,Other,True,B92.308Er7.692,B-Er,2,Supercon,B12Er1,MP-mp-1104598,Er1B12,B-Er,B92.308Er7.692,F m -3 m,cubic,5.28895649,5.28895649,5.28895649,data/final/MP/cifs/B12Er1-MP-mp-1104598.cif,data/source/MP/raw/cifs/mp-1104598.cif,mp-1104598,0.0,,2018-07-18 22:28:59,4.714084912176248,,,{'GGA': {'task_id': 'mp-1695136'}},0.0,6.10586922,520.0,-87.99031872,-6.768486055384615,"{'tags': ['UB12', 'ErB12 rt', 'Erbium boride (1/12)']}",-87.99031872,-6.768486055384615,-0.2515306661538458,['bandstructure'],True,[613695],True,2021-05-12 10:58:20.361000,NM,13,5,mp-1104598,,ErB12,"{'functional': 'PBE', 'labels': ['Er_3', 'B'], 'pot_type': 'paw'}","{'Er': 1.0, 'B': 12.0}",GGA,mp-1104598,"['mp-1104598', 'mp-1422951', 'mp-1695136', 'mp-1798072', 'mp-1599447']",0.0009498,"{'Er': 1.0, 'B': 12.0}",104.61524709806972,[],NM,False,225,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",9.078982522591823e-06,0.0009498,0,0.0009498,MP,data/source/MP/cleaned/cifs/MP-mp-1104598.cif,False,,data/final/MP/graphs/B12Er1-MP-mp-1104598.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Au1Sc1,1,0.0,1.0,True,Au1Sc1,Au1Sc1,2.0,Other,True,Au50Sc50,Au-Sc,2,Supercon,Au1Sc1,MP-mp-11256,Sc1Au1,Au-Sc,Au50Sc50,P m -3 m,cubic,3.413582,3.413582,3.413582,data/final/MP/cifs/Au1Sc1-MP-mp-11256.cif,data/source/MP/raw/cifs/mp-11256.cif,mp-11256,0.0,,2011-05-27 18:24:02,10.099370522562088,10.17188/1187679,"@misc{osti_1187679,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ScAu (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187679"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1673021'}},0.0,5.25070166,520.0,-11.22255138,-5.61127569,{'tags': ['Gold scandium (1/1)']},-11.22255138,-5.61127569,-0.8081003674999998,"['xas', 'elasticity', 'bandstructure']",True,[58582],True,2021-05-12 10:56:10.715000,NM,2,8,mp-11256,,ScAu,"{'functional': 'PBE', 'labels': ['Sc_sv', 'Au'], 'pot_type': 'paw'}","{'Sc': 1.0, 'Au': 1.0}",GGA,mp-11256,"['mp-11256', 'mp-912086', 'mp-928117', 'mp-928689', 'mp-1439171', 'mp-1673021', 'mp-1791031', 'mp-1594251']",0.0032755,"{'Sc': 1.0, 'Au': 1.0}",39.77690786686617,[],NM,False,221,0,"[0, 0]",8.234677293074519e-05,0.0032755,0,0.0032755,MP,data/source/MP/cleaned/cifs/MP-mp-11256.cif,False,,data/final/MP/graphs/Au1Sc1-MP-mp-11256.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Fe3Lu0.032Si5Y1.968,2,0.0064,4.0,False,Fe12Lu0.128Si20Y7.872,Fe12Si20Y8,2.9,Other,True,Fe30Lu0.32Si50Y19.68,Fe-Lu-Si-Y,4,Supercon,Y1.968Lu0.032Fe3Si5,MP-mp-1197725,Y8Fe12Si20,Fe-Si-Y,Fe30Si50Y20,P 4/m n c,tetragonal,5.486546,10.359463,10.359463,data/final/MP/cifs/Fe3Lu0.032Si5Y1.968-MP-mp-1197725-synth_doped.cif,data/source/MP/raw/cifs/mp-1197725.cif,mp-1197725,0.0,,2019-01-12 02:38:49.774000,5.479867051108368,,,{'GGA': {'task_id': 'mp-1738464'}},0.0,7.45858883,520.0,-289.57873526,-7.239468381499999,"{'tags': ['Y2Fe3Si5', 'Yttrium iron silicide (2/3/5)', 'U2Mn3Si5', 'Iron yttrium silicide (3/2/5)']}",-289.57873526,-7.239468381499999,-0.6570146138333314,[],False,"[633645, 633646, 633652, 247833]",True,2021-05-12 11:00:01.375000,NM,40,7,mp-1197725,,Y2Fe3Si5,"{'functional': 'PBE', 'labels': ['Y_sv', 'Fe_pv', 'Si'], 'pot_type': 'paw'}","{'Y': 2.0, 'Fe': 3.0, 'Si': 5.0}",GGA,mp-1197725,"['mp-1197725', 'mp-1201181', 'mp-1201341', 'mp-1202886', 'mp-1392993', 'mp-1738464', 'mp-1890166']",6.6625e-05,"{'Y': 8.0, 'Fe': 12.0, 'Si': 20.0}",588.8077423215643,[],NM,False,128,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.5260953762129193e-07,6.6625e-05,0,0.0002665,MP,data/source/MP/cleaned/cifs/MP-mp-1197725.cif,True,,data/final/MP/graphs/Fe3Lu0.032Si5Y1.968-MP-mp-1197725-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
C1Mo0.4Ta0.6,3,0.0999999999999999,2.0,False,C2Mo0.8Ta1.2,C2Mo1Ta1,8.67,Other,True,C50Mo20Ta30,C-Mo-Ta,3,Supercon,Ta0.6Mo0.4C1,MP-mp-1217919,Ta1Mo1C2,C-Mo-Ta,C50Mo25Ta25,R -3 m,trigonal,3.144835892169353,3.144835892169353,5.38817367,data/final/MP/cifs/C1Mo0.4Ta0.6-MP-mp-1217919-synth_doped.cif,data/source/MP/raw/cifs/mp-1217919.cif,mp-1217919,0.0,,2019-01-12 19:10:31.332000,11.499783499146304,,,{'GGA': {'task_id': 'mp-1766664'}},0.1494032275000005,9.116434,520.0,-41.88168601,-10.4704215025,{'tags': []},-41.88168601,-10.4704215025,-0.1811759874999996,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,4,5,mp-1217919,,TaMoC2,"{'functional': 'PBE', 'labels': ['Ta_pv', 'Mo_pv', 'C'], 'pot_type': 'paw'}","{'Ta': 1.0, 'Mo': 1.0, 'C': 2.0}",GGA,mp-1217919,"['mp-1217919', 'mp-1430516', 'mp-1766664', 'mp-1794431', 'mp-1610780']",0.0004872,"{'Ta': 1.0, 'Mo': 1.0, 'C': 2.0}",43.45052365373413,[],NM,False,166,0,"[0, 0, 0, 0]",1.1212753242805398e-05,0.0004872,0,0.0004872,MP,data/source/MP/cleaned/cifs/MP-mp-1217919.cif,True,,data/final/MP/graphs/C1Mo0.4Ta0.6-MP-mp-1217919-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Mg2Zn3,3,0.1333333333333333,1.0,True,Mg2Zn3,Mg2Zn4,0.76,Other,True,Mg40Zn60,Mg-Zn,2,Supercon,Mg2Zn3,MP-mp-978269,Mg2Zn4,Mg-Zn,Mg33.333Zn66.667,F d -3 m,cubic,5.2341642,5.2341642,5.2341642,data/final/MP/cifs/Mg2Zn3-MP-mp-978269-synth_doped.cif,data/source/MP/raw/cifs/mp-978269.cif,mp-978269,0.0,,2015-08-14 13:47:41,5.080755055416815,10.17188/1315884,"@misc{osti_1315884,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MgZn2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1315884"",
    place = ""United States"",
    year = ""2016"",
    month = ""9"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1005674'}},0.0,3.64761989,520.0,-9.03812273,-1.506353788333333,{'tags': []},-9.03812273,-1.506353788333333,-0.1330980316666667,"['xas', 'elasticity', 'bandstructure']",True,[],True,2021-05-12 10:56:37.246000,NM,6,7,mp-978269,,MgZn2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Zn'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Zn': 2.0}",GGA,mp-978269,"['mp-978269', 'mp-1005651', 'mp-978588', 'mp-1005674', 'mp-1387791', 'mp-1783490', 'mp-1010977']",9.59e-05,"{'Mg': 2.0, 'Zn': 4.0}",101.39744932342929,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",1.891566319269157e-06,9.59e-05,0,0.0001918,MP,data/source/MP/cleaned/cifs/MP-mp-978269.cif,True,,data/final/MP/graphs/Mg2Zn3-MP-mp-978269-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
As2Ba0.49Co0.21Fe1.79K0.51,3,0.088,2.0,False,As4Ba0.98Co0.42Fe3.58K1.02,As4Ba1Fe4K1,15.0,Ferrite,True,As40Ba9.8Co4.2Fe35.8K10.2,As-Ba-Co-Fe-K,5,Supercon,Ba0.49K0.51Fe1.79Co0.21As2,MP-mp-1223517,K1Ba1Fe4As4,As-Ba-Fe-K,As40Ba10Fe40K10,C m m m,orthorhombic,5.479027,5.480024002658328,7.13170472,data/final/MP/cifs/As2Ba0.49Co0.21Fe1.79K0.51-MP-mp-1223517-synth_doped.cif,data/source/MP/raw/cifs/mp-1223517.cif,mp-1223517,0.0,,2019-01-12 23:54:03.876000,5.87534599912672,,,{'GGA': {'task_id': 'mp-1743010'}},0.0132513644999994,4.21185628,520.0,-59.66633886,-5.966633886,{'tags': []},-59.66633886,-5.966633886,-0.4120461663000007,[],False,[],True,2021-05-12 11:00:52.054000,FM,10,4,mp-1223517,,KBa(FeAs)4,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",GGA,mp-1223517,"['mp-1223517', 'mp-1396881', 'mp-1743010', 'mp-1827585']",0.9947188,"{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",197.6961518155852,[],FM,True,65,1,"[0.0, 0.0, 0.3, 0.3, 0.3, 0.3, 0.0, 0.0, 0.0, 0.0]",0.0050315536790412,0.9947188,4,0.9947188,MP,data/source/MP/cleaned/cifs/MP-mp-1223517.cif,True,,data/final/MP/graphs/As2Ba0.49Co0.21Fe1.79K0.51-MP-mp-1223517-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Pd0.49Sb0.51,2,0.02,4.0,False,Pd1.96Sb2.04,Pd2Sb2,1.44,Other,True,Pd49Sb51,Pd-Sb,2,Supercon,Pd0.49Sb0.51,MP-mp-1769,Sb2Pd2,Pd-Sb,Pd50Sb50,P 63/m m c,hexagonal,4.14379200150878,4.14379188,5.681682,data/final/MP/cifs/Pd0.49Sb0.51-MP-mp-1769-synth_doped.cif,data/source/MP/raw/cifs/mp-1769.cif,mp-1769,0.0,,2011-05-12 20:23:42,8.969190247481327,10.17188/1192632,"@misc{osti_1192632,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SbPd (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1192632"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672236'}},0.0,7.23050119,520.0,-20.38401466,-5.096003665,"{'tags': ['Palladium antimony (1/1)', 'Sudburyite', 'Palladium antimony', 'Palladium antimonide (1/1)']}",-20.38401466,-5.096003665,-0.5375621399999995,"['xas', 'elasticity', 'bandstructure']",True,"[648770, 42598, 648779, 42597]",True,2021-05-12 10:56:14.760000,NM,4,8,mp-1769,,SbPd,"{'functional': 'PBE', 'labels': ['Sb', 'Pd'], 'pot_type': 'paw'}","{'Sb': 1.0, 'Pd': 1.0}",GGA,mp-1769,"['mp-924880', 'mp-925511', 'mp-909858', 'mp-1769', 'mp-1439686', 'mp-1672236', 'mp-1802229', 'mp-1586197']",0.0044707,"{'Sb': 2.0, 'Pd': 2.0}",84.4896347968957,[],NM,False,194,0,"[0, 0, 0, 0]",0.0001058283660651,0.0044707,0,0.0089414,MP,data/source/MP/cleaned/cifs/MP-mp-1769.cif,True,,data/final/MP/graphs/Pd0.49Sb0.51-MP-mp-1769-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
P1W1,1,0.0,4.0,False,P4W4,P4W4,0.0,Other,True,P50W50,P-W,2,Supercon,P1W1,MP-mp-2420,P4W4,P-W,P50W50,P n m a,orthorhombic,3.266293,5.757727,6.26923,data/final/MP/cifs/P1W1-MP-mp-2420.cif,data/source/MP/raw/cifs/mp-2420.cif,mp-2420,0.0,,2011-05-13 13:51:34,12.10182245775949,10.17188/1199972,"@misc{osti_1199972,
    author = ""Persson, Kristin"",
    title = ""Materials Data on PW (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199972"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699805'}},0.0,9.03958513,520.0,-76.43774077,-9.55471759625,"{'tags': ['Tungsten phosphide (1/1)', 'Tungsten(III) phosphide']}",-76.43774077,-9.55471759625,-0.3690031079166669,"['xas', 'elasticity', 'bandstructure']",True,"[648280, 42056, 648284, 648279, 76029]",True,2021-05-12 10:56:16.728000,NM,8,9,mp-2420,,PW,"{'functional': 'PBE', 'labels': ['P', 'W_pv'], 'pot_type': 'paw'}","{'P': 1.0, 'W': 1.0}",GGA,mp-2420,"['mp-925676', 'mp-910198', 'mp-926084', 'mp-2420', 'mp-570264', 'mp-1428634', 'mp-1699805', 'mp-1788131', 'mp-1594919']",0.00133935,"{'P': 4.0, 'W': 4.0}",117.90179374697406,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0]",4.5439512239291074e-05,0.00133935,0,0.0053574,MP,data/source/MP/cleaned/cifs/MP-mp-2420.cif,False,,data/final/MP/graphs/P1W1-MP-mp-2420.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ce1In5Ir0.7Rh0.3,3,0.0857142857142857,1.0,True,Ce1In5Ir0.7Rh0.3,Ce1In5Ir1,1.2,Heavy_fermion,True,Ce14.286In71.429Ir10Rh4.286,Ce-In-Ir-Rh,4,Supercon,Ce1Rh0.3Ir0.7In5,MP-mp-20975,Ce1In5Ir1,Ce-In-Ir,Ce14.286In71.429Ir14.286,P 4/m m m,tetragonal,4.724199,4.724199,7.575801,data/final/MP/cifs/Ce1In5Ir0.7Rh0.3-MP-mp-20975-synth_doped.cif,data/source/MP/raw/cifs/mp-20975.cif,mp-20975,0.0,,2014-02-21 16:15:16,8.902153726103897,10.17188/1196209,"@misc{osti_1196209,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeIn5Ir (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196209"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688300'}},0.0,8.1498488,520.0,-31.20695684,-4.458136691428572,{'tags': ['Cerium iridium indide (1/1/5)']},-31.20695684,-4.458136691428572,-0.3824312307142854,"['xas', 'bandstructure']",True,[150225],True,2021-05-12 10:56:57.051000,FM,7,8,mp-20975,,CeIn5Ir,"{'functional': 'PBE', 'labels': ['Ce', 'In_d', 'Ir'], 'pot_type': 'paw'}","{'Ce': 1.0, 'In': 5.0, 'Ir': 1.0}",GGA,mp-20975,"['mp-919528', 'mp-918523', 'mp-905302', 'mp-20975', 'mp-1300982', 'mp-1688300', 'mp-1832383', 'mp-1591628']",0.1040192,"{'Ce': 1.0, 'In': 5.0, 'Ir': 1.0}",169.077152414387,[],FM,True,123,1,"[0.1, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0006152173638757,0.1040192,1,0.1040192,MP,data/source/MP/cleaned/cifs/MP-mp-20975.cif,True,,data/final/MP/graphs/Ce1In5Ir0.7Rh0.3-MP-mp-20975-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Nb1Re1Si1,1,0.0,6.0,False,Nb6Re6Si6,Nb6Re6Si6,5.1,Other,True,Nb33.333Re33.333Si33.333,Nb-Re-Si,3,Supercon,Nb1Re1Si1,MP-mp-1189470,Nb6Re6Si6,Nb-Re-Si,Nb33.333Re33.333Si33.333,I m a 2,orthorhombic,6.735741996979376,7.581201380204923,7.038065996772739,data/final/MP/cifs/Nb1Re1Si1-MP-mp-1189470.cif,data/source/MP/raw/cifs/mp-1189470.cif,mp-1189470,0.0,,2019-01-11 20:13:09.067000,11.113585052482694,,,{'GGA': {'task_id': 'mp-1676255'}},0.0,7.85735133,520.0,-177.0514251,-9.836190283333332,{'tags': ['Niobium rhenium silicide (1/1/1)']},-177.0514251,-9.836190283333332,-0.4888082016666668,['bandstructure'],True,[600059],True,2021-05-12 10:58:33.577000,NM,18,4,mp-1189470,,NbReSi,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Re_pv', 'Si'], 'pot_type': 'paw'}","{'Nb': 1.0, 'Re': 1.0, 'Si': 1.0}",GGA,mp-1189470,"['mp-1189470', 'mp-1381445', 'mp-1676255', 'mp-1604228']",2.8166666666666667e-06,"{'Nb': 6.0, 'Re': 6.0, 'Si': 6.0}",275.4011810123193,[],NM,False,46,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.136502370062105e-08,2.8166666666666667e-06,0,1.69e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1189470.cif,False,,data/final/MP/graphs/Nb1Re1Si1-MP-mp-1189470.json,0,True,mm2,0,0,0,6,0,0,0,0,0,1,0,1.0,False
Sn3Yb1,1,0.0,1.0,True,Sn3Yb1,Sn3Yb1,3.6,Heavy_fermion,True,Sn75Yb25,Sn-Yb,2,Supercon,Sn3Yb1,MP-mp-2751,Yb1Sn3,Sn-Yb,Sn75Yb25,P m -3 m,cubic,4.730959,4.730959,4.730959,data/final/MP/cifs/Sn3Yb1-MP-mp-2751.cif,data/source/MP/raw/cifs/mp-2751.cif,mp-2751,0.0,,2011-05-13 03:08:03,8.29844575436073,10.17188/1201726,"@misc{osti_1201726,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YbSn3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201726"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677707'}},0.0,7.11641592,520.0,-15.40472965,-3.8511824125,{'tags': ['Tin ytterbium (3/1)']},-15.40472965,-3.8511824125,-0.4591014512500004,"['xas', 'bandstructure']",True,"[652844, 652843, 106106]",True,2021-05-12 10:57:03.017000,NM,4,8,mp-2751,,YbSn3,"{'functional': 'PBE', 'labels': ['Yb_2', 'Sn_d'], 'pot_type': 'paw'}","{'Yb': 1.0, 'Sn': 3.0}",GGA,mp-2751,"['mp-913804', 'mp-930583', 'mp-930959', 'mp-2751', 'mp-1438717', 'mp-1677707', 'mp-1797771', 'mp-1588565']",0.0001377,"{'Yb': 1.0, 'Sn': 3.0}",105.88819688445538,[],NM,False,221,0,"[0, 0, 0, 0]",1.3004282257281e-06,0.0001377,0,0.0001377,MP,data/source/MP/cleaned/cifs/MP-mp-2751.cif,False,,data/final/MP/graphs/Sn3Yb1-MP-mp-2751.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Cr0.78Ir0.22,3,0.06,8.0,False,Cr6.24Ir1.76,Cr6Ir2,0.0,Other,True,Cr78Ir22,Cr-Ir,2,Supercon,Cr0.78Ir0.22,MP-mp-1609,Cr6Ir2,Cr-Ir,Cr75Ir25,P m -3 n,cubic,4.649853,4.649853,4.649853,data/final/MP/cifs/Cr0.78Ir0.22-MP-mp-1609-synth_doped.cif,data/source/MP/raw/cifs/mp-1609.cif,mp-1609,0.0,,2011-05-14 06:37:35,11.502620729111474,10.17188/1191557,"@misc{osti_1191557,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Cr3Ir (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191557"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700096'}},0.0183214725000002,7.78335882,520.0,-76.09006936,-9.51125867,{'tags': ['Chromium iridium (3/1)']},-76.09006936,-9.51125867,-0.0618654625000001,"['xas', 'elasticity', 'bandstructure']",True,"[102780, 102779]",True,2021-05-12 10:56:12.755000,NM,8,8,mp-1609,,Cr3Ir,"{'functional': 'PBE', 'labels': ['Cr_pv', 'Ir'], 'pot_type': 'paw'}","{'Cr': 3.0, 'Ir': 1.0}",GGA,mp-1609,"['mp-912358', 'mp-928869', 'mp-928340', 'mp-1609', 'mp-1414364', 'mp-1700096', 'mp-1797142', 'mp-1590447']",0.005854,"{'Cr': 6.0, 'Ir': 2.0}",100.5350897789424,[],NM,False,223,0,"[-0.0, -0.0, -0.0, -0.0, -0.0, -0.0, 0.0, 0.0]",0.0001164568512918,0.005854,0,0.011708,MP,data/source/MP/cleaned/cifs/MP-mp-1609.cif,True,,data/final/MP/graphs/Cr0.78Ir0.22-MP-mp-1609-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Au0.5Pb2Pd0.5,1,0.0,2.0,False,Au1Pb4Pd1,Au1Pb4Pd1,3.02,Other,True,Au16.667Pb66.667Pd16.667,Au-Pb-Pd,3,Supercon,Pd0.5Au0.5Pb2,MP-mp-1219939,Pd1Pb4Au1,Au-Pb-Pd,Au16.667Pb66.667Pd16.667,I 4 2 2,tetragonal,5.827289995704654,5.882042670568449,5.88204267,data/final/MP/cifs/Au0.5Pb2Pd0.5-MP-mp-1219939.cif,data/source/MP/raw/cifs/mp-1219939.cif,mp-1219939,0.0,,2019-01-12 20:51:56.739000,12.3568729692114,,,{'GGA': {'task_id': 'mp-1754973'}},0.0107330600000006,6.90520974,520.0,-24.09747627,-4.016246045,{'tags': []},-24.09747627,-4.016246045,-0.1321874399999997,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,6,5,mp-1219939,,PdPb4Au,"{'functional': 'PBE', 'labels': ['Pd', 'Pb_d', 'Au'], 'pot_type': 'paw'}","{'Pd': 1.0, 'Pb': 4.0, 'Au': 1.0}",GGA,mp-1219939,"['mp-1219939', 'mp-1397452', 'mp-1754973', 'mp-1927706', 'mp-1625607']",0.0001578,"{'Pd': 1.0, 'Pb': 4.0, 'Au': 1.0}",152.14529057542765,[],NM,False,97,0,"[0, 0, 0, 0, 0, 0]",1.037166509743323e-06,0.0001578,0,0.0001578,MP,data/source/MP/cleaned/cifs/MP-mp-1219939.cif,False,,data/final/MP/graphs/Au0.5Pb2Pd0.5-MP-mp-1219939.json,0,True,422,0,0,0,0,4,0,0,0,0,1,0,1.0,False
Cr1N1,1,0.0,1.0,True,Cr1N1,Cr1N1,0.0,Other,True,Cr50N50,Cr-N,2,Supercon,Cr1N1,MP-mp-1183691,Cr1N1,Cr-N,Cr50N50,P -6 m 2,hexagonal,2.600186,2.682674002170398,2.68267328,data/final/MP/cifs/Cr1N1-MP-mp-1183691.cif,data/source/MP/raw/cifs/mp-1183691.cif,mp-1183691,0.0,,2019-01-11 12:12:53.514000,6.763021459578051,,,{'GGA': {'task_id': 'mp-1675624'}},0.0,9.1801754,520.0,-19.01161583,-9.505807915,{'tags': []},-19.01161583,-9.505807915,-0.6915367175,['bandstructure'],True,[],True,2021-05-12 10:58:25.879000,FM,2,5,mp-1183691,,CrN,"{'functional': 'PBE', 'labels': ['Cr_pv', 'N'], 'pot_type': 'paw'}","{'Cr': 1.0, 'N': 1.0}",GGA,mp-1183691,"['mp-1183691', 'mp-1432586', 'mp-1675624', 'mp-1792714', 'mp-1609818']",0.070937,"{'Cr': 1.0, 'N': 1.0}",16.20580809332882,[],FM,True,187,1,"[0.1, 0.0]",0.004377257807292,0.070937,1,0.070937,MP,data/source/MP/cleaned/cifs/MP-mp-1183691.cif,False,,data/final/MP/graphs/Cr1N1-MP-mp-1183691.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
V2Zr1,1,0.0,4.0,False,V8Zr4,V8Zr4,8.9933333335,Other,True,V66.667Zr33.333,V-Zr,2,Supercon,V2Zr1,MP-mp-1103264,Zr4V8,V-Zr,V66.667Zr33.333,P 63/m m c,hexagonal,5.208193229598517,5.20819373,8.45714,data/final/MP/cifs/V2Zr1-MP-mp-1103264.cif,data/source/MP/raw/cifs/mp-1103264.cif,mp-1103264,0.0,,2018-07-18 17:51:18,6.456226553557358,,,,0.0325666608333339,4.94123829,520.0,-106.47125115,-8.8726042625,{'tags': ['Vanadium zirconium (2/1)']},-106.47125115,-8.8726042625,0.0325666608333321,[],False,[653414],True,2021-05-12 10:59:31.014000,FM,12,3,mp-1103264,,ZrV2,"{'functional': 'PBE', 'labels': ['Zr_sv', 'V_pv'], 'pot_type': 'paw'}","{'Zr': 1.0, 'V': 2.0}",GGA,mp-1103264,"['mp-1103264', 'mp-1834547', 'mp-1986833']",0.158094725,"{'Zr': 4.0, 'V': 8.0}",198.6681941061952,[],FM,True,194,2,"[0.0, 0.0, 0.0, 0.0, -0.0, -0.0, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1]",0.0031830907954092,0.158094725,6,0.6323789,MP,data/source/MP/cleaned/cifs/MP-mp-1103264.cif,False,,data/final/MP/graphs/V2Zr1-MP-mp-1103264.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Fe3Th7,1,0.0,2.0,False,Fe6Th14,Fe6Th14,2.016666667,Other,True,Fe30Th70,Fe-Th,2,Supercon,Fe3Th7,MP-mp-18014,Th14Fe6,Fe-Th,Fe30Th70,P 63 m c,hexagonal,6.234076,9.683305999754582,9.68330601,data/final/MP/cifs/Fe3Th7-MP-mp-18014.cif,data/source/MP/raw/cifs/mp-18014.cif,mp-18014,0.0,,2014-02-14 16:55:03,11.754899828709185,10.17188/1192834,"@misc{osti_1192834,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Th7Fe3 (SG:186) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1192834"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678033'}},0.0,7.5102509,520.0,-157.08270675,-7.8541353375,"{'tags': ['Iron thorium (3/7)', 'Thorium iron (7/3)']}",-157.08270675,-7.8541353375,-0.1234320275000001,"['xas', 'bandstructure']",True,"[108477, 633922, 633893, 633907, 633908, 633897, 107715]",True,2021-05-12 10:56:55.092000,NM,20,13,mp-18014,,Th7Fe3,"{'functional': 'PBE', 'labels': ['Th', 'Fe_pv'], 'pot_type': 'paw'}","{'Th': 7.0, 'Fe': 3.0}",GGA,mp-18014,"['mp-914281', 'mp-977816', 'mp-18014', 'mp-1189462', 'mp-1189535', 'mp-1189537', 'mp-1190269', 'mp-1190276', 'mp-1115918', 'mp-1381452', 'mp-1678033', 'mp-1932661', 'mp-1637800']",0.0023926,"{'Th': 14.0, 'Fe': 6.0}",506.2325159475359,[],NM,False,8,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, 0.0, -0.0, -0.0, -0.0, -0.0]",9.452573371434562e-06,0.0023926,0,0.0047852,MP,data/source/MP/cleaned/cifs/MP-mp-18014.cif,False,,data/final/MP/graphs/Fe3Th7-MP-mp-18014.json,0,True,6mm,0,5,0,0,0,0,0,1,0,0,0,1.0,False
Ce1Co1.8Ru0.2,3,0.1333333333333333,2.0,False,Ce2Co3.6Ru0.4,Ce2Co4,0.35,Heavy_fermion,True,Ce33.333Co60Ru6.667,Ce-Co-Ru,3,Supercon,Ce1Ru0.2Co1.8,MP-mp-1112,Ce2Co4,Ce-Co,Ce33.333Co66.667,F d -3 m,cubic,4.99867784,4.99867784,4.99867784,data/final/MP/cifs/Ce1Co1.8Ru0.2-MP-mp-1112-synth_doped.cif,data/source/MP/raw/cifs/mp-1112.cif,mp-1112,0.0,,2011-05-13 09:02:17,9.701049230746174,10.17188/1187580,"@misc{osti_1187580,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeCo2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187580"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686856'}},0.0,8.26937171,520.0,-41.81273492,-6.968789153333333,{'tags': ['Cerium cobalt (1/2)']},-41.81273492,-6.968789153333333,-0.2522142383333327,"['xas', 'bandstructure']",True,"[102094, 620652, 620671, 657905, 108239, 620681, 620677, 620694, 620679, 620691, 620644, 656107, 620672, 620661, 620654]",True,2021-05-12 10:56:51.169000,NM,6,9,mp-1112,,CeCo2,"{'functional': 'PBE', 'labels': ['Ce', 'Co'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Co': 2.0}",GGA,mp-1112,"['mp-930540', 'mp-929975', 'mp-913634', 'mp-1112', 'mp-1440572', 'mp-1686856', 'mp-1801907', 'mp-1593275', 'mp-1596792']",0.0056005,"{'Ce': 2.0, 'Co': 4.0}",88.31824824311025,[],NM,False,227,0,"[0.0, 0.0, -0.0, -0.0, -0.0, -0.0]",0.0001268254321481,0.0056005,0,0.011201,MP,data/source/MP/cleaned/cifs/MP-mp-1112.cif,True,,data/final/MP/graphs/Ce1Co1.8Ru0.2-MP-mp-1112-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ga1V1.95,3,0.0720338983050847,5.128102564102564,False,Ga5.128V10,Ga6V10,5.3,Other,True,Ga33.898V66.102,Ga-V,2,Supercon,Ga1V1.95,MP-mp-1190304,V10Ga6,Ga-V,Ga37.5V62.5,P 63/m c m,hexagonal,4.904587,7.351338969453604,7.351338469999999,data/final/MP/cifs/Ga1V1.95-MP-mp-1190304-synth_doped.cif,data/source/MP/raw/cifs/mp-1190304.cif,mp-1190304,0.0,,2019-01-11 20:50:49.189000,6.711436911592945,,,,0.0827806190972157,5.25423597,520.0,-110.8500597,-6.92812873125,"{'tags': ['V5Ga3 stab', 'Vanadium gallide (5/3)', 'Mn5Si3']}",-110.8500597,-6.92812873125,-0.1151514290625002,[],False,"[635640, 635612]",True,2021-05-12 10:59:54.607000,FM,16,3,mp-1190304,,V5Ga3,"{'functional': 'PBE', 'labels': ['V_pv', 'Ga_d'], 'pot_type': 'paw'}","{'V': 5.0, 'Ga': 3.0}",GGA,mp-1190304,"['mp-1190304', 'mp-1866115', 'mp-1987173']",1.37646625,"{'V': 10.0, 'Ga': 6.0}",229.5440039068621,[],FM,True,193,2,"[-0.0, -0.0, -0.0, -0.0, 0.4, 0.4, 0.4, 0.4, 0.4, 0.4, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0119930490587635,1.37646625,6,2.7529325,MP,data/source/MP/cleaned/cifs/MP-mp-1190304.cif,True,,data/final/MP/graphs/Ga1V1.95-MP-mp-1190304-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Nb1O2,1,0.0,8.0,False,Nb8O16,Nb8O16,0.0,Oxide,True,Nb33.333O66.66666666666667,Nb-O,2,Supercon,Nb1O2,MP-mp-557057,Nb8O16,Nb-O,Nb33.333O66.66666666666667,I 41/a,tetragonal,6.088311997562822,7.568921411516535,7.56892141,data/final/MP/cifs/Nb1O2-MP-mp-557057.cif,data/source/MP/raw/cifs/mp-557057.cif,mp-557057,0.2999,,2014-02-22 17:00:09,5.67525308908265,10.17188/1269678,"@misc{osti_1269678,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbO2 (SG:88) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1269678"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1670678'}},0.0,4.2114634,520.0,-218.52889306,-9.105370544166666,{'tags': []},-218.52889306,-9.105370544166666,-2.8976281941666664,"['xas', 'elasticity', 'bandstructure']",True,[],True,2021-05-12 10:56:22.739000,NM,24,9,mp-557057,oxide,NbO2,"{'functional': 'PBE', 'labels': ['Nb_pv', 'O'], 'pot_type': 'paw'}","{'Nb': 1.0, 'O': 2.0}",GGA,mp-557057,"['mp-921811', 'mp-920780', 'mp-907346', 'mp-557057', 'mp-1180086', 'mp-1435923', 'mp-1670678', 'mp-1812702', 'mp-1606128']",8.95375e-05,"{'Nb': 8.0, 'O': 16.0}",292.3710047887655,[],NM,False,88,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.449969348080594e-06,8.95375e-05,0,0.0007163,MP,data/source/MP/cleaned/cifs/MP-mp-557057.cif,False,,data/final/MP/graphs/Nb1O2-MP-mp-557057.json,0,True,4/m,0,0,0,0,3,0,0,0,0,1,0,1.0,False
B2C1Cu0.15Ni1.85Y1,2,0.0499999999999999,1.0,True,B2C1Cu0.15Ni1.85Y1,B2C1Ni2Y1,13.0,Other,True,B33.333C16.667Cu2.5Ni30.833Y16.667,B-C-Cu-Ni-Y,5,Supercon,Y1Ni1.85Cu0.15B2C1,MP-mp-6576,Y1Ni2B2C1,B-C-Ni-Y,B33.333C16.667Ni33.333Y16.667,I 4/m m m,tetragonal,3.548790000501972,3.548790000501972,5.76144136,data/final/MP/cifs/B2C1Cu0.15Ni1.85Y1-MP-mp-6576-synth_doped.cif,data/source/MP/raw/cifs/mp-6576.cif,mp-6576,0.0,,2011-05-13 05:21:43,6.099730998852292,10.17188/1281366,"@misc{osti_1281366,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281366"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688230'}},0.0,6.81083016,520.0,-43.677878,-7.279646333333333,{'tags': []},-43.677878,-7.279646333333333,-0.5109282141666659,"['xas', 'bandstructure']",True,"[75816, 89142, 83231, 79574, 41549]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6576,,YNi2B2C,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6576,"['mp-6576', 'mp-1007054', 'mp-1000583', 'mp-1439516', 'mp-1688230', 'mp-1794280', 'mp-1011792', 'mp-1597064']",0.0006603,"{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.3152437079014,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",1.010943177297096e-05,0.0006603,0,0.0006603,MP,data/source/MP/cleaned/cifs/MP-mp-6576.cif,True,,data/final/MP/graphs/B2C1Cu0.15Ni1.85Y1-MP-mp-6576-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Fe2Ge2Nd1,1,0.0,1.0,True,Fe2Ge2Nd1,Fe2Ge2Nd1,0.0,Other,True,Fe40Ge40Nd20,Fe-Ge-Nd,3,Supercon,Nd1Fe2Ge2,MP-mp-20785,Nd1Fe2Ge2,Fe-Ge-Nd,Fe40Ge40Nd20,I 4/m m m,tetragonal,4.0328640025968845,4.0328640025968845,6.09589206,data/final/MP/cifs/Fe2Ge2Nd1-MP-mp-20785.cif,data/source/MP/raw/cifs/mp-20785.cif,mp-20785,0.0,,2014-02-21 12:10:03,7.603053031718357,10.17188/1195975,"@misc{osti_1195975,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nd(FeGe)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195975"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668267'}},0.0,4.62339323,520.0,-33.13236646,-6.626473292,"{'tags': ['Iron germanium neodymium (2/2/1)', 'Iron neodymium germanide (2/1/2)', 'Iron neodymium germanide (1/2/2)', 'Neodymium iron germanide (1/2/2)']}",-33.13236646,-6.626473292,-0.4356301279999997,"['xas', 'bandstructure']",True,"[166192, 53468, 632074, 53467, 81746, 106873, 632076]",True,2021-05-12 10:56:57.051000,FM,5,8,mp-20785,,Nd(FeGe)2,"{'functional': 'PBE', 'labels': ['Nd_3', 'Fe_pv', 'Ge_d'], 'pot_type': 'paw'}","{'Nd': 1.0, 'Fe': 2.0, 'Ge': 2.0}",GGA,mp-20785,"['mp-990576', 'mp-992635', 'mp-20785', 'mp-1440154', 'mp-1668267', 'mp-1800359', 'mp-994095', 'mp-1596730']",4.6585964,"{'Nd': 1.0, 'Fe': 2.0, 'Ge': 2.0}",87.62640444691804,[],FM,True,139,1,"[0.0, 2.4, 2.4, 0.0, 0.0]",0.0531642993844631,4.6585964,2,4.6585964,MP,data/source/MP/cleaned/cifs/MP-mp-20785.cif,False,,data/final/MP/graphs/Fe2Ge2Nd1-MP-mp-20785.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ga0.5Nb3Sn0.5,1,0.0,2.0,False,Ga1Nb6Sn1,Ga1Nb6Sn1,16.4,Other,True,Ga12.5Nb75Sn12.5,Ga-Nb-Sn,3,Supercon,Nb3Sn0.5Ga0.5,MP-mp-1220342,Nb6Ga1Sn1,Ga-Nb-Sn,Ga12.5Nb75Sn12.5,P m -3,cubic,5.267319,5.267319,5.267319,data/final/MP/cifs/Ga0.5Nb3Sn0.5-MP-mp-1220342.cif,data/source/MP/raw/cifs/mp-1220342.cif,mp-1220342,0.0,,2019-01-12 21:12:16.669000,8.475086109299342,,,{'GGA': {'task_id': 'mp-1733533'}},0.0480318309375,5.78514107,520.0,-68.8247362,-8.603092025,{'tags': []},-68.8247362,-8.603092025,-0.1474047603125008,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,8,5,mp-1220342,,Nb6GaSn,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Ga_d', 'Sn_d'], 'pot_type': 'paw'}","{'Nb': 6.0, 'Ga': 1.0, 'Sn': 1.0}",GGA,mp-1220342,"['mp-1220342', 'mp-1392260', 'mp-1733533', 'mp-1929075', 'mp-1619541']",0.5383733,"{'Nb': 6.0, 'Ga': 1.0, 'Sn': 1.0}",146.13991918453098,[],NM,False,200,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0036839578330421,0.5383733,0,0.5383733,MP,data/source/MP/cleaned/cifs/MP-mp-1220342.cif,False,,data/final/MP/graphs/Ga0.5Nb3Sn0.5-MP-mp-1220342.json,0,True,m-3,2,0,0,0,0,0,0,1,0,0,0,1.0,False
La1Rh1Sb1,1,0.0,4.0,False,La4Rh4Sb4,La4Rh4Sb4,2.1,Other,True,La33.333Rh33.333Sb33.333,La-Rh-Sb,3,Supercon,La1Rh1Sb1,MP-mp-1211458,La4Sb4Rh4,La-Rh-Sb,La33.333Rh33.333Sb33.333,P n m a,orthorhombic,4.700295,7.615112,7.990599,data/final/MP/cifs/La1Rh1Sb1-MP-mp-1211458.cif,data/source/MP/raw/cifs/mp-1211458.cif,mp-1211458,0.0,,2019-01-12 13:49:16.388000,8.443403417840187,,,{'GGA': {'task_id': 'mp-1739039'}},0.0,8.54768935,520.0,-77.80733896,-6.483944913333333,"{'tags': ['LaRhSb', 'AlB2 family', 'TiNiSi']}",-77.80733896,-6.483944913333333,-1.0715061749999997,[],False,[],True,2021-05-12 11:00:28.874000,NM,12,5,mp-1211458,,LaSbRh,"{'functional': 'PBE', 'labels': ['La', 'Sb', 'Rh_pv'], 'pot_type': 'paw'}","{'La': 1.0, 'Sb': 1.0, 'Rh': 1.0}",GGA,mp-1211458,"['mp-1211458', 'mp-1211467', 'mp-1398520', 'mp-1739039', 'mp-1931581']",9.2925e-05,"{'La': 4.0, 'Sb': 4.0, 'Rh': 4.0}",286.00969030618154,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.2996063161429409e-06,9.2925e-05,0,0.0003717,MP,data/source/MP/cleaned/cifs/MP-mp-1211458.cif,False,,data/final/MP/graphs/La1Rh1Sb1-MP-mp-1211458.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ga0.19Nb0.81,3,0.12,8.0,False,Ga1.52Nb6.48,Ga2Nb6,13.3,Other,True,Ga19Nb81,Ga-Nb,2,Supercon,Ga0.19Nb0.81,MP-mp-2670,Nb6Ga2,Ga-Nb,Ga25Nb75,P m -3 n,cubic,5.189021,5.189021,5.189021,data/final/MP/cifs/Ga0.19Nb0.81-MP-mp-2670-synth_doped.cif,data/source/MP/raw/cifs/mp-2670.cif,mp-2670,0.0,,2011-05-14 07:55:50,8.28234811962253,10.17188/1201220,"@misc{osti_1201220,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Ga (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201220"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686575'}},0.0550303606249986,4.96610647,520.0,-68.03986833,-8.50498354125,"{'tags': ['Gallium niobium (1/3)', 'Niobium gallide (3/1)']}",-68.03986833,-8.50498354125,-0.1719807556250003,"['xas', 'elasticity', 'bandstructure']",True,"[634772, 634745, 634746, 634774, 634731, 634748, 634762, 634767, 108484, 634734, 634761, 103831]",True,2021-05-12 10:56:18.721000,NM,8,9,mp-2670,,Nb3Ga,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Ga_d'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Ga': 1.0}",GGA,mp-2670,"['mp-928915', 'mp-912435', 'mp-929292', 'mp-2670', 'mp-1078851', 'mp-1440107', 'mp-1686575', 'mp-1781117', 'mp-1594502']",0.0001134,"{'Nb': 6.0, 'Ga': 2.0}",139.71926259628808,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.6232550600794926e-06,0.0001134,0,0.0002268,MP,data/source/MP/cleaned/cifs/MP-mp-2670.cif,True,,data/final/MP/graphs/Ga0.19Nb0.81-MP-mp-2670-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Cu1La2O4.068,2,0.0082464225078825,0.9832613897082924,True,Cu0.983La1.967O4,Cu1La2O4,36.0,Cuprate,True,Cu14.148La28.297O57.555178268251275,Cu-La-O,3,Supercon,La2Cu1O4.068,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La2O4.068-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La2O4.068-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Mo0.57Re0.43,3,0.1399999999999999,2.0,False,Mo1.14Re0.86,Mo1Re1,12.0,Other,True,Mo57Re43,Mo-Re,2,Supercon,Mo0.57Re0.43,MP-mp-1219485,Re1Mo1,Mo-Re,Mo50Re50,C m m m,orthorhombic,2.71936353,2.71936353,4.457651,data/final/MP/cifs/Mo0.57Re0.43-MP-mp-1219485-synth_doped.cif,data/source/MP/raw/cifs/mp-1219485.cif,mp-1219485,0.0,,2019-01-12 20:28:58.315000,15.093827410702431,,,{'GGA': {'task_id': 'mp-1675676'}},0.1130813237499985,8.320612,520.0,-23.08071648,-11.54035824,{'tags': []},-23.08071648,-11.54035824,0.1047268675000001,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,2,5,mp-1219485,,ReMo,"{'functional': 'PBE', 'labels': ['Re_pv', 'Mo_pv'], 'pot_type': 'paw'}","{'Re': 1.0, 'Mo': 1.0}",GGA,mp-1219485,"['mp-1219485', 'mp-1425249', 'mp-1675676', 'mp-1792472', 'mp-1630224']",0.0007488,"{'Re': 1.0, 'Mo': 1.0}",31.0402460075689,[],NM,False,65,0,"[0, 0]",2.412352014920924e-05,0.0007488,0,0.0007488,MP,data/source/MP/cleaned/cifs/MP-mp-1219485.cif,True,,data/final/MP/graphs/Mo0.57Re0.43-MP-mp-1219485-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
B1C1Lu1Ni0.9V0.1,2,0.0499999999999999,2.0,False,B2C2Lu2Ni1.8V0.2,B2C2Lu2Ni2,2.94,Other,True,B25C25Lu25Ni22.5V2.5,B-C-Lu-Ni-V,5,Supercon,Lu1Ni0.9V0.1B1C1,MP-mp-6188,Lu2Ni2B2C2,B-C-Lu-Ni,B25C25Lu25Ni25,P 4/n m m,tetragonal,3.499459,3.499459,7.54108,data/final/MP/cifs/B1C1Lu1Ni0.9V0.1-MP-mp-6188-synth_doped.cif,data/source/MP/raw/cifs/mp-6188.cif,mp-6188,0.0,,2011-05-13 11:39:58,9.22360692471969,10.17188/1277950,"@misc{osti_1277950,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LuNiBC (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277950"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701902'}},0.0,5.56637243,520.0,-56.94584528,-7.11823066,{'tags': []},-56.94584528,-7.11823066,-0.5664157422916656,"['xas', 'bandstructure']",True,"[54041, 75610]",True,2021-05-12 10:57:28.836000,NM,8,8,mp-6188,,LuNiBC,"{'functional': 'PBE', 'labels': ['Lu_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Lu': 1.0, 'Ni': 1.0, 'B': 1.0, 'C': 1.0}",GGA,mp-6188,"['mp-6188', 'mp-1007095', 'mp-1000629', 'mp-1426768', 'mp-1701902', 'mp-1796435', 'mp-1011840', 'mp-1591367']",0.0004347,"{'Lu': 2.0, 'Ni': 2.0, 'B': 2.0, 'C': 2.0}",92.34967413717082,[],NM,False,129,0,"[0, 0, 0, 0, 0, 0, 0, 0]",9.414218383798992e-06,0.0004347,0,0.0008694,MP,data/source/MP/cleaned/cifs/MP-mp-6188.cif,True,,data/final/MP/graphs/B1C1Lu1Ni0.9V0.1-MP-mp-6188-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ga0.1Nb3Sn0.9,2,0.0499999999999999,2.0,False,Ga0.2Nb6Sn1.8,Nb6Sn2,18.2,Other,True,Ga2.5Nb75Sn22.5,Ga-Nb-Sn,3,Supercon,Nb3Sn0.9Ga0.1,MP-mp-1326,Nb6Sn2,Nb-Sn,Nb75Sn25,P m -3 n,cubic,5.334611,5.334611,5.334611,data/final/MP/cifs/Ga0.1Nb3Sn0.9-MP-mp-1326-synth_doped.cif,data/source/MP/raw/cifs/mp-1326.cif,mp-1326,0.0,,2011-05-14 09:51:48,8.694218121896231,10.17188/1189484,"@misc{osti_1189484,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Sn (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189484"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668415'}},0.0,6.59372491,520.0,-69.93787048,-8.74223381,{'tags': ['Niobium tin (3/1)']},-69.93787048,-8.74223381,-0.163862066250001,"['xas', 'elasticity', 'bandstructure']",True,"[105230, 645503, 645489, 105231, 645498, 645485, 645474, 645496, 645480, 645488, 645482, 645487, 645500, 645493, 645477, 645484, 645502, 645483, 150878, 645479, 645481, 645486, 645473]",True,2021-05-12 10:56:12.755000,NM,8,9,mp-1326,,Nb3Sn,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Sn_d'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Sn': 1.0}",GGA,mp-1326,"['mp-930046', 'mp-913770', 'mp-930577', 'mp-1326', 'mp-1440651', 'mp-1668415', 'mp-1880085', 'mp-1594093', 'mp-1594507']",0.62023085,"{'Nb': 6.0, 'Sn': 2.0}",151.81275738025872,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0081709977567491,0.62023085,0,1.2404617,MP,data/source/MP/cleaned/cifs/MP-mp-1326.cif,True,,data/final/MP/graphs/Ga0.1Nb3Sn0.9-MP-mp-1326-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
B1.968C0.032Mg1,2,0.0213333333333333,1.0,True,B1.968C0.032Mg1,B2Mg1,37.0,Other,True,B65.6C1.067Mg33.333,B-C-Mg,3,Supercon,Mg1B1.968C0.032,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B1.968C0.032Mg1-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B1.968C0.032Mg1-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Al1Ge3Y2,1,0.0,4.0,False,Al4Ge12Y8,Al4Ge12Y8,4.5,Other,True,Al16.667Ge50Y33.333,Al-Ge-Y,3,Supercon,Y2Al1Ge3,MP-mp-28997,Y8Al4Ge12,Al-Ge-Y,Al16.667Ge50Y33.333,P n m a,orthorhombic,4.21587,6.840053,17.754919,data/final/MP/cifs/Al1Ge3Y2-MP-mp-28997.cif,data/source/MP/raw/cifs/mp-28997.cif,mp-28997,0.0,,2014-02-20 08:02:31,5.483900487843437,10.17188/1203049,"@misc{osti_1203049,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Y2AlGe3 (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1203049"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1736313'}},0.0050200181666673,5.78420877,520.0,-137.76266712,-5.74011113,{'tags': ['Yttrium aluminium germanide (2/1/3)']},-137.76266712,-5.74011113,-0.6488441930555554,"['xas', 'bandstructure']",True,[78969],True,2021-05-12 10:57:03.017000,NM,24,9,mp-28997,,Y2AlGe3,"{'functional': 'PBE', 'labels': ['Y_sv', 'Al', 'Ge_d'], 'pot_type': 'paw'}","{'Y': 2.0, 'Al': 1.0, 'Ge': 3.0}",GGA,mp-28997,"['mp-923871', 'mp-924612', 'mp-908934', 'mp-28997', 'mp-1255457', 'mp-1395379', 'mp-1736313', 'mp-1825208', 'mp-1618043']",0.000926775,"{'Y': 8.0, 'Al': 4.0, 'Ge': 12.0}",511.9945908721945,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",7.24050618129553e-06,0.000926775,0,0.0037071,MP,data/source/MP/cleaned/cifs/MP-mp-28997.cif,False,,data/final/MP/graphs/Al1Ge3Y2-MP-mp-28997.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
C4Fe1Tm2,1,0.0,2.0,False,C8Fe2Tm4,C8Fe2Tm4,0.0,Other,True,C57.143Fe14.286Tm28.571,C-Fe-Tm,3,Supercon,Tm2Fe1C4,MP-mp-7085,Tm4Fe2C8,C-Fe-Tm,C57.143Fe14.286Tm28.571,I b a m,orthorhombic,4.971685999332673,6.4992735,6.499273499055862,data/final/MP/cifs/C4Fe1Tm2-MP-mp-7085.cif,data/source/MP/raw/cifs/mp-7085.cif,mp-7085,0.0,,2011-05-30 23:47:02,8.409666789543039,10.17188/1286549,"@misc{osti_1286549,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Tm2FeC4 (SG:72) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1286549"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697913'}},0.0,4.92649407,520.0,-113.11537929,-8.079669949285714,{'tags': ['Thulium iron carbide (2/1/4)']},-113.11537929,-8.079669949285714,-0.3184125069047618,['bandstructure'],True,[40758],True,2021-05-12 10:58:53.520000,NM,14,8,mp-7085,,Tm2FeC4,"{'functional': 'PBE', 'labels': ['Tm_3', 'Fe_pv', 'C'], 'pot_type': 'paw'}","{'Tm': 2.0, 'Fe': 1.0, 'C': 4.0}",GGA,mp-7085,"['mp-909739', 'mp-925377', 'mp-924803', 'mp-7085', 'mp-1423432', 'mp-1697913', 'mp-1831151', 'mp-1599582']",4.035e-05,"{'Tm': 4.0, 'Fe': 2.0, 'C': 8.0}",174.45482195220336,[],NM,False,72,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.625839463589603e-07,4.035e-05,0,8.07e-05,MP,data/source/MP/cleaned/cifs/MP-mp-7085.cif,False,,data/final/MP/graphs/C4Fe1Tm2-MP-mp-7085.json,0,True,mmm,0,0,0,7,0,0,0,0,0,1,0,1.0,False
Ca2Pt3Si5,1,0.0,2.0,False,Ca4Pt6Si10,Ca4Pt6Si10,1.3,Other,True,Ca20Pt30Si50,Ca-Pt-Si,3,Supercon,Ca2Pt3Si5,MP-mp-1214093,Ca4Si10Pt6,Ca-Pt-Si,Ca20Pt30Si50,I b a m,orthorhombic,5.982844002391486,8.25619804,8.256198040969446,data/final/MP/cifs/Ca2Pt3Si5-MP-mp-1214093.cif,data/source/MP/raw/cifs/mp-1214093.cif,mp-1214093,0.0,,2019-01-12 15:59:50.446000,7.63134365128885,,,{'GGA': {'task_id': 'mp-1683085'}},0.0,7.16507672,520.0,-115.18907067,-5.7594535335,{'tags': []},-115.18907067,-5.7594535335,-0.7889042345,[],False,[],True,2021-05-12 11:00:35.508000,NM,20,4,mp-1214093,,Ca2Si5Pt3,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Si', 'Pt'], 'pot_type': 'paw'}","{'Ca': 2.0, 'Si': 5.0, 'Pt': 3.0}",GGA,mp-1214093,"['mp-1214093', 'mp-1344193', 'mp-1683085', 'mp-1839140']",0.00301855,"{'Ca': 4.0, 'Si': 10.0, 'Pt': 6.0}",350.6908848947328,[],NM,False,72,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.7214875721141603e-05,0.00301855,0,0.0060371,MP,data/source/MP/cleaned/cifs/MP-mp-1214093.cif,False,,data/final/MP/graphs/Ca2Pt3Si5-MP-mp-1214093.json,0,True,mmm,0,0,0,7,0,0,0,0,0,1,0,1.0,False
Ba0.18Cu1La1.82O4,3,0.0514285714285714,1.0,True,Ba0.18Cu1La1.82O4,Cu1La2O4,23.1,Cuprate,True,Ba2.571Cu14.286La26O57.142857142857146,Ba-Cu-La-O,4,Supercon,La1.82Ba0.18Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ba0.18Cu1La1.82O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ba0.18Cu1La1.82O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ge2Mo1,1,0.0,4.0,False,Ge8Mo4,Ge8Mo4,1.5275,Other,True,Ge66.667Mo33.333,Ge-Mo,2,Supercon,Ge2Mo1,MP-mp-13688,Ge8Mo4,Ge-Mo,Ge66.667Mo33.333,P n m a,orthorhombic,3.485781,6.404467,8.64668,data/final/MP/cifs/Ge2Mo1-MP-mp-13688.cif,data/source/MP/raw/cifs/mp-13688.cif,mp-13688,0.0,,2011-06-06 22:50:56,8.300226134485262,10.17188/1189721,"@misc{osti_1189721,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ge2Mo (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189721"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703095'}},0.0,6.20081257,520.0,-82.36128573,-6.8634404775,{'tags': ['Molybdenum germanium (1/2)']},-82.36128573,-6.8634404775,-0.1662075641666677,"['xas', 'bandstructure']",True,[16822],True,2021-05-12 10:56:53.126000,NM,12,8,mp-13688,,Ge2Mo,"{'functional': 'PBE', 'labels': ['Ge_d', 'Mo_pv'], 'pot_type': 'paw'}","{'Ge': 2.0, 'Mo': 1.0}",GGA,mp-13688,"['mp-925180', 'mp-924522', 'mp-909475', 'mp-13688', 'mp-1435618', 'mp-1703095', 'mp-1827407', 'mp-1601363']",2.275e-06,"{'Ge': 8.0, 'Mo': 4.0}",193.03340759888457,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.7142098941284935e-08,2.275e-06,0,9.1e-06,MP,data/source/MP/cleaned/cifs/MP-mp-13688.cif,False,,data/final/MP/graphs/Ge2Mo1-MP-mp-13688.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Rh0.29Se0.71,3,0.0866666666666666,12.0,False,Rh3.48Se8.52,Rh4Se8,0.0,Other,True,Rh29Se71,Rh-Se,2,Supercon,Rh0.29Se0.71,MP-mp-983,Rh4Se8,Rh-Se,Rh33.333Se66.667,P a -3,cubic,6.099805,6.099805,6.099805,data/final/MP/cifs/Rh0.29Se0.71-MP-mp-983-synth_doped.cif,data/source/MP/raw/cifs/mp-983.cif,mp-983,0.0,,2011-05-14 19:13:30,7.6332815701689585,10.17188/1316470,"@misc{osti_1316470,
    author = ""Persson, Kristin"",
    title = ""Materials Data on RhSe2 (SG:205) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1316470"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700335'}},0.033700524583339,6.11932593,520.0,-62.153365,-5.179447083333334,"{'tags': ['Rhenium selenide (1/2)', 'Rhodium selenide (1/2)', 'Rhodium perselenide (1/1)']}",-62.153365,-5.179447083333334,-0.7087368082291666,['bandstructure'],True,"[650276, 44868, 650283]",True,2021-05-12 10:59:09.988000,NM,12,8,mp-983,,RhSe2,"{'functional': 'PBE', 'labels': ['Rh_pv', 'Se'], 'pot_type': 'paw'}","{'Rh': 1.0, 'Se': 2.0}",GGA,mp-983,"['mp-942577', 'mp-921168', 'mp-983', 'mp-942969', 'mp-1417796', 'mp-1700335', 'mp-1871355', 'mp-1600224']",8.3475e-05,"{'Rh': 4.0, 'Se': 8.0}",226.95923284585007,[],NM,False,205,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.4711893224752998e-06,8.3475e-05,0,0.0003339,MP,data/source/MP/cleaned/cifs/MP-mp-983.cif,True,,data/final/MP/graphs/Rh0.29Se0.71-MP-mp-983-synth_doped.json,0,True,m-3,2,0,0,0,0,0,0,1,0,0,0,1.0,False
Al2.97Pd2U1,2,0.0050251256281406,1.0,True,Al2.97Pd2U1,Al3Pd2U1,0.0,Heavy_fermion,True,Al49.749Pd33.501U16.75,Al-Pd-U,3,Supercon,U1Pd2Al2.97,MP-mp-4561,U1Al3Pd2,Al-Pd-U,Al50Pd33.333U16.667,P 6/m m m,hexagonal,4.239652,5.384229999094356,5.3842309,data/final/MP/cifs/Al2.97Pd2U1-MP-mp-4561-synth_doped.cif,data/source/MP/raw/cifs/mp-4561.cif,mp-4561,0.0,,2011-05-12 23:59:10,8.296603403902926,10.17188/1208253,"@misc{osti_1208253,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UAl3Pd2 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208253"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700804'}},0.0796314472916668,8.0468212,520.0,-36.36476907,-6.060794845,"{'tags': ['Aluminium palladium uranium (3/2/1)', 'Aluminum palladium uranium (3/2/1)']}",-36.36476907,-6.060794845,-0.5794779916666665,"['xas', 'elasticity', 'bandstructure']",True,"[657574, 106242, 659234]",True,2021-05-12 10:56:20.740000,FM,6,9,mp-4561,,UAl3Pd2,"{'functional': 'PBE', 'labels': ['U', 'Al', 'Pd'], 'pot_type': 'paw'}","{'U': 1.0, 'Al': 3.0, 'Pd': 2.0}",GGA,mp-4561,"['mp-4561', 'mp-991619', 'mp-993538', 'mp-1251974', 'mp-1441898', 'mp-1700804', 'mp-1933710', 'mp-994863', 'mp-1593816']",2.2050571,"{'U': 1.0, 'Al': 3.0, 'Pd': 2.0}",106.4408038742404,[],FM,True,191,1,"[2.2, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0207162762750765,2.2050571,1,2.2050571,MP,data/source/MP/cleaned/cifs/MP-mp-4561.cif,True,,data/final/MP/graphs/Al2.97Pd2U1-MP-mp-4561-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Nb1Sn2,1,0.0,4.0,False,Nb4Sn8,Nb4Sn8,2.64,Other,True,Nb33.333Sn66.667,Nb-Sn,2,Supercon,Nb1Sn2,MP-mp-1046,Nb4Sn8,Nb-Sn,Nb33.333Sn66.667,F d d d,orthorhombic,5.725022000819292,5.736213393085975,10.073235029794544,data/final/MP/cifs/Nb1Sn2-MP-mp-1046.cif,data/source/MP/raw/cifs/mp-1046.cif,mp-1046,0.0,,2011-05-16 14:18:04,7.982742120157364,10.17188/1187136,"@misc{osti_1187136,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbSn2 (SG:70) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187136"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697177'}},0.0,7.75126641,520.0,-74.15110062,-6.179258385,"{'tags': ['Niobium tin (1/2)', 'Niobium stannide (1/2)']}",-74.15110062,-6.179258385,-0.1391088016666657,"['xas', 'elasticity', 'bandstructure']",True,"[106552, 645495, 105229]",True,2021-05-12 10:56:10.715000,NM,12,8,mp-1046,,NbSn2,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Sn_d'], 'pot_type': 'paw'}","{'Nb': 1.0, 'Sn': 2.0}",GGA,mp-1046,"['mp-930212', 'mp-913205', 'mp-929708', 'mp-1046', 'mp-1103231', 'mp-1429030', 'mp-1697177', 'mp-1597336']",0.000120375,"{'Nb': 4.0, 'Sn': 8.0}",274.8528515450747,[],NM,False,70,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.7518464781910258e-06,0.000120375,0,0.0004815,MP,data/source/MP/cleaned/cifs/MP-mp-1046.cif,False,,data/final/MP/graphs/Nb1Sn2-MP-mp-1046.json,0,True,mmm,0,0,0,7,0,0,0,0,0,0,1,1.0,False
C0.82Nb2S1,3,0.0706806282722513,2.0,False,C1.64Nb4S2,C2Nb4S2,4.43,Other,True,C21.466Nb52.356S26.178,C-Nb-S,3,Supercon,Nb2S1C0.82,MP-mp-9988,Nb4C2S2,C-Nb-S,C25Nb50S25,P 63/m m c,hexagonal,3.343598003728437,3.34359817,11.580941,data/final/MP/cifs/C0.82Nb2S1-MP-mp-9988-synth_doped.cif,data/source/MP/raw/cifs/mp-9988.cif,mp-9988,0.0,,2011-05-28 14:17:21,6.80916159531999,10.17188/1317400,"@misc{osti_1317400,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb2CS (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1317400"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703916'}},0.0247363409375012,7.73433733,520.0,-73.20869059,-9.15108632375,"{'tags': ['Niobium sulfide carbide (2/1/1)', 'Diniobium sulfide carbide']}",-73.20869059,-9.15108632375,-0.8853761620312515,"['xas', 'elasticity', 'bandstructure']",True,"[43010, 180619]",True,2021-05-12 10:56:37.246000,NM,8,8,mp-9988,,Nb2CS,"{'functional': 'PBE', 'labels': ['Nb_pv', 'C', 'S'], 'pot_type': 'paw'}","{'Nb': 2.0, 'C': 1.0, 'S': 1.0}",GGA,mp-9988,"['mp-909913', 'mp-925443', 'mp-9988', 'mp-925879', 'mp-1415588', 'mp-1703916', 'mp-1802770', 'mp-1593375']",0.00040745,"{'Nb': 4.0, 'C': 2.0, 'S': 2.0}",112.12504313391082,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",7.267778697991365e-06,0.00040745,0,0.0008149,MP,data/source/MP/cleaned/cifs/MP-mp-9988.cif,True,,data/final/MP/graphs/C0.82Nb2S1-MP-mp-9988-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Bi1Mn1,1,0.0,2.0,False,Bi2Mn2,Bi2Mn2,0.0,Other,True,Bi50Mn50,Bi-Mn,2,Supercon,Bi1Mn1,MP-mp-568382,Mn2Bi2,Bi-Mn,Bi50Mn50,P 63/m m c,hexagonal,4.319688001408622,4.31968753,5.745016,data/final/MP/cifs/Bi1Mn1-MP-mp-568382.cif,data/source/MP/raw/cifs/mp-568382.cif,mp-568382,0.0,,2015-02-14 23:59:24,9.441092785858007,10.17188/1274398,"@misc{osti_1274398,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MnBi (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1274398"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1066840'}},0.2078357360344824,5.82765454,520.0,-25.27275626,-6.318189065,"{'tags': ['Bismuth magnesium (1/1)', 'Manganese bismuthide (1/1)', 'Bismuth manganese (1/1)']}",-25.27275626,-6.318189065,0.2078357360344824,"['xas', 'elasticity']",False,"[616811, 192881, 192875, 192878, 192874, 192877, 192879, 192876, 192873, 192880, 616812, 616808, 58805]",True,2021-05-12 10:56:22.739000,FiM,4,44,mp-568382,,MnBi,"{'functional': 'PBE', 'labels': ['Mn_pv', 'Bi'], 'pot_type': 'paw'}","{'Mn': 1.0, 'Bi': 1.0}",GGA,mp-568382,"['mp-944365', 'mp-933511', 'mp-943724', 'mp-1063902', 'mp-1063916', 'mp-1063933', 'mp-1065169', 'mp-1065215', 'mp-1065128', 'mp-1065134', 'mp-1065234', 'mp-1065200', 'mp-1065071', 'mp-1065267', 'mp-1065280', 'mp-1065374', 'mp-1065403', 'mp-1065441', 'mp-1065471', 'mp-1065509', 'mp-1065576', 'mp-568382', 'mp-1066704', 'mp-1066842', 'mp-1066840', 'mp-1066755', 'mp-1066798', 'mp-1066959', 'mp-1066754', 'mp-1066879', 'mp-1440707', 'mp-1686639', 'mp-1797587', 'mp-1590969', 'mp-1595227', 'mp-1066828', 'mp-1066827', 'mp-1066949', 'mp-1063934', 'mp-1065571', 'mp-1065264', 'mp-1065275', 'mp-1065438', 'mp-1065210']",3.5484694,"{'Mn': 2.0, 'Bi': 2.0}",92.83816995746125,[],FiM,True,194,2,"[3.5, 3.5, -0.2, -0.2]",0.0764441910396536,3.5484694,4,7.0969388,MP,data/source/MP/cleaned/cifs/MP-mp-568382.cif,False,,data/final/MP/graphs/Bi1Mn1-MP-mp-568382.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ca1Zn5,1,0.0,1.0,True,Ca1Zn5,Ca1Zn5,0.0,Other,True,Ca16.667Zn83.333,Ca-Zn,2,Supercon,Ca1Zn5,MP-mp-1734,Ca1Zn5,Ca-Zn,Ca16.667Zn83.333,P 6/m m m,hexagonal,4.253008,5.397262002447387,5.397262,data/final/MP/cifs/Ca1Zn5-MP-mp-1734.cif,data/source/MP/raw/cifs/mp-1734.cif,mp-1734,0.0,,2011-05-13 14:57:42,5.681811988903221,10.17188/1192457,"@misc{osti_1192457,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CaZn5 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1192457"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695254'}},0.0,2.84334752,520.0,-9.67189641,-1.611982735,{'tags': ['Calcium zinc (1/5)']},-9.67189641,-1.611982735,-0.2279297466666667,"['xas', 'elasticity', 'bandstructure']",True,"[58947, 619638, 418614]",True,2021-05-12 10:56:14.760000,NM,6,8,mp-1734,,CaZn5,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Zn'], 'pot_type': 'paw'}","{'Ca': 1.0, 'Zn': 5.0}",GGA,mp-1734,"['mp-928235', 'mp-912182', 'mp-1734', 'mp-928771', 'mp-1441897', 'mp-1695254', 'mp-1797858', 'mp-1595417']",6.47e-05,"{'Ca': 1.0, 'Zn': 5.0}",107.29360368452971,[],NM,False,191,0,"[0, 0, 0, 0, 0, 0]",6.030182394677909e-07,6.47e-05,0,6.47e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1734.cif,False,,data/final/MP/graphs/Ca1Zn5-MP-mp-1734.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
P1Rh1Zr1,1,0.0,4.0,False,P4Rh4Zr4,P4Rh4Zr4,1.525,Other,True,P33.333Rh33.333Zr33.333,P-Rh-Zr,3,Supercon,Zr1Rh1P1,MP-mp-1101753,Zr4P4Rh4,P-Rh-Zr,P33.333Rh33.333Zr33.333,P n m a,orthorhombic,3.818296,6.536864,7.458812,data/final/MP/cifs/P1Rh1Zr1-MP-mp-1101753.cif,data/source/MP/raw/cifs/mp-1101753.cif,mp-1101753,0.0,,2018-07-18 12:04:54,8.031232049929258,,,{'GGA': {'task_id': 'mp-1698972'}},0.0,7.74416373,520.0,-100.63858571,-8.386548809166667,"{'tags': ['ZrRhP', 'Rhodium zirconium phosphide (1/1/1)', 'AlB2 family', 'TiNiSi']}",-100.63858571,-8.386548809166667,-1.2781118069444446,['bandstructure'],True,[648009],True,2021-05-12 10:58:18.470000,NM,12,5,mp-1101753,,ZrPRh,"{'functional': 'PBE', 'labels': ['Zr_sv', 'P', 'Rh_pv'], 'pot_type': 'paw'}","{'Zr': 1.0, 'P': 1.0, 'Rh': 1.0}",GGA,mp-1101753,"['mp-1101753', 'mp-1434024', 'mp-1698972', 'mp-1829630', 'mp-1598543']",9e-07,"{'Zr': 4.0, 'P': 4.0, 'Rh': 4.0}",186.16957310971367,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.933720929723808e-08,9e-07,0,3.6e-06,MP,data/source/MP/cleaned/cifs/MP-mp-1101753.cif,False,,data/final/MP/graphs/P1Rh1Zr1-MP-mp-1101753.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Al0.044B2Mg0.956,2,0.0293333333333333,1.0,True,Al0.044B2Mg0.956,B2Mg1,34.0,Other,True,Al1.467B66.667Mg31.867,Al-B-Mg,3,Supercon,Mg0.956Al0.044B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/Al0.044B2Mg0.956-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/Al0.044B2Mg0.956-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
As1Ca1F1Fe0.9Ni0.1,2,0.0499999999999999,2.0,False,As2Ca2F2Fe1.8Ni0.2,As2Ca2F2Fe2,15.4,Ferrite,True,As25Ca25F25Fe22.5Ni2.5,As-Ca-F-Fe-Ni,5,Supercon,Ca1Fe0.9Ni0.1As1F1,MP-mp-1079859,Ca2Fe2As2F2,As-Ca-F-Fe,As25Ca25F25Fe25,P m m n,orthorhombic,3.933336,3.981276,9.018918,data/final/MP/cifs/As1Ca1F1Fe0.9Ni0.1-MP-mp-1079859-synth_doped.cif,data/source/MP/raw/cifs/mp-1079859.cif,mp-1079859,0.0,,2018-04-16 14:43:21,4.464120586611354,,,{'GGA+U': {'task_id': 'mp-1695365'}},0.2859614887499973,4.27317878,520.0,-41.71531675,-5.21441459375,"{'tags': ['Calcium iron arsenide fluoride', 'High pressure experimental phase']}",-41.71531675,-5.21441459375,-1.632363168125,['bandstructure'],True,[186505],True,2021-05-12 10:58:16.596000,FM,8,6,mp-1079859,,CaFeAsF,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Fe_pv', 'As', 'F'], 'pot_type': 'paw'}","{'Ca': 1.0, 'Fe': 1.0, 'As': 1.0, 'F': 1.0}",GGA+U,mp-1079859,"['mp-1079859', 'mp-1475687', 'mp-1695365', 'mp-1785040', 'mp-1938652', 'mp-1594699']",3.7150606,"{'Ca': 2.0, 'Fe': 2.0, 'As': 2.0, 'F': 2.0}",141.2335160836522,[],FM,True,59,1,"[0.0, 0.0, 3.6, 3.6, 0.0, 0.0, 0.0, 0.0]",0.0526087674231601,3.7150606,2,7.4301212,MP,data/source/MP/cleaned/cifs/MP-mp-1079859.cif,True,,data/final/MP/graphs/As1Ca1F1Fe0.9Ni0.1-MP-mp-1079859-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Lu1Tc2,1,0.0,4.0,False,Lu4Tc8,Lu4Tc8,9.9,Other,True,Lu33.333Tc66.667,Lu-Tc,2,Supercon,Lu1Tc2,MP-mp-1095487,Lu4Tc8,Lu-Tc,Lu33.333Tc66.667,P 63/m m c,hexagonal,5.328509996749636,5.32850911,8.811705,data/final/MP/cifs/Lu1Tc2-MP-mp-1095487.cif,data/source/MP/raw/cifs/mp-1095487.cif,mp-1095487,0.0,,2018-04-28 02:05:36,11.372142991320931,,,{'GGA': {'task_id': 'mp-1678103'}},0.0,5.90791947,520.0,-104.30131182,-8.691775985,"{'tags': ['Lutetium technetium (1/2)', 'MgZn2', 'Friauf-Laves phase, Frank-Kasper phase', 'LuTc2']}",-104.30131182,-8.691775985,-0.2777125383333327,['bandstructure'],True,"[642617, 642618]",True,2021-05-12 10:58:18.470000,NM,12,6,mp-1095487,,LuTc2,"{'functional': 'PBE', 'labels': ['Lu_3', 'Tc_pv'], 'pot_type': 'paw'}","{'Lu': 1.0, 'Tc': 2.0}",GGA,mp-1095487,"['mp-1095487', 'mp-1102241', 'mp-1340525', 'mp-1678103', 'mp-1788061', 'mp-1598129']",0.00777715,"{'Lu': 4.0, 'Tc': 8.0}",216.6716322119865,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0001435748634115,0.00777715,0,0.0311086,MP,data/source/MP/cleaned/cifs/MP-mp-1095487.cif,False,,data/final/MP/graphs/Lu1Tc2-MP-mp-1095487.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Cu3F0.76Y1O6,3,0.0347238967928623,1.0,True,Ba2Cu3F0.76Y1O6,Ba2Cu3F1Y1O6,35.0,Cuprate,True,Ba15.674Cu23.511F5.956Y7.837O47.02194357366771,Ba-Cu-F-Y-O,5,Supercon,Y1Ba2Cu3F0.76O6,MP-mp-1214572,Ba2Y1Cu3O6F1,Ba-Cu-F-Y-O,Ba15.385Cu23.077F7.692Y7.692O46.15384615384615,P m m m,orthorhombic,3.825928,3.996006,11.979348,data/final/MP/cifs/Ba2Cu3F0.76Y1O6-MP-mp-1214572-synth_doped.cif,data/source/MP/raw/cifs/mp-1214572.cif,mp-1214572,0.0,,2019-01-12 16:23:36.117000,6.0674213586441015,,,{'GGA': {'task_id': 'mp-1742688'}},0.0994703672884611,3.46277739,520.0,-79.44286371,-6.110989516153846,"{'tags': ['Ba2Cu3YO7', 'Ba2Cu3YO6F ht', 'high-Tc cuprate family']}",-79.44286371,-6.110989516153846,-2.294275840705128,[],False,[],True,2021-05-12 11:00:35.508000,NM,13,4,mp-1214572,oxide,Ba2YCu3O6F,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Cu_pv', 'O', 'F'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Cu': 3.0, 'O': 6.0, 'F': 1.0}",GGA,mp-1214572,"['mp-1214572', 'mp-1412673', 'mp-1742688', 'mp-1789833']",0.0338055,"{'Ba': 2.0, 'Y': 1.0, 'Cu': 3.0, 'O': 6.0, 'F': 1.0}",183.14543824077384,[],NM,False,47,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001845828120248,0.0338055,0,0.0338055,MP,data/source/MP/cleaned/cifs/MP-mp-1214572.cif,True,,data/final/MP/graphs/Ba2Cu3F0.76Y1O6-MP-mp-1214572-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ba2Cu1Hg1O4.02,2,0.0024937655860348,0.9950062189054728,True,Ba1.99Cu0.995Hg0.995O4,Ba2Cu1Hg1O4,72.0,Cuprate,True,Ba24.938Cu12.469Hg12.469O50.12468827930174,Ba-Cu-Hg-O,4,Supercon,Hg1Ba2Cu1O4.02,MP-mp-6562,Ba2Cu1Hg1O4,Ba-Cu-Hg-O,Ba25Cu12.5Hg12.5O50,P 4/m m m,tetragonal,3.933714,3.933714,9.827602,data/final/MP/cifs/Ba2Cu1Hg1O4.02-MP-mp-6562-synth_doped.cif,data/source/MP/raw/cifs/mp-6562.cif,mp-6562,0.0,,2011-05-13 18:18:06,6.582036471328142,10.17188/1281336,"@misc{osti_1281336,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2CuHgO4 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281336"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697135'}},0.0234340381250053,2.58068675,520.0,-40.91481298,-5.1143516225,"{'tags': ['Mercury dibarium copper oxide', 'High pressure experimental phase']}",-40.91481298,-5.1143516225,-1.953767533125,"['xas', 'bandstructure']",True,"[75722, 75720, 75724, 75721, 75723]",True,2021-05-12 10:57:32.679000,NM,8,8,mp-6562,oxide,Ba2CuHgO4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Cu_pv', 'Hg', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",GGA,mp-6562,"['mp-6562', 'mp-990899', 'mp-992892', 'mp-1435690', 'mp-1697135', 'mp-1878488', 'mp-994198', 'mp-1592659']",0.0003984,"{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",152.07335344042525,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0, 0, 0]",2.619788352047311e-06,0.0003984,0,0.0003984,MP,data/source/MP/cleaned/cifs/MP-mp-6562.cif,True,,data/final/MP/graphs/Ba2Cu1Hg1O4.02-MP-mp-6562-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
La1Os4Sb12,1,0.0,1.0,True,La1Os4Sb12,La1Os4Sb12,0.80775,Other,True,La5.882Os23.529Sb70.588,La-Os-Sb,3,Supercon,La1Os4Sb12,MP-mp-1106066,La1Sb12Os4,La-Os-Sb,La5.882Os23.529Sb70.588,I m -3,cubic,8.169493031811049,8.16949303,8.16949303,data/final/MP/cifs/La1Os4Sb12-MP-mp-1106066.cif,data/source/MP/raw/cifs/mp-1106066.cif,mp-1106066,0.0,,2018-07-19 07:39:03,9.340532263900675,,,{'GGA': {'task_id': 'mp-1668888'}},0.0,7.58379109,520.0,-102.78670558,-6.04627679882353,"{'tags': ['LaOs4Sb12', 'Lanthanum osmium antimonide (1/4/12)', 'LaFe4P12']}",-102.78670558,-6.04627679882353,-0.1996010926470591,['bandstructure'],True,"[183085, 641617]",True,2021-05-12 10:58:22.271000,NM,17,6,mp-1106066,,La(Sb3Os)4,"{'functional': 'PBE', 'labels': ['La', 'Sb', 'Os_pv'], 'pot_type': 'paw'}","{'La': 1.0, 'Sb': 12.0, 'Os': 4.0}",GGA,mp-1106066,"['mp-1106066', 'mp-1190143', 'mp-1436423', 'mp-1668888', 'mp-1822649', 'mp-1607939']",0.0172651,"{'La': 1.0, 'Sb': 12.0, 'Os': 4.0}",419.7236384696232,[],NM,False,204,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",4.113444756876502e-05,0.0172651,0,0.0172651,MP,data/source/MP/cleaned/cifs/MP-mp-1106066.cif,False,,data/final/MP/graphs/La1Os4Sb12-MP-mp-1106066.json,0,True,m-3,2,0,0,0,0,0,0,0,0,1,0,1.0,False
C6Sr1,1,0.0,2.0,False,C12Sr2,C12Sr2,1.65,Carbon,True,C85.714Sr14.286,C-Sr,2,Supercon,C6Sr1,MP-mp-1208630,Sr2C12,C-Sr,C85.714Sr14.286,P 63/m m c,hexagonal,4.3336479980698375,4.33364864,9.970737,data/final/MP/cifs/C6Sr1-MP-mp-1208630.cif,data/source/MP/raw/cifs/mp-1208630.cif,mp-1208630,0.0,,2019-01-12 11:30:36.127000,3.270211156449992,,,{'GGA': {'task_id': 'mp-1725173'}},0.0,5.79066679,520.0,-114.7099863,-8.19357045,"{'tags': ['SrC6', 'BaC6', 'graphite intercalation compound']}",-114.7099863,-8.19357045,-0.0435450709523794,[],False,[],True,2021-05-12 11:00:21.818000,NM,14,4,mp-1208630,,SrC6,"{'functional': 'PBE', 'labels': ['Sr_sv', 'C'], 'pot_type': 'paw'}","{'Sr': 1.0, 'C': 6.0}",GGA,mp-1208630,"['mp-1208630', 'mp-1392888', 'mp-1725173', 'mp-1788440']",0.00391585,"{'Sr': 2.0, 'C': 12.0}",162.16803119625865,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.829373546825599e-05,0.00391585,0,0.0078317,MP,data/source/MP/cleaned/cifs/MP-mp-1208630.cif,False,,data/final/MP/graphs/C6Sr1-MP-mp-1208630.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
La1Rh1Si1,1,0.0,4.0,False,La4Rh4Si4,La4Rh4Si4,4.35,Other,True,La33.333Rh33.333Si33.333,La-Rh-Si,3,Supercon,La1Rh1Si1,MP-mp-1103155,La4Si4Rh4,La-Rh-Si,La33.333Rh33.333Si33.333,P 21 3,cubic,6.420524,6.420524,6.420524,data/final/MP/cifs/La1Rh1Si1-MP-mp-1103155.cif,data/source/MP/raw/cifs/mp-1103155.cif,mp-1103155,0.0,,2018-07-18 17:23:19,6.773215165025397,,,{'GGA': {'task_id': 'mp-1676236'}},0.0,7.65781776,520.0,-82.55768347,-6.879806955833334,"{'tags': ['LaRhSi', 'Lanthanum rhodium silicide (1/1/1)', 'ZrSO']}",-82.55768347,-6.879806955833334,-0.9712639574999996,['bandstructure'],True,[641749],True,2021-05-12 10:58:20.361000,NM,12,6,mp-1103155,,LaSiRh,"{'functional': 'PBE', 'labels': ['La', 'Si', 'Rh_pv'], 'pot_type': 'paw'}","{'La': 1.0, 'Si': 1.0, 'Rh': 1.0}",GGA,mp-1103155,"['mp-1103155', 'mp-1211705', 'mp-1426419', 'mp-1676236', 'mp-1938818', 'mp-1604678']",0.0012604,"{'La': 4.0, 'Si': 4.0, 'Rh': 4.0}",264.67408546927766,[],NM,False,198,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.9048332559876587e-05,0.0012604,0,0.0050416,MP,data/source/MP/cleaned/cifs/MP-mp-1103155.cif,False,,data/final/MP/graphs/La1Rh1Si1-MP-mp-1103155.json,0,True,23,1,0,0,0,0,0,0,1,0,0,0,1.0,False
Ce1Cu2Ge0.3Si1.7,3,0.12,1.0,True,Ce1Cu2Ge0.3Si1.7,Ce1Cu2Si2,0.1,Heavy_fermion,True,Ce20Cu40Ge6Si34,Ce-Cu-Ge-Si,4,Supercon,Ce1Cu2Si1.7Ge0.3,MP-mp-5452,Ce1Cu2Si2,Ce-Cu-Si,Ce20Cu40Si40,I 4/m m m,tetragonal,4.075731996715381,4.075731996715381,5.70132195,data/final/MP/cifs/Ce1Cu2Ge0.3Si1.7-MP-mp-5452-synth_doped.cif,data/source/MP/raw/cifs/mp-5452.cif,mp-5452,0.0,,2011-05-13 06:29:11,6.571257460055593,10.17188/1266988,"@misc{osti_1266988,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ce(SiCu)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1266988"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668622'}},0.0,8.51519913,520.0,-27.86039596,-5.572079192,"{'tags': ['Cerium copper silicon (1/2/2)', 'Cerium copper silicide (1/2/2)']}",-27.86039596,-5.572079192,-0.5472530850000006,"['xas', 'elasticity', 'bandstructure']",True,"[620924, 620948, 102140, 620940, 620921, 620914, 164068, 620946, 620920, 620949, 102141, 620930, 620939, 620931, 620951, 620944, 657643, 657672, 620943, 55797, 52851]",True,2021-05-12 10:56:22.739000,NM,5,9,mp-5452,,Ce(CuSi)2,"{'functional': 'PBE', 'labels': ['Ce', 'Cu_pv', 'Si'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Cu': 2.0, 'Si': 2.0}",GGA,mp-5452,"['mp-5452', 'mp-1097881', 'mp-1156698', 'mp-1248439', 'mp-1440927', 'mp-1668622', 'mp-1798875', 'mp-1594230', 'mp-1595235']",0.01041,"{'Ce': 1.0, 'Cu': 2.0, 'Si': 2.0}",81.71700258012696,[],NM,False,139,0,"[-0.0, 0.0, 0.0, 0.0, 0.0]",0.0001273908693578,0.01041,0,0.01041,MP,data/source/MP/cleaned/cifs/MP-mp-5452.cif,True,,data/final/MP/graphs/Ce1Cu2Ge0.3Si1.7-MP-mp-5452-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ce2Ge5Ni3,1,0.0,2.0,False,Ce4Ge10Ni6,Ce4Ge10Ni6,0.22,Heavy_fermion,True,Ce20Ge50Ni30,Ce-Ge-Ni,3,Supercon,Ce2Ni3Ge5,MP-mp-1213960,Ce4Ni6Ge10,Ce-Ge-Ni,Ce20Ge50Ni30,I b a m,orthorhombic,5.940528000843085,8.18416497,8.184164968839598,data/final/MP/cifs/Ce2Ge5Ni3-MP-mp-1213960.cif,data/source/MP/raw/cifs/mp-1213960.cif,mp-1213960,0.0,,2019-01-12 15:53:18.859000,8.01431366453875,,,,0.0,7.08265365,520.0,-117.62337288,-5.881168644000001,"{'tags': ['U2Co3Si5', 'Ce2Ni3Ge5']}",-117.62337288,-5.881168644000001,-0.6489958814999994,[],False,[],True,2021-05-12 11:00:35.508000,NM,20,3,mp-1213960,,Ce2Ni3Ge5,"{'functional': 'PBE', 'labels': ['Ce', 'Ni_pv', 'Ge_d'], 'pot_type': 'paw'}","{'Ce': 2.0, 'Ni': 3.0, 'Ge': 5.0}",GGA,mp-1213960,"['mp-1213960', 'mp-1370453', 'mp-1838031']",0.00772365,"{'Ce': 4.0, 'Ni': 6.0, 'Ge': 10.0}",339.6003901560877,[],NM,False,72,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",4.548669685832837e-05,0.00772365,0,0.0154473,MP,data/source/MP/cleaned/cifs/MP-mp-1213960.cif,False,,data/final/MP/graphs/Ce2Ge5Ni3-MP-mp-1213960.json,0,True,mmm,0,0,0,7,0,0,0,0,0,1,0,1.0,False
Ga1Nb0.7Ni2Zr0.3,3,0.15,1.0,True,Ga1Nb0.7Ni2Zr0.3,Ga1Nb1Ni2,0.0,Other,True,Ga25Nb17.5Ni50Zr7.5,Ga-Nb-Ni-Zr,4,Supercon,Ni2Zr0.3Nb0.7Ga1,MP-mp-3539,Nb1Ga1Ni2,Ga-Nb-Ni,Ga25Nb25Ni50,F m -3 m,cubic,4.23622157,4.23622157,4.23622157,data/final/MP/cifs/Ga1Nb0.7Ni2Zr0.3-MP-mp-3539-synth_doped.cif,data/source/MP/raw/cifs/mp-3539.cif,mp-3539,0.0,,2011-05-13 06:27:57,8.64990264907728,10.17188/1206989,"@misc{osti_1206989,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbGaNi2 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1206989"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1670470'}},0.0119209402920557,6.67032754,520.0,-26.02435502,-6.506088755,{'tags': ['Gallium niobium nickel (1/1/2)']},-26.02435502,-6.506088755,-0.3336701493750009,"['xas', 'elasticity', 'bandstructure']",True,"[634779, 103839]",True,2021-05-12 10:56:20.740000,NM,4,8,mp-3539,,NbGaNi2,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Ga_d', 'Ni_pv'], 'pot_type': 'paw'}","{'Nb': 1.0, 'Ga': 1.0, 'Ni': 2.0}",GGA,mp-3539,"['mp-912433', 'mp-929283', 'mp-928920', 'mp-3539', 'mp-1438644', 'mp-1670470', 'mp-1792304', 'mp-1591890']",0.0002159,"{'Nb': 1.0, 'Ga': 1.0, 'Ni': 2.0}",53.75526465834832,[],NM,False,225,0,"[0, 0, 0, 0]",4.016350796004688e-06,0.0002159,0,0.0002159,MP,data/source/MP/cleaned/cifs/MP-mp-3539.cif,True,,data/final/MP/graphs/Ga1Nb0.7Ni2Zr0.3-MP-mp-3539-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Cs0.33W1O3,2,0.0014212115828743,3.0,False,Cs0.99W3O9,Cs1W3O9,0.0,Oxide,True,Cs7.621W23.095O69.28406466512702,Cs-W-O,3,Supercon,Cs0.33W1O3,MP-mp-753119,Cs1W3O9,Cs-W-O,Cs7.692W23.077O69.23076923076923,P 6/m m m,hexagonal,3.887459,7.544746001131922,7.54474626,data/final/MP/cifs/Cs0.33W1O3-MP-mp-753119-synth_doped.cif,data/source/MP/raw/cifs/mp-753119.cif,mp-753119,0.0,,2014-02-13 20:26:51,7.178173970651413,,,{'GGA+U': {'task_id': 'mp-1729896'}},0.0,3.52433864,520.0,-94.0038219,-7.231063223076924,{'tags': []},-94.0038219,-7.231063223076924,-2.24610700561008,['bandstructure'],True,[],True,2021-05-12 10:58:57.544000,FM,13,8,mp-753119,oxide,Cs(WO3)3,"{'functional': 'PBE', 'labels': ['Cs_sv', 'W_pv', 'O'], 'pot_type': 'paw'}","{'Cs': 1.0, 'W': 3.0, 'O': 9.0}",GGA+U,mp-753119,"['mp-763713', 'mp-880554', 'mp-894582', 'mp-753119', 'mp-1400201', 'mp-1729896', 'mp-1882816', 'mp-895340']",0.8712151,"{'Cs': 1.0, 'W': 3.0, 'O': 9.0}",191.6398049642021,[],FM,True,65,1,"[0.0, 0.3, 0.4, 0.4, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0045461072148489,0.8712151,3,0.8712151,MP,data/source/MP/cleaned/cifs/MP-mp-753119.cif,True,,data/final/MP/graphs/Cs0.33W1O3-MP-mp-753119-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ag1Te1,1,0.0,16.0,False,Ag16Te16,Ag16Te16,0.0,Other,True,Ag50Te50,Ag-Te,2,Supercon,Ag1Te1,MP-mp-568761,Ag16Te16,Ag-Te,Ag50Te50,P n m a,orthorhombic,4.742659,8.93363,20.358743,data/final/MP/cifs/Ag1Te1-MP-mp-568761.cif,data/source/MP/raw/cifs/mp-568761.cif,mp-568761,0.2403999999999992,,2013-12-30 17:53:33,7.25271351002929,10.17188/1274681,"@misc{osti_1274681,
    author = ""Persson, Kristin"",
    title = ""Materials Data on AgTe (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1274681"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1684617'}},0.0,4.36235272,520.0,-97.0824907,-3.033827834375,"{'tags': ['Empressite', 'Silver telluride']}",-97.0824907,-3.033827834375,-0.2568993677083329,"['xas', 'bandstructure']",True,[55237],True,2021-05-12 10:57:24.969000,NM,32,7,mp-568761,,AgTe,"{'functional': 'PBE', 'labels': ['Ag', 'Te'], 'pot_type': 'paw'}","{'Ag': 1.0, 'Te': 1.0}",GGA,mp-568761,"['mp-706636', 'mp-568761', 'mp-719530', 'mp-715844', 'mp-1340202', 'mp-1684617', 'mp-1867683']",2.025625e-05,"{'Ag': 16.0, 'Te': 16.0}",862.5828542683535,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.757320220269194e-07,2.025625e-05,0,0.0003241,MP,data/source/MP/cleaned/cifs/MP-mp-568761.cif,False,,data/final/MP/graphs/Ag1Te1-MP-mp-568761.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
B1Ba1Cu1La1O5,1,0.0,2.0,False,B2Ba2Cu2La2O10,B2Ba2Cu2La2O10,0.0,Cuprate,True,B11.111Ba11.111Cu11.111La11.111O55.55555555555556,B-Ba-Cu-La-O,5,Supercon,La1Ba1Cu1B1O5,MP-mp-14970,Ba2La2Cu2B2O10,B-Ba-Cu-La-O,B11.111Ba11.111Cu11.111La11.111O55.55555555555556,P 4 b m,tetragonal,5.597606,5.597606,7.685433,data/final/MP/cifs/B1Ba1Cu1La1O5-MP-mp-14970.cif,data/source/MP/raw/cifs/mp-14970.cif,mp-14970,0.0,,2011-06-05 06:29:15,5.938359404446698,10.17188/1190978,"@misc{osti_1190978,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BaLaCuBO5 (SG:100) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1190978"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1708747'}},0.0018921994032918,4.57945883,520.0,-129.40620668,-7.189233704444444,{'tags': ['Lanthanum barium copper dioxide borate']},-129.40620668,-7.189233704444444,-2.86274688212963,"['xas', 'bandstructure']",True,[75318],True,2021-05-12 10:56:53.126000,NM,18,9,mp-14970,oxide,BaLaCuBO5,"{'functional': 'PBE', 'labels': ['Ba_sv', 'La', 'Cu_pv', 'B', 'O'], 'pot_type': 'paw'}","{'Ba': 1.0, 'La': 1.0, 'Cu': 1.0, 'B': 1.0, 'O': 5.0}",GGA,mp-14970,"['mp-908760', 'mp-924362', 'mp-923794', 'mp-14970', 'mp-1115828', 'mp-1431851', 'mp-1708747', 'mp-1934576', 'mp-1603712']",0.00012205,"{'Ba': 2.0, 'La': 2.0, 'Cu': 2.0, 'B': 2.0, 'O': 10.0}",240.80915494908783,[],NM,False,100,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.0136657804874898e-06,0.00012205,0,0.0002441,MP,data/source/MP/cleaned/cifs/MP-mp-14970.cif,False,,data/final/MP/graphs/B1Ba1Cu1La1O5-MP-mp-14970.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
As1Ca1Cr0.1F1Fe0.9,2,0.0499999999999999,2.0,False,As2Ca2Cr0.2F2Fe1.8,As2Ca2F2Fe2,0.0,Ferrite,True,As25Ca25Cr2.5F25Fe22.5,As-Ca-Cr-F-Fe,5,Supercon,Ca1Fe0.9Cr0.1As1F1,MP-mp-1079859,Ca2Fe2As2F2,As-Ca-F-Fe,As25Ca25F25Fe25,P m m n,orthorhombic,3.933336,3.981276,9.018918,data/final/MP/cifs/As1Ca1Cr0.1F1Fe0.9-MP-mp-1079859-synth_doped.cif,data/source/MP/raw/cifs/mp-1079859.cif,mp-1079859,0.0,,2018-04-16 14:43:21,4.464120586611354,,,{'GGA+U': {'task_id': 'mp-1695365'}},0.2859614887499973,4.27317878,520.0,-41.71531675,-5.21441459375,"{'tags': ['Calcium iron arsenide fluoride', 'High pressure experimental phase']}",-41.71531675,-5.21441459375,-1.632363168125,['bandstructure'],True,[186505],True,2021-05-12 10:58:16.596000,FM,8,6,mp-1079859,,CaFeAsF,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Fe_pv', 'As', 'F'], 'pot_type': 'paw'}","{'Ca': 1.0, 'Fe': 1.0, 'As': 1.0, 'F': 1.0}",GGA+U,mp-1079859,"['mp-1079859', 'mp-1475687', 'mp-1695365', 'mp-1785040', 'mp-1938652', 'mp-1594699']",3.7150606,"{'Ca': 2.0, 'Fe': 2.0, 'As': 2.0, 'F': 2.0}",141.2335160836522,[],FM,True,59,1,"[0.0, 0.0, 3.6, 3.6, 0.0, 0.0, 0.0, 0.0]",0.0526087674231601,3.7150606,2,7.4301212,MP,data/source/MP/cleaned/cifs/MP-mp-1079859.cif,True,,data/final/MP/graphs/As1Ca1Cr0.1F1Fe0.9-MP-mp-1079859-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ba0.553Bi1K0.447O3,2,0.0454666666666666,3.0,False,Ba1.659Bi3K1.341O9,Ba2Bi3K1O9,25.5,Oxide,True,Ba11.06Bi20K8.94O60,Ba-Bi-K-O,4,Supercon,Ba0.553K0.447Bi1O3,MP-mp-1223518,K1Ba2Bi3O9,Ba-Bi-K-O,Ba13.333Bi20K6.667O60,P -3 m 1,trigonal,6.18756400330999,6.187564340000001,7.581401,data/final/MP/cifs/Ba0.553Bi1K0.447O3-MP-mp-1223518-synth_doped.cif,data/source/MP/raw/cifs/mp-1223518.cif,mp-1223518,0.0,,2019-01-12 23:54:06.965000,7.16530091201999,,,{'GGA': {'task_id': 'mp-1729135'}},0.001551682833333,3.46143017,520.0,-85.22271396,-5.681514264,{'tags': []},-85.22271396,-5.681514264,-2.0170414252000004,[],False,[],True,2021-05-12 11:00:52.054000,NM,15,4,mp-1223518,oxide,KBa2(BiO3)3,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Bi', 'O'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 2.0, 'Bi': 3.0, 'O': 9.0}",GGA,mp-1223518,"['mp-1223518', 'mp-1391182', 'mp-1729135', 'mp-1775199']",4.99e-05,"{'K': 1.0, 'Ba': 2.0, 'Bi': 3.0, 'O': 9.0}",251.37352739849624,[],NM,False,164,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.9850936777799505e-07,4.99e-05,0,4.99e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1223518.cif,True,,data/final/MP/graphs/Ba0.553Bi1K0.447O3-MP-mp-1223518-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Al4La1,3,0.1,1.5,False,Al6La1.5,Al6La2,0.0,Other,True,Al80La20,Al-La,2,Supercon,Al4La1,MP-mp-959,La2Al6,Al-La,Al75La25,P 63/m m c,hexagonal,4.672344,6.644005995263407,6.64400688,data/final/MP/cifs/Al4La1-MP-mp-959-synth_doped.cif,data/source/MP/raw/cifs/mp-959.cif,mp-959,0.0,,2011-05-12 22:58:22,4.087710981614599,10.17188/1313359,"@misc{osti_1313359,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaAl3 (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1313359"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701397'}},0.0,7.05748333,520.0,-35.87550749,-4.48443843625,"{'tags': ['Aluminium lanthanum (3/1)', 'Lanthanum aluminide (1/3)']}",-35.87550749,-4.48443843625,-0.4412547874999992,"['xas', 'elasticity', 'bandstructure']",True,"[57934, 658314, 659413, 608279]",True,2021-05-12 10:56:35.166000,NM,8,11,mp-959,,LaAl3,"{'functional': 'PBE', 'labels': ['La', 'Al'], 'pot_type': 'paw'}","{'La': 1.0, 'Al': 3.0}",GGA,mp-959,"['mp-927454', 'mp-911541', 'mp-927865', 'mp-959', 'mp-1079058', 'mp-1080763', 'mp-1252675', 'mp-1419071', 'mp-1701397', 'mp-1829026', 'mp-1591237']",0.0011922,"{'La': 2.0, 'Al': 6.0}",178.6181351412783,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.3349148439569447e-05,0.0011922,0,0.0023844,MP,data/source/MP/cleaned/cifs/MP-mp-959.cif,True,,data/final/MP/graphs/Al4La1-MP-mp-959-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
C4Fe1Y2,1,0.0,2.0,False,C8Fe2Y4,C8Fe2Y4,3.6,Other,True,C57.143Fe14.286Y28.571,C-Fe-Y,3,Supercon,Y2Fe1C4,MP-mp-1103537,Y4Fe2C8,C-Fe-Y,C57.143Fe14.286Y28.571,I b a m,orthorhombic,5.043798,6.621417619999999,6.62141762,data/final/MP/cifs/C4Fe1Y2-MP-mp-1103537.cif,data/source/MP/raw/cifs/mp-1103537.cif,mp-1103537,0.0,,2018-07-18 18:36:05,5.113552661904217,,,,0.0,5.03126399,520.0,-120.62968499,-8.616406070714286,"{'tags': ['Y2FeC4', 'Er2FeC4', 'Yttrium iron carbide (2/1/4)']}",-120.62968499,-8.616406070714286,-0.2863955740476182,[],False,[617900],True,2021-05-12 10:59:31.014000,NM,14,3,mp-1103537,,Y2FeC4,"{'functional': 'PBE', 'labels': ['Y_sv', 'Fe_pv', 'C'], 'pot_type': 'paw'}","{'Y': 2.0, 'Fe': 1.0, 'C': 4.0}",GGA,mp-1103537,"['mp-1103537', 'mp-1830305', 'mp-1986805']",0.0005759,"{'Y': 4.0, 'Fe': 2.0, 'C': 8.0}",182.954222130762,[],NM,False,72,0,"[0.0, 0.0, 0.0, 0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",6.295563920775655e-06,0.0005759,0,0.0011518,MP,data/source/MP/cleaned/cifs/MP-mp-1103537.cif,False,,data/final/MP/graphs/C4Fe1Y2-MP-mp-1103537.json,0,True,mmm,0,0,0,7,0,0,0,0,0,1,0,1.0,False
B2C1Er0.8Ni2Tb0.2,1,0.0,5.0,False,B10C5Er4Ni10Tb1,B10C5Er4Ni10Tb1,6.15,Other,True,B33.333C16.667Er13.333Ni33.333Tb3.333,B-C-Er-Ni-Tb,5,Supercon,Tb0.2Er0.8Ni2B2C1,MP-mp-1217626,Tb1Er4Ni10B10C5,B-C-Er-Ni-Tb,B33.333C16.667Er13.333Ni33.333Tb3.333,C 1 2/m 1,monoclinic,3.5302169999999995,5.802705590000001,16.859565995405593,data/final/MP/cifs/B2C1Er0.8Ni2Tb0.2-MP-mp-1217626.cif,data/source/MP/raw/cifs/mp-1217626.cif,mp-1217626,0.0,,2019-01-12 18:55:52.329000,8.034303798032928,,,,0.0,6.5883024,520.0,-209.29144465,-6.976381488333333,{'tags': []},-209.29144465,-6.976381488333333,-0.5219005100555554,[],False,[],True,2021-05-12 11:00:40.103000,NM,30,2,mp-1217626,,TbEr4Ni10(B2C)5,"{'functional': 'PBE', 'labels': ['Tb_3', 'Er_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Tb': 1.0, 'Er': 4.0, 'Ni': 10.0, 'B': 10.0, 'C': 5.0}",GGA,mp-1217626,"['mp-1217626', 'mp-1810291']",0.0007452,"{'Tb': 1.0, 'Er': 4.0, 'Ni': 10.0, 'B': 10.0, 'C': 5.0}",327.18840751272955,[],NM,False,12,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.2775868059170384e-06,0.0007452,0,0.0007452,MP,data/source/MP/cleaned/cifs/MP-mp-1217626.cif,False,,data/final/MP/graphs/B2C1Er0.8Ni2Tb0.2-MP-mp-1217626.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
Ta0.462Ti0.538,3,0.076,2.0,False,Ta0.924Ti1.076,Ta1Ti1,9.05,Other,True,Ta46.2Ti53.8,Ta-Ti,2,Supercon,Ta0.462Ti0.538,MP-mp-1217887,Ta1Ti1,Ta-Ti,Ta50Ti50,C m m m,orthorhombic,2.83159279,2.83159221,4.659713,data/final/MP/cifs/Ta0.462Ti0.538-MP-mp-1217887-synth_doped.cif,data/source/MP/raw/cifs/mp-1217887.cif,mp-1217887,0.0,,2019-01-12 19:08:56.125000,10.746615063570298,,,{'GGA': {'task_id': 'mp-1675318'}},0.0605979833333325,5.58352202,520.0,-19.63207368,-9.81603684,{'tags': []},-19.63207368,-9.81603684,0.0605979833333325,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,2,5,mp-1217887,,TaTi,"{'functional': 'PBE', 'labels': ['Ta_pv', 'Ti_pv'], 'pot_type': 'paw'}","{'Ta': 1.0, 'Ti': 1.0}",GGA,mp-1217887,"['mp-1217887', 'mp-1425780', 'mp-1675318', 'mp-1790597', 'mp-1611384']",0.0591736,"{'Ta': 1.0, 'Ti': 1.0}",35.35588136467223,[],NM,False,65,0,"[0, 0]",0.0016736564813549,0.0591736,0,0.0591736,MP,data/source/MP/cleaned/cifs/MP-mp-1217887.cif,True,,data/final/MP/graphs/Ta0.462Ti0.538-MP-mp-1217887-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Al0.08B2Mg0.92,3,0.0533333333333333,1.0,True,Al0.08B2Mg0.92,B2Mg1,33.55,Other,True,Al2.667B66.667Mg30.667,Al-B-Mg,3,Supercon,Mg0.92Al0.08B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/Al0.08B2Mg0.92-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/Al0.08B2Mg0.92-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Ca0.2Cu2Nd0.8Tl1O7,3,0.0307692307692307,1.0,True,Ba2Ca0.2Cu2Nd0.8Tl1O7,Ba2Cu2Nd1Tl1O7,0.0,Cuprate,True,Ba15.385Ca1.538Cu15.385Nd6.154Tl7.692O53.84615384615385,Ba-Ca-Cu-Nd-Tl-O,6,Supercon,Tl1Ba2Ca0.2Nd0.8Cu2O7,MP-mp-1228402,Ba2Nd1Tl1Cu2O7,Ba-Cu-Nd-Tl-O,Ba15.385Cu15.385Nd7.692Tl7.692O53.84615384615385,P m m 2,orthorhombic,3.929039,3.948187,12.881668,data/final/MP/cifs/Ba2Ca0.2Cu2Nd0.8Tl1O7-MP-mp-1228402-synth_doped.cif,data/source/MP/raw/cifs/mp-1228402.cif,mp-1228402,0.0,,2019-01-13 04:07:08.147000,7.166137240556236,,,{'GGA': {'task_id': 'mp-1724936'}},0.0,3.43309131,520.0,-77.34822334,-5.949863333846154,{'tags': []},-77.34822334,-5.949863333846154,-2.181104226794872,[],False,[],True,2021-05-12 11:00:59.151000,NM,13,4,mp-1228402,oxide,Ba2NdTlCu2O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Nd_3', 'Tl_d', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Nd': 1.0, 'Tl': 1.0, 'Cu': 2.0, 'O': 7.0}",GGA,mp-1228402,"['mp-1228402', 'mp-1404141', 'mp-1724936', 'mp-1786775']",7.89e-05,"{'Ba': 2.0, 'Nd': 1.0, 'Tl': 1.0, 'Cu': 2.0, 'O': 7.0}",199.82791443014523,[],NM,False,25,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.948397311006388e-07,7.89e-05,0,7.89e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1228402.cif,True,,data/final/MP/graphs/Ba2Ca0.2Cu2Nd0.8Tl1O7-MP-mp-1228402-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,1,0,0,0,1.0,False
B2Ru3U1,1,0.0,1.0,True,B2Ru3U1,B2Ru3U1,0.0,Heavy_fermion,True,B33.333Ru50U16.667,B-Ru-U,3,Supercon,U1Ru3B2,MP-mp-10137,U1B2Ru3,B-Ru-U,B33.333Ru50U16.667,P 6/m m m,hexagonal,2.967956,5.520771997265864,5.520772170000001,data/final/MP/cifs/B2Ru3U1-MP-mp-10137.cif,data/source/MP/raw/cifs/mp-10137.cif,mp-10137,0.0,,2011-05-28 11:21:30,11.930604645649202,10.17188/1186668,"@misc{osti_1186668,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UB2Ru3 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1186668"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1676170'}},0.0,9.35562609,520.0,-55.23794613,-9.206324355,"{'tags': ['Ruthenium uranium boride (3/1/2)', 'Uranium ruthenium boride (1/3/2)']}",-55.23794613,-9.206324355,-0.4607639355555548,"['xas', 'bandstructure']",True,"[44579, 615389, 44578]",True,2021-05-12 10:56:51.169000,FiM,6,13,mp-10137,,UB2Ru3,"{'functional': 'PBE', 'labels': ['U', 'B', 'Ru_pv'], 'pot_type': 'paw'}","{'U': 1.0, 'B': 2.0, 'Ru': 3.0}",GGA,mp-10137,"['mp-910323', 'mp-926175', 'mp-926708', 'mp-10137', 'mp-570862', 'mp-1072572', 'mp-1072719', 'mp-1072750', 'mp-1381357', 'mp-1676170', 'mp-1799096', 'mp-1604580', 'mp-1072739']",1.3799978,"{'U': 1.0, 'B': 2.0, 'Ru': 3.0}",78.34075119217627,[],FiM,True,191,2,"[1.7, 0.0, 0.0, -0.1, -0.1, -0.1]",0.0176153250894257,1.3799978,4,1.3799978,MP,data/source/MP/cleaned/cifs/MP-mp-10137.cif,False,,data/final/MP/graphs/B2Ru3U1-MP-mp-10137.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Cu1La1.913Sr0.087O4,2,0.0248571428571428,1.0,True,Cu1La1.913Sr0.087O4,Cu1La2O4,25.0,Cuprate,True,Cu14.286La27.329Sr1.243O57.142857142857146,Cu-La-Sr-O,4,Supercon,La1.913Sr0.087Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La1.913Sr0.087O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La1.913Sr0.087O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Co1,1,0.0,2.0,False,Co2,Co2,0.0,Other,True,Co100,Co,1,Supercon,Co1,MP-mp-54,Co2,Co,Co100,P 63/m m c,hexagonal,2.500784000122728,2.50078359,4.033331,data/final/MP/cifs/Co1-MP-mp-54.cif,data/source/MP/raw/cifs/mp-54.cif,mp-54,0.0,,2011-05-12 18:08:10,8.95967619453142,10.17188/1263614,"@misc{osti_1263614,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Co (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1263614"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671303'}},0.0,5.36038046,520.0,-14.21663559,-7.108317795,"{'tags': ['Cobalt', 'Cobalt - epsilon', 'Cobalt - beta - HT', 'Cobalt - eta']}",-14.21663559,-7.108317795,0.0,"['surfaces', 'eos', 'bandstructure', 'xas', 'elasticity']",True,"[52935, 191752, 184251, 44990, 426935, 622436, 622438, 76633, 76942, 53806]",True,2021-05-12 10:56:22.739000,FM,2,31,mp-54,,Co,"{'functional': 'PBE', 'labels': ['Co'], 'pot_type': 'paw'}",{'Co': 1.0},GGA,mp-54,"['mp-987206', 'mp-988042', 'mp-54', 'mp-1057473', 'mp-1057511', 'mp-1057598', 'mp-1057628', 'mp-1057659', 'mp-1057760', 'mp-1058516', 'mp-1058625', 'mp-1058535', 'mp-1271070', 'mp-1271181', 'mp-1271188', 'mp-1271193', 'mp-1271253', 'mp-1271435', 'mp-1271673', 'mp-1271539', 'mp-1271600', 'mp-1271556', 'mp-1440682', 'mp-1671303', 'mp-1794903', 'mp-988276', 'mp-1595595', 'mp-1596759', 'mp-1057691', 'mp-1057541', 'mp-1058567']",1.60663785,{'Co': 2.0},21.84473422751273,[],FM,True,194,1,"[1.6, 1.6]",0.1470961224125576,1.60663785,2,3.2132757,MP,data/source/MP/cleaned/cifs/MP-mp-54.cif,False,,data/final/MP/graphs/Co1-MP-mp-54.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ge0.6Si0.4V3,2,0.0499999999999999,2.0,False,Ge1.2Si0.8V6,Ge1Si1V6,7.2,Other,True,Ge15Si10V75,Ge-Si-V,3,Supercon,V3Si0.4Ge0.6,MP-mp-1216453,V6Si1Ge1,Ge-Si-V,Ge12.5Si12.5V75,P m -3,cubic,4.734388,4.734388,4.734388,data/final/MP/cifs/Ge0.6Si0.4V3-MP-mp-1216453-synth_doped.cif,data/source/MP/raw/cifs/mp-1216453.cif,mp-1216453,0.0,,2019-01-12 17:57:35.454000,6.358929418376749,,,{'GGA': {'task_id': 'mp-1754998'}},0.0,7.11494476,520.0,-67.7541736,-8.4692717,{'tags': []},-67.7541736,-8.4692717,-0.4002994131249995,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,FM,8,5,mp-1216453,,V6SiGe,"{'functional': 'PBE', 'labels': ['V_pv', 'Si', 'Ge_d'], 'pot_type': 'paw'}","{'V': 6.0, 'Si': 1.0, 'Ge': 1.0}",GGA,mp-1216453,"['mp-1216453', 'mp-1400373', 'mp-1754998', 'mp-1939394', 'mp-1621955']",1.2825662,"{'V': 6.0, 'Si': 1.0, 'Ge': 1.0}",106.1186071620683,[],FM,True,47,1,"[0.1, 0.2, 0.2, 0.1, 0.2, 0.2, 0.0, 0.0]",0.0120861575014946,1.2825662,6,1.2825662,MP,data/source/MP/cleaned/cifs/MP-mp-1216453.cif,True,,data/final/MP/graphs/Ge0.6Si0.4V3-MP-mp-1216453-synth_doped.json,0,True,m-3,2,0,0,0,0,0,0,1,0,0,0,1.0,False
Mo0.77Si0.23,2,0.04,8.0,False,Mo6.16Si1.84,Mo6Si2,1.7,Other,True,Mo77Si23,Mo-Si,2,Supercon,Mo0.77Si0.23,MP-mp-1275,Si2Mo6,Mo-Si,Mo75Si25,P m -3 n,cubic,4.91941,4.91941,4.91941,data/final/MP/cifs/Mo0.77Si0.23-MP-mp-1275-synth_doped.cif,data/source/MP/raw/cifs/mp-1275.cif,mp-1275,0.0,,2011-05-13 22:36:52,8.812461272463066,10.17188/1189161,"@misc{osti_1189161,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SiMo3 (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189161"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687594'}},0.0,9.39010762,520.0,-78.44059285,-9.80507410625,"{'tags': ['Molydenum silicide (3/1)', 'Molybdenum silicon (3/1)', 'Molybdenum silicide (3/1)']}",-78.44059285,-9.80507410625,-0.3145133287499995,"['xas', 'elasticity', 'bandstructure']",True,"[644409, 644415, 644414, 644398, 35755, 644417, 644408, 644402, 30640]",True,2021-05-12 10:56:12.755000,NM,8,11,mp-1275,,SiMo3,"{'functional': 'PBE', 'labels': ['Si', 'Mo_pv'], 'pot_type': 'paw'}","{'Si': 1.0, 'Mo': 3.0}",GGA,mp-1275,"['mp-907385', 'mp-920787', 'mp-921824', 'mp-1275', 'mp-1125217', 'mp-1132596', 'mp-1261496', 'mp-1439549', 'mp-1687594', 'mp-1802687', 'mp-1594554']",0.0020449,"{'Si': 2.0, 'Mo': 6.0}",119.05264780975064,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",3.435286887978848e-05,0.0020449,0,0.0040898,MP,data/source/MP/cleaned/cifs/MP-mp-1275.cif,True,,data/final/MP/graphs/Mo0.77Si0.23-MP-mp-1275-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Al1Re1,1,0.0,2.0,False,Al2Re2,Al2Re2,0.0,Other,True,Al50Re50,Al-Re,2,Supercon,Al1Re1,MP-mp-1228815,Al2Re2,Al-Re,Al50Re50,P 4/n m m,tetragonal,3.101512,3.101512,5.995543,data/final/MP/cifs/Al1Re1-MP-mp-1228815.cif,data/source/MP/raw/cifs/mp-1228815.cif,mp-1228815,0.0,,2019-01-13 04:29:03.053000,12.276299972751705,,,{'GGA': {'task_id': 'mp-1735710'}},0.0,8.72772399,520.0,-33.64332561,-8.4108314025,{'tags': []},-33.64332561,-8.4108314025,-0.3157798950000003,['bandstructure'],True,[],True,2021-05-12 10:58:49.477000,NM,4,5,mp-1228815,,AlRe,"{'functional': 'PBE', 'labels': ['Al', 'Re_pv'], 'pot_type': 'paw'}","{'Al': 1.0, 'Re': 1.0}",GGA,mp-1228815,"['mp-1228815', 'mp-1418548', 'mp-1735710', 'mp-1784051', 'mp-1616383']",1.95e-05,"{'Al': 2.0, 'Re': 2.0}",57.67338655497386,[],NM,False,129,0,"[0, 0, 0, 0]",6.762217780089171e-07,1.95e-05,0,3.9e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1228815.cif,False,,data/final/MP/graphs/Al1Re1-MP-mp-1228815.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Al2U1,1,0.0,8.0,False,Al16U8,Al16U8,0.0,Heavy_fermion,True,Al66.667U33.333,Al-U,2,Supercon,Al2U1,MP-mp-569744,U8Al16,Al-U,Al66.667U33.333,P 63/m m c,hexagonal,5.59623799684389,5.596237760000001,16.922582,data/final/MP/cifs/Al2U1-MP-mp-569744.cif,data/source/MP/raw/cifs/mp-569744.cif,mp-569744,0.0,,2014-02-24 02:42:16,8.451239932377648,10.17188/1275238,"@misc{osti_1275238,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UAl2 (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1275238"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1766146'}},0.0,9.61750513,520.0,-155.03762414,-6.459901005833333,"{'tags': ['Aluminum uranium (2/1) - HP', 'High pressure experimental phase']}",-155.03762414,-6.459901005833333,-0.199047115833333,"['xas', 'bandstructure']",True,[106979],True,2021-05-12 10:57:24.969000,FM,24,10,mp-569744,,UAl2,"{'functional': 'PBE', 'labels': ['U', 'Al'], 'pot_type': 'paw'}","{'U': 1.0, 'Al': 2.0}",GGA,mp-569744,"['mp-915493', 'mp-931210', 'mp-932193', 'mp-569744', 'mp-1255511', 'mp-1257753', 'mp-1393014', 'mp-1766146', 'mp-1817308', 'mp-1585357']",1.678237775,"{'U': 8.0, 'Al': 16.0}",458.9755877332966,[],FM,True,194,2,"[1.7, 1.5, 1.5, 1.7, 1.5, 1.7, 1.5, 1.7, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0292518873744578,1.678237775,8,13.4259022,MP,data/source/MP/cleaned/cifs/MP-mp-569744.cif,False,,data/final/MP/graphs/Al2U1-MP-mp-569744.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Cu0.96La2Zn0.04O4,2,0.0114285714285714,1.0,True,Cu0.96La2Zn0.04O4,Cu1La2O4,0.0,Cuprate,True,Cu13.714La28.571Zn0.571O57.142857142857146,Cu-La-Zn-O,4,Supercon,La2Cu0.96Zn0.04O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu0.96La2Zn0.04O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu0.96La2Zn0.04O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ce1Pd2Si2,1,0.0,1.0,True,Ce1Pd2Si2,Ce1Pd2Si2,0.421,Heavy_fermion,True,Ce20Pd40Si40,Ce-Pd-Si,3,Supercon,Ce1Pd2Si2,MP-mp-3826,Ce1Si2Pd2,Ce-Pd-Si,Ce20Pd40Si40,I 4/m m m,tetragonal,4.200178000336017,4.200178000336017,5.841839639999999,data/final/MP/cifs/Ce1Pd2Si2-MP-mp-3826.cif,data/source/MP/raw/cifs/mp-3826.cif,mp-3826,0.0,,2011-05-12 23:53:06,7.655210799110225,10.17188/1207495,"@misc{osti_1207495,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ce(SiPd)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207495"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668569'}},0.0,7.50209447,520.0,-31.69403831,-6.338807662,"{'tags': ['Cerium palladium silicide (1/2/2)', 'Cerium palladium silicon (1/2/2)']}",-31.69403831,-6.338807662,-0.8817114989999993,"['xas', 'bandstructure']",True,"[621843, 621847, 621841, 621839, 40913, 52893, 603871, 656123, 621848, 246615, 87147, 621852, 52892]",True,2021-05-12 10:57:06.958000,FM,5,11,mp-3826,,Ce(SiPd)2,"{'functional': 'PBE', 'labels': ['Ce', 'Si', 'Pd'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Si': 2.0, 'Pd': 2.0}",GGA,mp-3826,"['mp-906902', 'mp-921519', 'mp-920515', 'mp-3826', 'mp-1171094', 'mp-1267804', 'mp-1440713', 'mp-1668569', 'mp-1783688', 'mp-1592250', 'mp-1588908']",0.5304136,"{'Ce': 1.0, 'Si': 2.0, 'Pd': 2.0}",88.74626506429088,[],FM,True,139,1,"[0.5, 0.0, 0.0, 0.0, 0.0]",0.0059767427915501,0.5304136,1,0.5304136,MP,data/source/MP/cleaned/cifs/MP-mp-3826.cif,False,,data/final/MP/graphs/Ce1Pd2Si2-MP-mp-3826.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Rh3U1,1,0.0,1.0,True,Rh3U1,Rh3U1,0.0,Heavy_fermion,True,Rh75U25,Rh-U,2,Supercon,Rh3U1,MP-mp-1150,U1Rh3,Rh-U,Rh75U25,P m -3 m,cubic,4.03108,4.03108,4.03108,data/final/MP/cifs/Rh3U1-MP-mp-1150.cif,data/source/MP/raw/cifs/mp-1150.cif,mp-1150,0.0,,2011-05-13 07:48:03,13.86021578629663,10.17188/1188011,"@misc{osti_1188011,
    author = ""Persson, Kristin"",
    title = ""Materials Data on URh3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188011"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688588'}},0.0,9.13373178,520.0,-36.07520726,-9.018801815,"{'tags': ['Uranium rhodium (1/3)', 'Rhodium uranium (3/1)']}",-36.07520726,-9.018801815,-0.6727184099999999,"['xas', 'elasticity', 'bandstructure']",True,"[187479, 650499, 650501, 105962, 650497, 105961, 650502, 650500]",True,2021-05-12 10:56:12.755000,NM,4,12,mp-1150,,URh3,"{'functional': 'PBE', 'labels': ['U', 'Rh_pv'], 'pot_type': 'paw'}","{'U': 1.0, 'Rh': 3.0}",GGA,mp-1150,"['mp-997550', 'mp-997556', 'mp-1150', 'mp-1064001', 'mp-1064115', 'mp-1064193', 'mp-1442089', 'mp-1688588', 'mp-1782379', 'mp-997558', 'mp-1593960', 'mp-1064196']",0.1020204,"{'U': 1.0, 'Rh': 3.0}",65.50346161903572,[],NM,False,221,0,"[0, 0, 0, 0]",0.001557481047236,0.1020204,0,0.1020204,MP,data/source/MP/cleaned/cifs/MP-mp-1150.cif,False,,data/final/MP/graphs/Rh3U1-MP-mp-1150.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Al4Ca1,1,0.0,1.0,True,Al4Ca1,Al4Ca1,0.0,Other,True,Al80Ca20,Al-Ca,2,Supercon,Al4Ca1,MP-mp-1749,Ca1Al4,Al-Ca,Al80Ca20,I 4/m m m,tetragonal,4.351256001202197,4.351256001202197,6.40287376,data/final/MP/cifs/Al4Ca1-MP-mp-1749.cif,data/source/MP/raw/cifs/mp-1749.cif,mp-1749,0.0,,2011-05-12 19:16:31,2.3116986040954672,10.17188/1192533,"@misc{osti_1192533,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CaAl4 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1192533"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695347'}},0.001930132,5.73037115,520.0,-17.96185522,-3.592371044,"{'tags': ['Aluminum calcium (4/1)', 'Aluminium calcium (4/1)']}",-17.96185522,-3.592371044,-0.1947904040000004,"['xas', 'elasticity', 'bandstructure']",True,"[606298, 151189]",True,2021-05-12 10:56:14.760000,NM,5,9,mp-1749,,CaAl4,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Al'], 'pot_type': 'paw'}","{'Ca': 1.0, 'Al': 4.0}",GGA,mp-1749,"['mp-905554', 'mp-919617', 'mp-918643', 'mp-1749', 'mp-1257256', 'mp-1441830', 'mp-1695347', 'mp-1797023', 'mp-1595986']",0.0008887,"{'Ca': 1.0, 'Al': 4.0}",106.31432660161296,[],NM,False,139,0,"[0, 0, 0, 0, 0]",8.359174425570945e-06,0.0008887,0,0.0008887,MP,data/source/MP/cleaned/cifs/MP-mp-1749.cif,False,,data/final/MP/graphs/Al4Ca1-MP-mp-1749.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ba2Cu3Er0.6Pr0.4O7,2,0.0153846153846153,2.0,False,Ba4Cu6Er1.2Pr0.8O14,Ba4Cu6Er1Pr1O14,45.8,Cuprate,True,Ba15.385Cu23.077Er4.615Pr3.077O53.84615384615385,Ba-Cu-Er-Pr-O,5,Supercon,Er0.6Pr0.4Ba2Cu3O7,MP-mp-1228227,Ba4Pr1Er1Cu6O14,Ba-Cu-Er-Pr-O,Ba15.385Cu23.077Er3.846Pr3.846O53.84615384615385,P m m m,orthorhombic,3.874962,3.948902,23.915469,data/final/MP/cifs/Ba2Cu3Er0.6Pr0.4O7-MP-mp-1228227-synth_doped.cif,data/source/MP/raw/cifs/mp-1228227.cif,mp-1228227,0.0,,2019-01-13 03:57:53.906000,6.637342019150472,,,,0.0349924649919799,3.12836665,520.0,-157.60416115,-6.061698505769231,{'tags': []},-157.60416115,-6.061698505769231,-2.1665756071153845,[],False,[],True,2021-05-12 11:00:59.151000,NM,26,3,mp-1228227,oxide,Ba4PrEr(Cu3O7)2,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Pr_3', 'Er_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 4.0, 'Pr': 1.0, 'Er': 1.0, 'Cu': 6.0, 'O': 14.0}",GGA,mp-1228227,"['mp-1228227', 'mp-1340453', 'mp-1836278']",0.0001937,"{'Ba': 4.0, 'Pr': 1.0, 'Er': 1.0, 'Cu': 6.0, 'O': 14.0}",365.9508043254744,[],NM,False,47,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.293061190479701e-07,0.0001937,0,0.0001937,MP,data/source/MP/cleaned/cifs/MP-mp-1228227.cif,True,,data/final/MP/graphs/Ba2Cu3Er0.6Pr0.4O7-MP-mp-1228227-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Si0.3V0.7,3,0.1,8.0,False,Si2.4V5.6,Si2V6,16.95,Other,True,Si30V70,Si-V,2,Supercon,Si0.3V0.7,MP-mp-2567,V6Si2,Si-V,Si25V75,P m -3 n,cubic,4.702381,4.702381,4.702381,data/final/MP/cifs/Si0.3V0.7-MP-mp-2567-synth_doped.cif,data/source/MP/raw/cifs/mp-2567.cif,mp-2567,0.0,,2011-05-13 19:15:43,5.778142190030859,10.17188/1200874,"@misc{osti_1200874,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Si (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1200874"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668672'}},0.0,7.30599425,520.0,-69.05773321,-8.63221665125,{'tags': ['Vanadium silicide (3/1)']},-69.05773321,-8.63221665125,-0.4452085937499994,"['xas', 'elasticity', 'bandstructure']",True,"[652491, 87328, 652522, 652502, 652510, 652520, 600518, 186003, 652507, 652513, 652497, 601150, 652514, 652487, 22412, 652509, 652529, 652532, 652499, 652539, 652537, 652533, 652512, 652538, 652490, 652493, 652494, 652511, 652519, 87329, 652526, 652500]",True,2021-05-12 10:56:18.721000,FM,8,13,mp-2567,,V3Si,"{'functional': 'PBE', 'labels': ['V_pv', 'Si'], 'pot_type': 'paw'}","{'V': 3.0, 'Si': 1.0}",GGA,mp-2567,"['mp-920081', 'mp-906309', 'mp-919083', 'mp-2567', 'mp-1078474', 'mp-1078852', 'mp-1138781', 'mp-1145907', 'mp-1440678', 'mp-1668672', 'mp-1795955', 'mp-1593554', 'mp-1596575']",0.8382519,"{'V': 6.0, 'Si': 2.0}",103.98086881866836,[],FM,True,131,1,"[0.2, 0.3, 0.3, 0.2, 0.3, 0.3, 0.0, 0.0]",0.0161231947669493,0.8382519,6,1.6765038,MP,data/source/MP/cleaned/cifs/MP-mp-2567.cif,True,,data/final/MP/graphs/Si0.3V0.7-MP-mp-2567-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Cu0.2Ru0.8Sr2Y1O6,3,0.0399999999999999,2.0,False,Cu0.4Ru1.6Sr4Y2O12,Ru2Sr4Y2O12,23.0,Cuprate,True,Cu2Ru8Sr20Y10O60,Cu-Ru-Sr-Y-O,5,Supercon,Sr2Y1Ru0.8Cu0.2O6,MP-mp-14430,Sr4Y2Ru2O12,Ru-Sr-Y-O,Ru10Sr20Y10O60,P 1 21/c 1,monoclinic,5.816658,5.885394,8.254861792272742,data/final/MP/cifs/Cu0.2Ru0.8Sr2Y1O6-MP-mp-14430-synth_doped.cif,data/source/MP/raw/cifs/mp-14430.cif,mp-14430,0.0,,2011-06-07 07:34:15,5.420400820723878,10.17188/1190674,"@misc{osti_1190674,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr2YRuO6 (SG:14) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1190674"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1669873'}},0.0,3.25749146,520.0,-146.31379286,-7.315689643000001,"{'tags': ['Distrontium yttrium ruthenium(V) oxide', 'Distrontium yttrium ruthenium hexaoxide']}",-146.31379286,-7.315689643000001,-2.847128272500001,"['xas', 'bandstructure']",True,"[192766, 49500]",True,2021-05-12 10:56:53.126000,FM,20,10,mp-14430,oxide,Sr2YRuO6,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Y_sv', 'Ru_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Y': 1.0, 'Ru': 1.0, 'O': 6.0}",GGA,mp-14430,"['mp-923119', 'mp-922143', 'mp-917338', 'mp-14430', 'mp-1106028', 'mp-1236895', 'mp-1431640', 'mp-1669873', 'mp-1931083', 'mp-1608013']",2.9996044,"{'Sr': 4.0, 'Y': 2.0, 'Ru': 2.0, 'O': 12.0}",282.584622226224,[],FM,True,14,1,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 2.0, 2.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0212297780138839,2.9996044,2,5.9992088,MP,data/source/MP/cleaned/cifs/MP-mp-14430.cif,True,,data/final/MP/graphs/Cu0.2Ru0.8Sr2Y1O6-MP-mp-14430-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,1,0,0,0,1.0,False
B2Lu0.9Ru1Tm0.1,2,0.0499999999999999,4.0,False,B8Lu3.6Ru4Tm0.4,B8Lu4Ru4,8.72,Other,True,B50Lu22.5Ru25Tm2.5,B-Lu-Ru-Tm,4,Supercon,Lu0.9Tm0.1Ru1B2,MP-mp-29239,Lu4B8Ru4,B-Lu-Ru,B50Lu25Ru25,P n m a,orthorhombic,5.262881,5.829858,6.288542,data/final/MP/cifs/B2Lu0.9Ru1Tm0.1-MP-mp-29239-synth_doped.cif,data/source/MP/raw/cifs/mp-29239.cif,mp-29239,0.0,,2014-02-24 06:45:28,10.246997128776938,10.17188/1203618,"@misc{osti_1203618,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LuB2Ru (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1203618"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677301'}},0.0,6.02142224,520.0,-119.30016105,-7.456260065625,"{'tags': ['Lutetium ruthenium(III) boride', 'Lutetium ruthenium boride (1/1/2)']}",-119.30016105,-7.456260065625,-0.6677291364583331,"['xas', 'bandstructure']",True,"[614715, 100774]",True,2021-05-12 10:57:03.017000,NM,16,8,mp-29239,,LuB2Ru,"{'functional': 'PBE', 'labels': ['Lu_3', 'B', 'Ru_pv'], 'pot_type': 'paw'}","{'Lu': 1.0, 'B': 2.0, 'Ru': 1.0}",GGA,mp-29239,"['mp-909473', 'mp-925177', 'mp-924466', 'mp-29239', 'mp-1381674', 'mp-1677301', 'mp-1784701', 'mp-1603819']",4.565e-05,"{'Lu': 4.0, 'B': 8.0, 'Ru': 4.0}",192.9440954509509,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",9.4638812124945e-07,4.565e-05,0,0.0001826,MP,data/source/MP/cleaned/cifs/MP-mp-29239.cif,True,,data/final/MP/graphs/B2Lu0.9Ru1Tm0.1-MP-mp-29239-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Cu1La1.868Sr0.132O4,2,0.0377142857142857,1.0,True,Cu1La1.868Sr0.132O4,Cu1La2O4,35.5,Cuprate,True,Cu14.286La26.686Sr1.886O57.142857142857146,Cu-La-Sr-O,4,Supercon,La1.868Sr0.132Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La1.868Sr0.132O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La1.868Sr0.132O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As2Ba0.698Fe2Na0.302,3,0.0791999999999999,2.0,False,As4Ba1.396Fe4Na0.604,As4Ba1Fe4Na1,18.0,Ferrite,True,As40Ba13.96Fe40Na6.04,As-Ba-Fe-Na,4,Supercon,Ba0.698Na0.302Fe2As2,MP-mp-1227868,Ba1Na1Fe4As4,As-Ba-Fe-Na,As40Ba10Fe40Na10,C m m m,orthorhombic,5.458732000131759,5.462821,6.96934908,data/final/MP/cifs/As2Ba0.698Fe2Na0.302-MP-mp-1227868-synth_doped.cif,data/source/MP/raw/cifs/mp-1227868.cif,mp-1227868,0.0,,2019-01-13 03:39:01.428000,5.934244973483095,,,{'GGA': {'task_id': 'mp-1731957'}},0.0195872770000011,4.30353274,520.0,-59.62394279,-5.962394279,{'tags': []},-59.62394279,-5.962394279,-0.3865939246551718,[],False,[],True,2021-05-12 11:00:59.151000,FM,10,4,mp-1227868,,BaNa(FeAs)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Na_pv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Na': 1.0, 'Fe': 4.0, 'As': 4.0}",GGA,mp-1227868,"['mp-1227868', 'mp-1396889', 'mp-1731957', 'mp-1827521']",0.9949323,"{'Ba': 1.0, 'Na': 1.0, 'Fe': 4.0, 'As': 4.0}",191.22642477974767,[],FM,True,65,1,"[0.0, 0.0, 0.3, 0.3, 0.3, 0.3, 0.0, 0.0, 0.0, 0.0]",0.0052029017493055,0.9949323,4,0.9949323,MP,data/source/MP/cleaned/cifs/MP-mp-1227868.cif,True,,data/final/MP/graphs/As2Ba0.698Fe2Na0.302-MP-mp-1227868-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Nb0.72Pd0.28,3,0.1066666666666666,3.0,False,Nb2.16Pd0.84,Nb2Pd1,1.89,Other,True,Nb72Pd28,Nb-Pd,2,Supercon,Nb0.72Pd0.28,MP-mp-1220678,Nb2Pd1,Nb-Pd,Nb66.667Pd33.333,F m m m,orthorhombic,2.8240621319204884,2.82406213,6.78333523,data/final/MP/cifs/Nb0.72Pd0.28-MP-mp-1220678-synth_doped.cif,data/source/MP/raw/cifs/mp-1220678.cif,mp-1220678,0.0,,2019-01-12 21:29:16.302000,9.433924184220336,,,{'GGA': {'task_id': 'mp-1764792'}},0.0,5.1760297,520.0,-26.07874005,-8.69291335,{'tags': []},-26.07874005,-8.69291335,-0.2320827199999998,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,3,5,mp-1220678,,Nb2Pd,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Pd'], 'pot_type': 'paw'}","{'Nb': 2.0, 'Pd': 1.0}",GGA,mp-1220678,"['mp-1220678', 'mp-1427348', 'mp-1764792', 'mp-1792829', 'mp-1612674']",0.0072664,"{'Nb': 2.0, 'Pd': 1.0}",51.43818256797303,[],NM,False,69,0,"[0, 0, 0]",0.0001412647111005,0.0072664,0,0.0072664,MP,data/source/MP/cleaned/cifs/MP-mp-1220678.cif,True,,data/final/MP/graphs/Nb0.72Pd0.28-MP-mp-1220678-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,0,0,1,1.0,False
Si2Th3,1,0.0,2.0,False,Si4Th6,Si4Th6,0.0,Other,True,Si40Th60,Si-Th,2,Supercon,Si2Th3,MP-mp-1079146,Th6Si4,Si-Th,Si40Th60,P 4/m b m,tetragonal,4.165766,7.839047,7.839047,data/final/MP/cifs/Si2Th3-MP-mp-1079146.cif,data/source/MP/raw/cifs/mp-1079146.cif,mp-1079146,0.0,,2018-04-14 04:25:44,9.759783676976353,,,{'GGA': {'task_id': 'mp-1700016'}},0.0,7.72212293,520.0,-72.7945673,-7.27945673,{'tags': ['Thorium silicide (3/2)']},-72.7945673,-7.27945673,-0.6326161719999988,['bandstructure'],True,"[652398, 652409]",True,2021-05-12 10:58:16.596000,NM,10,7,mp-1079146,,Th3Si2,"{'functional': 'PBE', 'labels': ['Th', 'Si'], 'pot_type': 'paw'}","{'Th': 3.0, 'Si': 2.0}",GGA,mp-1079146,"['mp-1079146', 'mp-1084825', 'mp-1251731', 'mp-1436869', 'mp-1700016', 'mp-1927835', 'mp-1599196']",0.0002061,"{'Th': 6.0, 'Si': 4.0}",255.9890612250175,[],NM,False,127,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.6102250542560143e-06,0.0002061,0,0.0004122,MP,data/source/MP/cleaned/cifs/MP-mp-1079146.cif,False,,data/final/MP/graphs/Si2Th3-MP-mp-1079146.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
H0.81Pd1,3,0.1049723756906077,2.0,False,H1.62Pd2,H2Pd2,1.855,Other,True,H44.751Pd55.249,H-Pd,2,Supercon,H0.81Pd1,MP-mp-1184548,H2Pd2,H-Pd,H50Pd50,P 63 m c,hexagonal,2.968136003881316,2.96813585,5.040799,data/final/MP/cifs/H0.81Pd1-MP-mp-1184548-synth_doped.cif,data/source/MP/raw/cifs/mp-1184548.cif,mp-1184548,0.0,,2019-01-11 12:52:40.348000,9.276812227294194,,,{'GGA': {'task_id': 'mp-1734957'}},0.0,3.52113336,520.0,-17.47744839,-4.3693620975,{'tags': []},-17.47744839,-4.3693620975,-0.0830581699999992,['bandstructure'],True,[],True,2021-05-12 10:58:27.755000,NM,4,5,mp-1184548,,HPd,"{'functional': 'PBE', 'labels': ['H', 'Pd'], 'pot_type': 'paw'}","{'H': 1.0, 'Pd': 1.0}",GGA,mp-1184548,"['mp-1184548', 'mp-1426775', 'mp-1734957', 'mp-1792734', 'mp-1612181']",3.7e-05,"{'H': 2.0, 'Pd': 2.0}",38.45896345503417,[],NM,False,186,0,"[0, 0, 0, 0]",1.924128820749941e-06,3.7e-05,0,7.4e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1184548.cif,True,,data/final/MP/graphs/H0.81Pd1-MP-mp-1184548-synth_doped.json,0,True,6mm,0,5,0,0,0,0,0,1,0,0,0,1.0,False
Al0.7Ge0.3Nb3,3,0.0999999999999999,2.0,False,Al1.4Ge0.6Nb6,Al1Ge1Nb6,18.9,Other,True,Al17.5Ge7.5Nb75,Al-Ge-Nb,3,Supercon,Nb3Al0.7Ge0.3,MP-mp-1220344,Nb6Al1Ge1,Al-Ge-Nb,Al12.5Ge12.5Nb75,P m -3,cubic,5.193789,5.193789,5.193789,data/final/MP/cifs/Al0.7Ge0.3Nb3-MP-mp-1220344-synth_doped.cif,data/source/MP/raw/cifs/mp-1220344.cif,mp-1220344,0.0,,2019-01-12 21:12:22.670000,7.787554520755366,,,{'GGA': {'task_id': 'mp-1754189'}},0.0456705447083347,5.7081774,520.0,-70.77042247,-8.84630280875,{'tags': []},-70.77042247,-8.84630280875,-0.2242485681249988,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,8,5,mp-1220344,,Nb6AlGe,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al', 'Ge_d'], 'pot_type': 'paw'}","{'Nb': 6.0, 'Al': 1.0, 'Ge': 1.0}",GGA,mp-1220344,"['mp-1220344', 'mp-1388432', 'mp-1754189', 'mp-1925908', 'mp-1619029']",0.0004952,"{'Nb': 6.0, 'Al': 1.0, 'Ge': 1.0}",140.10476523412882,[],NM,False,200,0,"[0, 0, 0, 0, 0, 0, 0, 0]",3.534497910706122e-06,0.0004952,0,0.0004952,MP,data/source/MP/cleaned/cifs/MP-mp-1220344.cif,True,,data/final/MP/graphs/Al0.7Ge0.3Nb3-MP-mp-1220344-synth_doped.json,0,True,m-3,2,0,0,0,0,0,0,1,0,0,0,1.0,False
Pd32Zr68,2,0.0266666666666666,0.0294090073529411,False,Pd0.941Zr2,Pd1Zr2,2.24,Other,True,Pd32Zr68,Pd-Zr,2,Supercon,Pd32Zr68,MP-mp-266,Zr2Pd1,Pd-Zr,Pd33.333Zr66.667,I 4/m m m,tetragonal,3.3580019980484703,3.3580019980484703,5.91909309,data/final/MP/cifs/Pd32Zr68-MP-mp-266-synth_doped.cif,data/source/MP/raw/cifs/mp-266.cif,mp-266,0.0,,2011-05-12 21:30:36,7.845685271874635,10.17188/1201202,"@misc{osti_1201202,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Zr2Pd (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201202"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688097'}},0.0,4.68790204,520.0,-23.73938079,-7.91312693,"{'tags': ['Palladium zirconium (1/2)', 'Palladium zironium hydride (1/2/2)']}",-23.73938079,-7.91312693,-0.4880325733333326,"['xas', 'elasticity', 'bandstructure']",True,"[601954, 649146, 105758, 186412, 649158, 109133]",True,2021-05-12 10:56:18.721000,NM,3,12,mp-266,,Zr2Pd,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Pd'], 'pot_type': 'paw'}","{'Zr': 2.0, 'Pd': 1.0}",GGA,mp-266,"['mp-914366', 'mp-977842', 'mp-266', 'mp-1062819', 'mp-1062894', 'mp-1062980', 'mp-1442272', 'mp-1688097', 'mp-1784401', 'mp-992491', 'mp-1591765', 'mp-1062949']",0.0017364,"{'Zr': 2.0, 'Pd': 1.0}",61.13890405598638,[],NM,False,139,0,"[0, 0, 0]",2.8400901632288605e-05,0.0017364,0,0.0017364,MP,data/source/MP/cleaned/cifs/MP-mp-266.cif,True,,data/final/MP/graphs/Pd32Zr68-MP-mp-266-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Nd0.95Ni1Sr0.05O3,2,0.02,4.0,False,Nd3.8Ni4Sr0.2O12,Nd4Ni4O12,0.0,Oxide,True,Nd19Ni20Sr1O60,Nd-Ni-Sr-O,4,Supercon,Nd0.95Sr0.05Ni1O3,MP-mp-22106,Nd4Ni4O12,Nd-Ni-O,Nd20Ni20O60,P n m a,orthorhombic,5.431762,5.495849,7.709429,data/final/MP/cifs/Nd0.95Ni1Sr0.05O3-MP-mp-22106-synth_doped.cif,data/source/MP/raw/cifs/mp-22106.cif,mp-22106,0.0,,2014-02-19 13:18:08,7.242194237367626,,,{'GGA+U': {'task_id': 'mp-1701351'}},0.0,3.99854667,520.0,-131.66600273,-6.5833001365,"{'tags': ['Neodymium nickel(III) oxide', 'Dineodymium niccolate', 'Neodymium niccolate', 'Neodymium nickel oxide', 'Neodymium niccolate(III)']}",-131.66600273,-6.5833001365,-2.425267555500001,"['xas', 'bandstructure']",True,"[155746, 67725, 164825, 67724, 416213, 78319, 164562, 155747, 67723, 69788, 155748, 67722, 24875, 416212]",True,2021-05-12 10:57:01.079000,FM,20,11,mp-22106,oxide,NdNiO3,"{'functional': 'PBE', 'labels': ['Nd_3', 'Ni_pv', 'O'], 'pot_type': 'paw'}","{'Nd': 1.0, 'Ni': 1.0, 'O': 3.0}",GGA+U,mp-22106,"['mp-919926', 'mp-918860', 'mp-905914', 'mp-602303', 'mp-25591', 'mp-1189695', 'mp-22106', 'mp-1416651', 'mp-1701351', 'mp-1930748', 'mp-1599871']",1.00005245,"{'Nd': 4.0, 'Ni': 4.0, 'O': 12.0}",230.14298278419733,[],FM,True,62,1,"[0.0, 0.0, 0.0, 0.0, 1.4, 1.4, 1.4, 1.4, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0173814111193255,1.00005245,4,4.0002098,MP,data/source/MP/cleaned/cifs/MP-mp-22106.cif,True,,data/final/MP/graphs/Nd0.95Ni1Sr0.05O3-MP-mp-22106-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
As1Co0.2Fe0.8Pr1O1,3,0.0999999999999999,2.0,False,As2Co0.4Fe1.6Pr2O2,As2Fe2Pr2O2,2.0,Ferrite,True,As25Co5Fe20Pr25O25,As-Co-Fe-Pr-O,5,Supercon,Pr1Fe0.8Co0.2As1O1,MP-mp-22491,Pr2Fe2As2O2,As-Fe-Pr-O,As25Fe25Pr25O25,P 4/n m m,tetragonal,4.094889,4.094889,9.258722,data/final/MP/cifs/As1Co0.2Fe0.8Pr1O1-MP-mp-22491-synth_doped.cif,data/source/MP/raw/cifs/mp-22491.cif,mp-22491,0.0,,2014-02-25 19:17:30,6.153806906111091,,,{'GGA+U': {'task_id': 'mp-1695715'}},0.3808778432291664,4.12348168,520.0,-51.7633941,-6.4704242625,{'tags': ['Praseodymium iron arsenic oxide (1/1/1/1)']},-51.7633941,-6.4704242625,-1.491677511249999,"['xas', 'bandstructure']",True,"[162830, 162833, 246832, 90316, 422000, 236649, 236648, 602491]",True,2021-05-12 10:57:10.838000,FM,8,8,mp-22491,oxide,PrFeAsO,"{'functional': 'PBE', 'labels': ['Pr_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Pr': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-22491,"['mp-510622', 'mp-1079608', 'mp-1079857', 'mp-22491', 'mp-1476145', 'mp-1695715', 'mp-1778524', 'mp-1596397']",3.7947681,"{'Pr': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",155.25132378854377,[],FM,True,129,1,"[0.0, 0.0, 3.5, 3.5, 0.0, 0.0, 0.0, 0.0]",0.0488854846116297,3.7947681,2,7.5895362,MP,data/source/MP/cleaned/cifs/MP-mp-22491.cif,True,,data/final/MP/graphs/As1Co0.2Fe0.8Pr1O1-MP-mp-22491-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Cu1La1.9Sm0.1O4,2,0.0285714285714285,1.0,True,Cu1La1.9Sm0.1O4,Cu1La2O4,25.0,Cuprate,True,Cu14.286La27.143Sm1.429O57.142857142857146,Cu-La-Sm-O,4,Supercon,La1.9Sm0.1Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La1.9Sm0.1O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La1.9Sm0.1O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Hf2Rh1,1,0.0,8.0,False,Hf16Rh8,Hf16Rh8,1.72,Other,True,Hf66.667Rh33.333,Hf-Rh,2,Supercon,Hf2Rh1,MP-mp-1190626,Hf16Rh8,Hf-Rh,Hf66.667Rh33.333,F d -3 m,cubic,8.73318735,8.73318735,8.73318735,data/final/MP/cifs/Hf2Rh1-MP-mp-1190626.cif,data/source/MP/raw/cifs/mp-1190626.cif,mp-1190626,0.0,,2019-01-11 21:05:24.155000,12.971358640413262,,,{'GGA': {'task_id': 'mp-1733895'}},0.0,5.49642639,520.0,-232.96665862,-9.706944109166669,"{'tags': ['Hafnium rhodium hydride (2/1/2)', 'Hafnium rhodium (2/1)']}",-232.96665862,-9.706944109166669,-0.6140489191666667,['bandstructure'],True,"[638817, 638828, 638176]",True,2021-05-12 10:58:33.577000,NM,24,7,mp-1190626,,Hf2Rh,"{'functional': 'PBE', 'labels': ['Hf_pv', 'Rh_pv'], 'pot_type': 'paw'}","{'Hf': 2.0, 'Rh': 1.0}",GGA,mp-1190626,"['mp-1190626', 'mp-1190702', 'mp-1191570', 'mp-1417341', 'mp-1733895', 'mp-1821090', 'mp-1610834']",0.00010295,"{'Hf': 16.0, 'Rh': 8.0}",470.9809419862248,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.7486907145896544e-06,0.00010295,0,0.0008236,MP,data/source/MP/cleaned/cifs/MP-mp-1190626.cif,False,,data/final/MP/graphs/Hf2Rh1-MP-mp-1190626.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ge0.5Pt0.5,1,0.0,8.0,False,Ge4Pt4,Ge4Pt4,0.8999999999999999,Other,True,Ge50Pt50,Ge-Pt,2,Supercon,Ge0.5Pt0.5,MP-mp-542640,Ge4Pt4,Ge-Pt,Ge50Pt50,P n m a,orthorhombic,3.730364,5.872017,6.185417,data/final/MP/cifs/Ge0.5Pt0.5-MP-mp-542640.cif,data/source/MP/raw/cifs/mp-542640.cif,mp-542640,0.0,,2014-02-26 02:08:59,13.12468517614386,10.17188/1266616,"@misc{osti_1266616,
    author = ""Persson, Kristin"",
    title = ""Materials Data on GePt (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1266616"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696516'}},0.0,6.19801068,520.0,-46.52493786,-5.8156172325,"{'tags': ['Platinum germanide (1/1)', 'Platinum germanium (1/1)', 'Platinum(IV) germanide', 'Germanium platinum (1/1)']}",-46.52493786,-5.8156172325,-0.46864945,"['xas', 'elasticity', 'bandstructure']",True,"[659799, 2624, 637633, 76625, 52127]",True,2021-05-12 10:56:22.739000,NM,8,8,mp-542640,,GePt,"{'functional': 'PBE', 'labels': ['Ge_d', 'Pt'], 'pot_type': 'paw'}","{'Ge': 1.0, 'Pt': 1.0}",GGA,mp-542640,"['mp-926831', 'mp-910515', 'mp-926295', 'mp-542640', 'mp-1426838', 'mp-1696516', 'mp-1929566', 'mp-1590723']",0.0005883,"{'Ge': 4.0, 'Pt': 4.0}",135.49007998286643,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.736806119162065e-05,0.0005883,0,0.0023532,MP,data/source/MP/cleaned/cifs/MP-mp-542640.cif,False,,data/final/MP/graphs/Ge0.5Pt0.5-MP-mp-542640.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
P1Rh0.05Ru0.95Zr1,2,0.0333333333333333,4.0,False,P4Rh0.2Ru3.8Zr4,P4Ru4Zr4,6.15,Other,True,P33.333Rh1.667Ru31.667Zr33.333,P-Rh-Ru-Zr,4,Supercon,Zr1Ru0.95Rh0.05P1,MP-mp-22268,Zr4P4Ru4,P-Ru-Zr,P33.333Ru33.333Zr33.333,P n m a,orthorhombic,3.896771,6.476559,7.378435,data/final/MP/cifs/P1Rh0.05Ru0.95Zr1-MP-mp-22268-synth_doped.cif,data/source/MP/raw/cifs/mp-22268.cif,mp-22268,0.0,,2014-02-22 18:40:36,7.963823777103373,10.17188/1197495,"@misc{osti_1197495,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrPRu (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197495"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677547'}},0.0,7.91938263,520.0,-106.40582437,-8.867152030833333,"{'tags': ['Ruthenium zirconium phosphide (1/1/1)', 'Zirconium ruthenium phosphide (1/1/1)']}",-106.40582437,-8.867152030833333,-1.1220211002777785,"['xas', 'elasticity', 'bandstructure']",True,"[648038, 30727]",True,2021-05-12 10:56:16.728000,NM,12,9,mp-22268,,ZrPRu,"{'functional': 'PBE', 'labels': ['Zr_sv', 'P', 'Ru_pv'], 'pot_type': 'paw'}","{'Zr': 1.0, 'P': 1.0, 'Ru': 1.0}",GGA,mp-22268,"['mp-921696', 'mp-907212', 'mp-920689', 'mp-22268', 'mp-1102635', 'mp-1442687', 'mp-1677547', 'mp-1785321', 'mp-1602314']",3.01e-05,"{'Zr': 4.0, 'P': 4.0, 'Ru': 4.0}",186.21448765818843,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.46566233992512e-07,3.01e-05,0,0.0001204,MP,data/source/MP/cleaned/cifs/MP-mp-22268.cif,True,,data/final/MP/graphs/P1Rh0.05Ru0.95Zr1-MP-mp-22268-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ho5Ir4Si10,1,0.0,2.0,False,Ho10Ir8Si20,Ho10Ir8Si20,0.0,Other,True,Ho26.316Ir21.053Si52.632,Ho-Ir-Si,3,Supercon,Ho5Ir4Si10,MP-mp-1205124,Ho10Si20Ir8,Ho-Ir-Si,Ho26.316Ir21.053Si52.632,P 4/m b m,tetragonal,4.260128,12.617723,12.617723,data/final/MP/cifs/Ho5Ir4Si10-MP-mp-1205124.cif,data/source/MP/raw/cifs/mp-1205124.cif,mp-1205124,0.0,,2019-01-12 08:41:07.924000,9.178059258794256,,,,0.0016194365789479,7.03714164,520.0,-259.03457087,-6.816699233421052,"{'tags': ['Sc5Co4Si10', 'Holmium iridium silicide (5/4/10)', 'Ho5Ir4Si10 lt']}",-259.03457087,-6.816699233421052,-0.8572831160526307,[],False,[639362],True,2021-05-12 11:00:17.126000,NM,38,2,mp-1205124,,Ho5(Si5Ir2)2,"{'functional': 'PBE', 'labels': ['Ho_3', 'Si', 'Ir'], 'pot_type': 'paw'}","{'Ho': 5.0, 'Si': 10.0, 'Ir': 4.0}",GGA,mp-1205124,"['mp-1205124', 'mp-1343461']",0.0003316,"{'Ho': 10.0, 'Si': 20.0, 'Ir': 8.0}",678.2419160696596,[],NM,False,38,0,"[0.0, 0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",9.77822196308913e-07,0.0003316,0,0.0006632,MP,data/source/MP/cleaned/cifs/MP-mp-1205124.cif,False,,data/final/MP/graphs/Ho5Ir4Si10-MP-mp-1205124.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ba1.8Cu4Sr0.2Y1O8,3,0.0266666666666666,1.0,True,Ba1.8Cu4Sr0.2Y1O8,Ba2Cu4Y1O8,77.7,Cuprate,True,Ba12Cu26.667Sr1.333Y6.667O53.333333333333336,Ba-Cu-Sr-Y-O,5,Supercon,Y1Ba1.8Sr0.2Cu4O8,MP-mp-6790,Ba2Y1Cu4O8,Ba-Cu-Y-O,Ba13.333Cu26.667Y6.667O53.333333333333336,C m m m,orthorhombic,3.889922,3.899603999537882,13.88942687,data/final/MP/cifs/Ba1.8Cu4Sr0.2Y1O8-MP-mp-6790-synth_doped.cif,data/source/MP/raw/cifs/mp-6790.cif,mp-6790,0.0,,2011-05-16 03:21:24,5.936250568336678,10.17188/1283441,"@misc{osti_1283441,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Y(CuO2)4 (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1283441"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686864'}},0.0,3.31391536,520.0,-91.58381472,-6.105587648,"{'tags': ['Yttrium barium copper oxide (1/2/4/8)', 'High pressure experimental phase']}",-91.58381472,-6.105587648,-2.0529924817777783,"['xas', 'bandstructure']",True,"[72261, 85273, 74251, 400273, 85277, 85275, 400280, 67632, 85272, 67631, 83920, 66613, 85279, 400277, 75689, 74259, 85278, 85280, 66603, 94265, 400276, 88873, 71417, 75712, 97052, 66605, 72258, 85281, 85274, 400279, 66604, 69698]",True,2021-05-12 10:57:34.594000,NM,15,10,mp-6790,oxide,Ba2Y(CuO2)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-6790,"['mp-1000664', 'mp-6790', 'mp-1007136', 'mp-1237713', 'mp-1440937', 'mp-1686864', 'mp-1834179', 'mp-1011883', 'mp-1590064', 'mp-1590433']",0.0004643,"{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",208.60454115924333,[],NM,False,65,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.225742533790601e-06,0.0004643,0,0.0004643,MP,data/source/MP/cleaned/cifs/MP-mp-6790.cif,True,,data/final/MP/graphs/Ba1.8Cu4Sr0.2Y1O8-MP-mp-6790-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Co0.5Ni0.5Ta2,1,0.0,2.0,False,Co1Ni1Ta4,Co1Ni1Ta4,0.91,Other,True,Co16.667Ni16.667Ta66.667,Co-Ni-Ta,3,Supercon,Co0.5Ni0.5Ta2,MP-mp-1217989,Ta4Co1Ni1,Co-Ni-Ta,Co16.667Ni16.667Ta66.667,I 4 2 2,tetragonal,4.914918004317558,5.007188659542556,5.00718866,data/final/MP/cifs/Co0.5Ni0.5Ta2-MP-mp-1217989.cif,data/source/MP/raw/cifs/mp-1217989.cif,mp-1217989,0.0,,2019-01-12 19:14:01.472000,14.93623818036501,,,{'GGA': {'task_id': 'mp-1735881'}},0.0,6.07701143,520.0,-61.78313005,-10.297188341666669,{'tags': []},-61.78313005,-10.297188341666669,-0.2439275091666672,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,6,5,mp-1217989,,Ta4CoNi,"{'functional': 'PBE', 'labels': ['Ta_pv', 'Co', 'Ni_pv'], 'pot_type': 'paw'}","{'Ta': 4.0, 'Co': 1.0, 'Ni': 1.0}",GGA,mp-1217989,"['mp-1217989', 'mp-1399183', 'mp-1735881', 'mp-1795951', 'mp-1626478']",0.0046616,"{'Ta': 4.0, 'Co': 1.0, 'Ni': 1.0}",93.5448159322461,[],NM,False,97,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",4.983279889477111e-05,0.0046616,0,0.0046616,MP,data/source/MP/cleaned/cifs/MP-mp-1217989.cif,False,,data/final/MP/graphs/Co0.5Ni0.5Ta2-MP-mp-1217989.json,0,True,422,0,0,0,0,4,0,0,0,0,1,0,1.0,False
Ba2Cu3Lu0.7Pr0.3O7,3,0.0461538461538461,1.0,True,Ba2Cu3Lu0.7Pr0.3O7,Ba2Cu3Lu1O7,73.5,Cuprate,True,Ba15.385Cu23.077Lu5.385Pr2.308O53.84615384615385,Ba-Cu-Lu-Pr-O,5,Supercon,Lu0.7Pr0.3Ba2Cu3O7,MP-mp-20324,Ba2Lu1Cu3O7,Ba-Cu-Lu-O,Ba15.385Cu23.077Lu7.692O53.84615384615385,P m m m,orthorhombic,3.818903,3.898469,11.801871,data/final/MP/cifs/Ba2Cu3Lu0.7Pr0.3O7-MP-mp-20324-synth_doped.cif,data/source/MP/raw/cifs/mp-20324.cif,mp-20324,0.0,,2014-02-22 11:14:13,7.109359718686039,10.17188/1195446,"@misc{osti_1195446,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2LuCu3O7 (SG:47) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195446"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1705063'}},0.0403003135096193,3.25942075,520.0,-79.03066785,-6.079282142307692,{'tags': ['Lutetium barium copper oxide (1/2/3/7)']},-79.03066785,-6.079282142307692,-2.1959560480769227,['bandstructure'],True,[161972],True,2021-05-12 10:58:49.477000,NM,13,8,mp-20324,oxide,Ba2LuCu3O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Lu_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Lu': 1.0, 'Cu': 3.0, 'O': 7.0}",GGA,mp-20324,"['mp-991834', 'mp-992281', 'mp-20324', 'mp-1421391', 'mp-1705063', 'mp-1786269', 'mp-993914', 'mp-1597533']",0.0008559,"{'Ba': 2.0, 'Lu': 1.0, 'Cu': 3.0, 'O': 7.0}",175.70477973623184,[],NM,False,47,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.871239139224771e-06,0.0008559,0,0.0008559,MP,data/source/MP/cleaned/cifs/MP-mp-20324.cif,True,,data/final/MP/graphs/Ba2Cu3Lu0.7Pr0.3O7-MP-mp-20324-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
H15Th4,1,0.0,2.0,False,H30Th8,H30Th8,8.025,Other,True,H78.947Th21.053,H-Th,2,Supercon,H15Th4,MP-mp-24202,Th8H30,H-Th,H78.947Th21.053,I -4 3 d,cubic,7.902835151751935,7.90283515,7.90283515,data/final/MP/cifs/H15Th4-MP-mp-24202.cif,data/source/MP/raw/cifs/mp-24202.cif,mp-24202,0.0,,2014-02-25 12:51:03,8.244965732021765,10.17188/1199974,"@misc{osti_1199974,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Th4H15 (SG:220) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199974"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1752729'}},0.0,6.08480305,520.0,-178.63001013,-4.700789740263158,"{'tags': ['Thorium hydride (4/15)', 'Thorium deuteride (4/15)']}",-178.63001013,-4.700789740263158,-0.6028253363157895,"['xas', 'bandstructure']",True,"[180582, 638495, 10420, 41803, 638496, 24686]",True,2021-05-12 10:57:01.079000,NM,38,10,mp-24202,,Th4H15,"{'functional': 'PBE', 'labels': ['Th', 'H'], 'pot_type': 'paw'}","{'Th': 4.0, 'H': 15.0}",GGA,mp-24202,"['mp-949799', 'mp-950612', 'mp-939323', 'mp-24202', 'mp-1198310', 'mp-1203824', 'mp-1388574', 'mp-1752729', 'mp-1837070', 'mp-1621247']",0.0387948,"{'Th': 8.0, 'H': 30.0}",379.95037490351,[],NM,False,220,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0002042098261377,0.0387948,0,0.0775896,MP,data/source/MP/cleaned/cifs/MP-mp-24202.cif,False,,data/final/MP/graphs/H15Th4-MP-mp-24202.json,0,True,-43m,5,0,0,0,0,0,0,0,0,1,0,1.0,False
B2Sc1,1,0.0,1.0,True,B2Sc1,B2Sc1,0.0,Other,True,B66.667Sc33.333,B-Sc,2,Supercon,B2Sc1,MP-mp-2252,Sc1B2,B-Sc,B66.667Sc33.333,P 6/m m m,hexagonal,3.145748000545588,3.14574741,3.524157,data/final/MP/cifs/B2Sc1-MP-mp-2252.cif,data/source/MP/raw/cifs/mp-2252.cif,mp-2252,0.0,,2011-05-12 18:05:10,3.660544064375377,10.17188/1198760,"@misc{osti_1198760,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ScB2 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198760"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671834'}},0.0,6.09145789,520.0,-22.20776733,-7.40258911,{'tags': ['Scandium boride (1/2)']},-22.20776733,-7.40258911,-0.8388382277777767,"['xas', 'elasticity', 'bandstructure']",True,"[44491, 615420, 249114, 165123, 615426, 615421]",True,2021-05-12 10:56:16.728000,NM,3,11,mp-2252,,ScB2,"{'functional': 'PBE', 'labels': ['Sc_sv', 'B'], 'pot_type': 'paw'}","{'Sc': 1.0, 'B': 2.0}",GGA,mp-2252,"['mp-990303', 'mp-990106', 'mp-990396', 'mp-990379', 'mp-2252', 'mp-1140033', 'mp-1442113', 'mp-1671834', 'mp-1794027', 'mp-990398', 'mp-1596103']",0.0018146,"{'Sc': 1.0, 'B': 2.0}",30.201855763624497,[],NM,False,191,0,"[0, 0, 0]",6.008240070418214e-05,0.0018146,0,0.0018146,MP,data/source/MP/cleaned/cifs/MP-mp-2252.cif,False,,data/final/MP/graphs/B2Sc1-MP-mp-2252.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Co1O2,1,0.0,4.0,False,Co4O8,Co4O8,0.0,Oxide,True,Co33.333O66.66666666666667,Co-O,2,Supercon,Co1O2,MP-mvc-14149,Co4O8,Co-O,Co33.333O66.66666666666667,I 4/m,tetragonal,2.874828000646255,6.867488450382776,6.867488449999999,data/final/MP/cifs/Co1O2-MP-mvc-14149.cif,data/source/MP/raw/cifs/mvc-14149.cif,mvc-14149,0.5902000000000001,,2014-01-23 18:04:54,4.65879523482134,10.17188/1319050,"@misc{osti_1319050,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CoO2 (SG:87) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1319050"",
    place = ""United States"",
    year = ""2014"",
    month = ""9"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-1744182'}},0.0,0.70589266,520.0,-68.93854684,-5.744878903333333,{'tags': []},-68.93854684,-5.744878903333333,-1.0807989683333343,"['diel', 'xas', 'elasticity', 'bandstructure']",True,[],True,2021-05-12 10:56:37.246000,FM,12,7,mvc-14149,oxide,CoO2,"{'functional': 'PBE', 'labels': ['Co', 'O'], 'pot_type': 'paw'}","{'Co': 1.0, 'O': 2.0}",GGA+U,mvc-14149,"['mvc-15010', 'mvc-14149', 'mp-1116784', 'mp-1400906', 'mp-1744182', 'mp-1862717', 'mp-1586453']",0.99999945,"{'Co': 4.0, 'O': 8.0}",129.64392937709047,[],FM,True,87,1,"[0.9, 0.9, 0.9, 0.9, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0308537223394807,0.99999945,4,3.9999978,MP,data/source/MP/cleaned/cifs/MP-mvc-14149.cif,False,,data/final/MP/graphs/Co1O2-MP-mvc-14149.json,0,True,4/m,0,0,0,0,3,0,0,0,0,1,0,1.0,False
B2Mg0.9Zn0.1,3,0.0666666666666666,1.0,True,B2Mg0.9Zn0.1,B2Mg1,38.4,Other,True,B66.667Mg30Zn3.333,B-Mg-Zn,3,Supercon,Mg0.9Zn0.1B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B2Mg0.9Zn0.1-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B2Mg0.9Zn0.1-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Nd1Os4Sb12,1,0.0,1.0,True,Nd1Os4Sb12,Nd1Os4Sb12,0.0,Other,True,Nd5.882Os23.529Sb70.588,Nd-Os-Sb,3,Supercon,Nd1Os4Sb12,MP-mp-3569,Nd1Sb12Os4,Nd-Os-Sb,Nd5.882Os23.529Sb70.588,I m -3,cubic,8.167780031810668,8.16778003,8.16778003,data/final/MP/cifs/Nd1Os4Sb12-MP-mp-3569.cif,data/source/MP/raw/cifs/mp-3569.cif,mp-3569,0.0,,2011-05-15 09:46:32,9.367536389864428,10.17188/1207030,"@misc{osti_1207030,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nd(Sb3Os)4 (SG:204) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207030"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1708829'}},0.013820645588237,7.21783923,520.0,-101.96267892,-5.997804642352941,"{'tags': ['Neodymium osmium tetraantimonide (1/4/3)', 'Neodymium osmium antimonide (1/4/12)']}",-101.96267892,-5.997804642352941,-0.1610032829411773,"['xas', 'bandstructure']",True,"[183088, 79929, 645672, 156470]",True,2021-05-12 10:57:06.958000,NM,17,9,mp-3569,,Nd(Sb3Os)4,"{'functional': 'PBE', 'labels': ['Nd_3', 'Sb', 'Os_pv'], 'pot_type': 'paw'}","{'Nd': 1.0, 'Sb': 12.0, 'Os': 4.0}",GGA,mp-3569,"['mp-1007579', 'mp-1001206', 'mp-3569', 'mp-1105478', 'mp-1434752', 'mp-1708829', 'mp-1815393', 'mp-1012335', 'mp-1583964']",0.0032687,"{'Nd': 1.0, 'Sb': 12.0, 'Os': 4.0}",419.4596679489652,[],NM,False,204,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",7.792644322594791e-06,0.0032687,0,0.0032687,MP,data/source/MP/cleaned/cifs/MP-mp-3569.cif,False,,data/final/MP/graphs/Nd1Os4Sb12-MP-mp-3569.json,0,True,m-3,2,0,0,0,0,0,0,0,0,1,0,1.0,False
Ag7N1O11,1,0.0,1.0,True,Ag7N1O11,Ag7N1O11,1.03625,Oxide,True,Ag36.842N5.263O57.89473684210527,Ag-N-O,3,Supercon,Ag7N1O11,MP-mp-37695,Ag7N1O11,Ag-N-O,Ag36.842N5.263O57.89473684210527,F m m 2,orthorhombic,7.056526105473534,7.05652611,7.08496826,data/final/MP/cifs/Ag7N1O11-MP-mp-37695.cif,data/source/MP/raw/cifs/mp-37695.cif,mp-37695,0.0,,2014-02-19 15:29:40,6.156879202333303,10.17188/1207397,"@misc{osti_1207397,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ag7NO11 (SG:42) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207397"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-948221'}},0.0,1.54359318,520.0,-84.83376852,-4.464935185263158,{'tags': []},-84.83376852,-4.464935185263158,-0.5157268692982462,"['xas', 'bandstructure']",True,[],True,2021-05-12 10:57:06.958000,NM,19,6,mp-37695,oxide,Ag7NO11,"{'functional': 'PBE', 'labels': ['Ag', 'N', 'O'], 'pot_type': 'paw'}","{'Ag': 7.0, 'N': 1.0, 'O': 11.0}",GGA,mp-37695,"['mp-948412', 'mp-948221', 'mp-937934', 'mp-37695', 'mp-1368057', 'mp-1932981']",0.0114985,"{'Ag': 7.0, 'N': 1.0, 'O': 11.0}",254.8918142035208,[],NM,False,42,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.511129569197901e-05,0.0114985,0,0.0114985,MP,data/source/MP/cleaned/cifs/MP-mp-37695.cif,False,,data/final/MP/graphs/Ag7N1O11-MP-mp-37695.json,0,True,mm2,0,0,0,6,0,0,0,0,0,0,1,1.0,False
As2Cu1,1,0.0,2.0,False,As4Cu2,As4Cu2,0.0,Other,True,As66.667Cu33.333,As-Cu,2,Supercon,As2Cu1,MP-mp-21859,Cu2As4,As-Cu,As66.667Cu33.333,P n n m,orthorhombic,3.820723,4.805974,5.960606,data/final/MP/cifs/As2Cu1-MP-mp-21859.cif,data/source/MP/raw/cifs/mp-21859.cif,mp-21859,0.0,,2015-02-14 23:33:43,6.474916065526641,10.17188/1197203,"@misc{osti_1197203,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CuAs2 (SG:58) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197203"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698316'}},0.0846026266666672,5.41957338,520.0,-26.3272712,-4.387878533333333,{'tags': ['Copper arsenide (1/2)']},-26.3272712,-4.387878533333333,0.0846026266666667,"['xas', 'elasticity', 'bandstructure']",True,[610303],True,2021-05-12 10:56:16.728000,NM,6,8,mp-21859,,CuAs2,"{'functional': 'PBE', 'labels': ['Cu_pv', 'As'], 'pot_type': 'paw'}","{'Cu': 1.0, 'As': 2.0}",GGA,mp-21859,"['mp-944355', 'mp-933480', 'mp-943706', 'mp-21859', 'mp-1435307', 'mp-1698316', 'mp-1805515', 'mp-1589625']",1.55e-06,"{'Cu': 2.0, 'As': 4.0}",109.45040813025584,[],NM,False,58,0,"[0, 0, 0, 0, 0, 0]",2.8323329743190365e-08,1.55e-06,0,3.1e-06,MP,data/source/MP/cleaned/cifs/MP-mp-21859.cif,False,,data/final/MP/graphs/As2Cu1-MP-mp-21859.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
B2Ir3Yb1,1,0.0,1.0,True,B2Ir3Yb1,B2Ir3Yb1,0.0,Heavy_fermion,True,B33.333Ir50Yb16.667,B-Ir-Yb,3,Supercon,Yb1Ir3B2,MP-mp-1025071,Yb1B2Ir3,B-Ir-Yb,B33.333Ir50Yb16.667,P 6/m m m,hexagonal,2.928812,5.630758001263107,5.63075846,data/final/MP/cifs/B2Ir3Yb1-MP-mp-1025071.cif,data/source/MP/raw/cifs/mp-1025071.cif,mp-1025071,0.0,,2016-10-01 02:55:07,15.926628481861565,10.17188/1355275,"@article{osti_1355275,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YbB2Ir3 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1355275"",
    place = ""United States"",
    year = ""2017"",
    month = ""5""
}
",{'GGA': {'task_id': 'mp-1696159'}},0.0,7.2328516,520.0,-45.36337783,-7.560562971666666,"{'tags': ['YbIr3B2', 'Ytterbium iridium boride (1/3/2)', 'ErIr3B2']}",-45.36337783,-7.560562971666666,-0.658282458055556,"['bandstructure', 'elasticity']",True,[614581],True,2021-05-12 10:56:10.715000,NM,6,5,mp-1025071,,YbB2Ir3,"{'functional': 'PBE', 'labels': ['Yb_2', 'B', 'Ir'], 'pot_type': 'paw'}","{'Yb': 1.0, 'B': 2.0, 'Ir': 3.0}",GGA,mp-1025071,"['mp-1025071', 'mp-1424729', 'mp-1696159', 'mp-1798378', 'mp-1589744']",0.0015543,"{'Yb': 1.0, 'B': 2.0, 'Ir': 3.0}",80.41848722315031,[],NM,False,191,0,"[0, 0, 0, 0, 0, 0]",1.9327645342134203e-05,0.0015543,0,0.0015543,MP,data/source/MP/cleaned/cifs/MP-mp-1025071.cif,False,,data/final/MP/graphs/B2Ir3Yb1-MP-mp-1025071.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ag0.5Ba1Si1.5,1,0.0,8.0,False,Ag4Ba8Si12,Ag4Ba8Si12,1.21,Other,True,Ag16.667Ba33.333Si50,Ag-Ba-Si,3,Supercon,Ba1Ag0.5Si1.5,MP-mp-9867,Ba8Si12Ag4,Ag-Ba-Si,Ag16.667Ba33.333Si50,F d d d,orthorhombic,8.663309998578674,8.670365129928047,10.875500388858086,data/final/MP/cifs/Ag0.5Ba1Si1.5-MP-mp-9867.cif,data/source/MP/raw/cifs/mp-9867.cif,mp-9867,0.0617,,2011-06-08 08:03:15,4.776502639573697,10.17188/1316758,"@misc{osti_1316758,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Si3Ag (SG:70) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1316758"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1751844'}},0.0,4.01838082,520.0,-102.27191518,-4.261329799166666,{'tags': ['Barium silver silicide (4/2/6)']},-102.27191518,-4.261329799166666,-0.4369231786111112,"['xas', 'bandstructure']",True,[410520],True,2021-05-12 10:57:57.486000,NM,24,9,mp-9867,,Ba2Si3Ag,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Si', 'Ag'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Si': 3.0, 'Ag': 1.0}",GGA,mp-9867,"['mp-925388', 'mp-9867', 'mp-924802', 'mp-909737', 'mp-1156413', 'mp-1399439', 'mp-1751844', 'mp-1889788', 'mp-1622280']",3.94e-05,"{'Ba': 8.0, 'Si': 12.0, 'Ag': 4.0}",649.0977397436878,[],NM,False,70,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.427985653782006e-07,3.94e-05,0,0.0001576,MP,data/source/MP/cleaned/cifs/MP-mp-9867.cif,False,,data/final/MP/graphs/Ag0.5Ba1Si1.5-MP-mp-9867.json,0,True,mmm,0,0,0,7,0,0,0,0,0,0,1,1.0,False
La1Ni1O3,1,0.0,2.0,False,La2Ni2O6,La2Ni2O6,0.0,Oxide,True,La20Ni20O60,La-Ni-O,3,Supercon,La1Ni1O3,MP-mp-19339,La2Ni2O6,La-Ni-O,La20Ni20O60,R -3 c,trigonal,5.44052788,5.44033618,5.4404415,data/final/MP/cifs/La1Ni1O3-MP-mp-19339.cif,data/source/MP/raw/cifs/mp-19339.cif,mp-19339,0.0,,2013-06-07 05:29:36,6.934778690951409,10.17188/1194344,"@misc{osti_1194344,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaNiO3 (SG:167) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1194344"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-922720'}},0.0,6.77725286,520.0,-66.6331008,-6.66331008,"{'tags': ['Lanthanum nickel(III) oxide', 'Perovskite', 'Lanthanum niccolate(III)']}",-66.6331008,-6.66331008,-2.4717047200000004,"['xas', 'bandstructure']",True,"[173477, 93919, 67714, 91042, 67717, 187088, 67715, 187087, 84933, 67716]",True,2021-05-12 10:56:57.051000,FM,10,20,mp-19339,oxide,LaNiO3,"{'functional': 'PBE', 'labels': ['La', 'Ni_pv', 'O'], 'pot_type': 'paw'}","{'La': 1.0, 'Ni': 1.0, 'O': 3.0}",GGA+U,mp-19339,"['mp-923508', 'mp-908376', 'mp-922720', 'mp-611435', 'mp-19339', 'mp-1080688', 'mp-1092303', 'mp-1298178', 'mp-1298459', 'mp-1277409', 'mp-1284150', 'mp-1294225', 'mp-1283222', 'mp-1281199', 'mp-1279122', 'mp-1438619', 'mp-1668024', 'mp-1804253', 'mp-1876577', 'mp-1593937']",1.00042415,"{'La': 2.0, 'Ni': 2.0, 'O': 6.0}",117.6168836965564,[],FM,True,167,1,"[0.0, 0.0, 1.4, 1.4, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0170115738244013,1.00042415,2,2.0008483,MP,data/source/MP/cleaned/cifs/MP-mp-19339.cif,False,,data/final/MP/graphs/La1Ni1O3-MP-mp-19339.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Mg1Y1,1,0.0,1.0,True,Mg1Y1,Mg1Y1,0.0,Other,True,Mg50Y50,Mg-Y,2,Supercon,Mg1Y1,MP-mp-615,Y1Mg1,Mg-Y,Mg50Y50,P m -3 m,cubic,3.802465,3.802465,3.802465,data/final/MP/cifs/Mg1Y1-MP-mp-615.cif,data/source/MP/raw/cifs/mp-615.cif,mp-615,0.0,,2011-05-12 18:23:19,3.4193335917896244,10.17188/1273003,"@misc{osti_1273003,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YMg (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1273003"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688091'}},0.0,3.14248116,520.0,-8.28803227,-4.144016135,"{'tags': ['Yttrium magnesium (1/1)', 'Magnesium yttrium (1/1)']}",-8.28803227,-4.144016135,-0.1106405533333338,"['xas', 'elasticity', 'bandstructure']",True,"[104889, 642907, 642906, 163698, 161738, 642913, 104890, 642904]",True,2021-05-12 10:56:27.046000,NM,2,7,mp-615,,YMg,"{'functional': 'PBE', 'labels': ['Y_sv', 'Mg_pv'], 'pot_type': 'paw'}","{'Y': 1.0, 'Mg': 1.0}",GGA,mp-615,"['mp-992217', 'mp-990506', 'mp-615', 'mp-1440734', 'mp-1688091', 'mp-1782462', 'mp-993848']",0.0472096,"{'Y': 1.0, 'Mg': 1.0}",54.97885308394291,[],NM,False,221,0,"[0, 0]",0.0008586865194863,0.0472096,0,0.0472096,MP,data/source/MP/cleaned/cifs/MP-mp-615.cif,False,,data/final/MP/graphs/Mg1Y1-MP-mp-615.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Te4Ti3,1,0.0,1.0,True,Te4Ti3,Te4Ti3,0.0,Chevrel,True,Te57.143Ti42.857,Te-Ti,2,Supercon,Te4Ti3,MP-mp-15669,Ti3Te4,Te-Ti,Te57.143Ti42.857,C 1 2/m 1,monoclinic,3.813840002100453,7.08072973,7.45433552,data/final/MP/cifs/Te4Ti3-MP-mp-15669.cif,data/source/MP/raw/cifs/mp-15669.cif,mp-15669,0.0,,2011-05-28 20:30:14,6.386267658048584,10.17188/1191310,"@misc{osti_1191310,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ti3Te4 (SG:12) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191310"",
    place = ""United States"",
    year = ""2015"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700120'}},0.0,7.24959725,520.0,-41.2885204,-5.898360057142858,{'tags': ['Titanium telluride (3/4)']},-41.2885204,-5.898360057142858,-0.9595486614285724,"['xas', 'elasticity', 'bandstructure']",True,"[653076, 43412]",True,2021-05-12 10:56:12.755000,NM,7,8,mp-15669,,Ti3Te4,"{'functional': 'PBE', 'labels': ['Ti_pv', 'Te'], 'pot_type': 'paw'}","{'Ti': 3.0, 'Te': 4.0}",GGA,mp-15669,"['mp-942485', 'mp-921044', 'mp-942871', 'mp-15669', 'mp-1431775', 'mp-1700120', 'mp-1851639', 'mp-1593582']",0.0858585,"{'Ti': 3.0, 'Te': 4.0}",170.0514711009322,[],NM,False,12,0,"[0, 0, 0, 0, 0, 0, 0]",0.0005048971316986,0.0858585,0,0.0858585,MP,data/source/MP/cleaned/cifs/MP-mp-15669.cif,False,,data/final/MP/graphs/Te4Ti3-MP-mp-15669.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
Bi2Ca1Cu2I1Sr2O8,1,0.0,2.0,False,Bi4Ca2Cu4I2Sr4O16,Bi4Ca2Cu4I2Sr4O16,58.0,Cuprate,True,Bi12.5Ca6.25Cu12.5I6.25Sr12.5O50,Bi-Ca-Cu-I-Sr-O,6,Supercon,Bi2Sr2Ca1Cu2I1O8,MP-mp-1209124,Sr4Ca2Cu4Bi4I2O16,Bi-Ca-Cu-I-Sr-O,Bi12.5Ca6.25Cu12.5I6.25Sr12.5O50,P m n a,orthorhombic,5.21493,5.481615,19.120353,data/final/MP/cifs/Bi2Ca1Cu2I1Sr2O8-MP-mp-1209124.cif,data/source/MP/raw/cifs/mp-1209124.cif,mp-1209124,0.0,,2019-01-12 11:54:40.777000,6.168902819730907,,,,0.092595106494147,3.5592228,520.0,-175.92812723,-5.4977539759375,{'tags': ['Sr2CaCu2Bi2IO8']},-175.92812723,-5.4977539759375,-1.9605183883333333,[],False,[],True,2021-05-12 11:00:21.818000,NM,32,3,mp-1209124,oxide,Sr2CaCu2Bi2IO8,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Cu_pv', 'Bi', 'I', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'I': 1.0, 'O': 8.0}",GGA,mp-1209124,"['mp-1209124', 'mp-1361882', 'mp-1929533']",0.31195235,"{'Sr': 4.0, 'Ca': 2.0, 'Cu': 4.0, 'Bi': 4.0, 'I': 2.0, 'O': 16.0}",546.5789712906787,[],NM,False,53,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0011414721984761,0.31195235,0,0.6239047,MP,data/source/MP/cleaned/cifs/MP-mp-1209124.cif,False,,data/final/MP/graphs/Bi2Ca1Cu2I1Sr2O8-MP-mp-1209124.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Cu0.67Zn0.33,2,0.0066666666666667,3.0,False,Cu2.01Zn0.99,Cu2Zn1,0.0,Other,True,Cu67Zn33,Cu-Zn,2,Supercon,Cu0.67Zn0.33,MP-mp-1215401,Zn1Cu2,Cu-Zn,Cu66.667Zn33.333,P -3 m 1,trigonal,2.637535995478726,2.63753584,6.260468,data/final/MP/cifs/Cu0.67Zn0.33-MP-mp-1215401-synth_doped.cif,data/source/MP/raw/cifs/mp-1215401.cif,mp-1215401,0.0,,2019-01-12 17:05:45.772000,8.475159839059959,,,{'GGA': {'task_id': 'mp-1766147'}},0.0275906699999999,5.65465841,520.0,-9.55682059,-3.185606863333333,{'tags': []},-9.55682059,-3.185606863333333,-0.0328878799999999,['bandstructure'],True,[],True,2021-05-12 10:58:39.488000,NM,3,5,mp-1215401,,ZnCu2,"{'functional': 'PBE', 'labels': ['Zn', 'Cu_pv'], 'pot_type': 'paw'}","{'Zn': 1.0, 'Cu': 2.0}",GGA,mp-1215401,"['mp-1215401', 'mp-1423510', 'mp-1766147', 'mp-1792659', 'mp-1610171']",1e-05,"{'Zn': 1.0, 'Cu': 2.0}",37.71674362840358,[],NM,False,164,0,"[0, 0, 0]",2.651342358323119e-07,1e-05,0,1e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1215401.cif,True,,data/final/MP/graphs/Cu0.67Zn0.33-MP-mp-1215401-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ca1.998Cl2Cu1Na0.002O2,2,0.0005714285714285,1.0,True,Ca1.998Cl2Cu1Na0.002O2,Ca2Cl2Cu1O2,0.0,Cuprate,True,Ca28.543Cl28.571Cu14.286Na0.029O28.571428571428573,Ca-Cl-Cu-Na-O,5,Supercon,Ca1.998Na0.002Cu1Cl2O2,MP-mp-23143,Ca2Cu1Cl2O2,Ca-Cl-Cu-O,Ca28.571Cl28.571Cu14.286O28.571428571428573,I 4/m m m,tetragonal,3.88024600076171,3.880246000761709,8.12907187,data/final/MP/cifs/Ca1.998Cl2Cu1Na0.002O2-MP-mp-23143-synth_doped.cif,data/source/MP/raw/cifs/mp-23143.cif,mp-23143,0.0,,2014-02-21 09:50:06,3.554337150605878,10.17188/1199263,"@misc{osti_1199263,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ca2Cu(ClO)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199263"",
    place = ""United States"",
    year = ""2016"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700223'}},0.0191527683333321,4.19679796,520.0,-35.95348475,-5.136212107142858,"{'tags': ['Dicalcium copper dioxide dichloride', 'Dicalcium dichlorodioxocuprate']}",-35.95348475,-5.136212107142858,-2.407440427142858,"['xas', 'elasticity', 'bandstructure']",True,"[1027, 83117, 41581]",True,2021-05-12 10:56:16.728000,NM,7,8,mp-23143,oxide,Ca2Cu(ClO)2,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Cu_pv', 'Cl', 'O'], 'pot_type': 'paw'}","{'Ca': 2.0, 'Cu': 1.0, 'Cl': 2.0, 'O': 2.0}",GGA,mp-23143,"['mp-992231', 'mp-990553', 'mp-23143', 'mp-1436301', 'mp-1700223', 'mp-1803462', 'mp-993865', 'mp-1592909']",0.0134962,"{'Ca': 2.0, 'Cu': 1.0, 'Cl': 2.0, 'O': 2.0}",115.21141865211318,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001171429026557,0.0134962,0,0.0134962,MP,data/source/MP/cleaned/cifs/MP-mp-23143.cif,True,,data/final/MP/graphs/Ca1.998Cl2Cu1Na0.002O2-MP-mp-23143-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Cu2Sn1Ti1,1,0.0,1.0,True,Cu2Sn1Ti1,Cu2Sn1Ti1,0.0,Other,True,Cu50Sn25Ti25,Cu-Sn-Ti,3,Supercon,Cu2Ti1Sn1,MP-mp-1206917,Ti1Cu2Sn1,Cu-Sn-Ti,Cu50Sn25Ti25,F m -3 m,cubic,4.4394879,4.439487899999999,4.439487899999999,data/final/MP/cifs/Cu2Sn1Ti1-MP-mp-1206917.cif,data/source/MP/raw/cifs/mp-1206917.cif,mp-1206917,0.0,,2019-01-12 10:07:53.440000,7.881766586625503,,,{'GGA': {'task_id': 'mp-1766721'}},0.1148503229687509,8.96942625,520.0,-20.34862964,-5.08715741,"{'tags': ['b.c.c. atom arrangement', 'Cu2TiSn', 'Cu2MnAl']}",-20.34862964,-5.08715741,-0.0612881070833326,['bandstructure'],True,[],True,2021-05-12 10:58:39.488000,NM,4,5,mp-1206917,,TiCu2Sn,"{'functional': 'PBE', 'labels': ['Ti_pv', 'Cu_pv', 'Sn_d'], 'pot_type': 'paw'}","{'Ti': 1.0, 'Cu': 2.0, 'Sn': 1.0}",GGA,mp-1206917,"['mp-1206917', 'mp-1430790', 'mp-1766721', 'mp-1782400', 'mp-1616125']",0.0316617,"{'Ti': 1.0, 'Cu': 2.0, 'Sn': 1.0}",61.87050095810274,[],NM,False,225,0,"[0, 0, 0, 0]",0.0005117414520603,0.0316617,0,0.0316617,MP,data/source/MP/cleaned/cifs/MP-mp-1206917.cif,False,,data/final/MP/graphs/Cu2Sn1Ti1-MP-mp-1206917.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ba0.8K0.2Sb2Ti2O1,3,0.0666666666666666,1.0,True,Ba0.8K0.2Sb2Ti2O1,Ba1Sb2Ti2O1,3.0,Oxide,True,Ba13.333K3.333Sb33.333Ti33.333O16.666666666666668,Ba-K-Sb-Ti-O,5,Supercon,Ba0.8K0.2Ti2Sb2O1,MP-mp-1070806,Ba1Ti2Sb2O1,Ba-Sb-Ti-O,Ba16.667Sb33.333Ti33.333O16.666666666666668,P 4/m m m,tetragonal,4.113474,4.113474,8.312382,data/final/MP/cifs/Ba0.8K0.2Sb2Ti2O1-MP-mp-1070806-synth_doped.cif,data/source/MP/raw/cifs/mp-1070806.cif,mp-1070806,0.0,,2018-03-22 04:02:04,5.8154485533321445,,,{'GGA': {'task_id': 'mp-1702174'}},0.0,5.89751533,520.0,-39.14932631,-6.524887718333333,{'tags': []},-39.14932631,-6.524887718333333,-1.5507346602777776,['bandstructure'],True,"[430061, 237789, 430060]",True,2021-05-12 10:58:14.654000,NM,6,16,mp-1070806,oxide,BaTi2Sb2O,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ti_pv', 'Sb', 'O'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Ti': 2.0, 'Sb': 2.0, 'O': 1.0}",GGA,mp-1070806,"['mp-1071055', 'mp-1071068', 'mp-1071083', 'mp-1071088', 'mp-1070806', 'mp-1071124', 'mp-1070846', 'mp-1070900', 'mp-1071137', 'mp-1423542', 'mp-1702174', 'mp-1785425', 'mp-1588663', 'mp-1070899', 'mp-1071129', 'mp-1071119']",0.001055,"{'Ba': 1.0, 'Ti': 2.0, 'Sb': 2.0, 'O': 1.0}",140.65105900950408,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0]",7.500832254158225e-06,0.001055,0,0.001055,MP,data/source/MP/cleaned/cifs/MP-mp-1070806.cif,True,,data/final/MP/graphs/Ba0.8K0.2Sb2Ti2O1-MP-mp-1070806-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ce1Pt0.2Ru1.8,3,0.1333333333333333,2.0,False,Ce2Pt0.4Ru3.6,Ce2Ru4,3.4,Heavy_fermion,True,Ce33.333Pt6.667Ru60,Ce-Pt-Ru,3,Supercon,Ce1Pt0.2Ru1.8,MP-mp-607,Ce2Ru4,Ce-Ru,Ce33.333Ru66.667,F d -3 m,cubic,5.35903077,5.35903077,5.35903077,data/final/MP/cifs/Ce1Pt0.2Ru1.8-MP-mp-607-synth_doped.cif,data/source/MP/raw/cifs/mp-607.cif,mp-607,0.0,,2011-05-13 22:34:26,10.444470046690055,10.17188/1277529,"@misc{osti_1277529,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeRu2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277529"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686879'}},0.0,8.61419203,520.0,-50.66413619,-8.444022698333333,"{'tags': ['Cerium ruthenium (1/2)', 'Cerium ruthenium hydride (1/2/4)']}",-50.66413619,-8.444022698333333,-0.2833998766666663,"['xas', 'elasticity', 'bandstructure']",True,"[621326, 656077, 621978, 621973, 621980, 621984, 102277, 621972, 621976, 621979, 604113, 621977, 621982, 621983, 102276, 656078]",True,2021-05-12 10:56:27.046000,NM,6,14,mp-607,,CeRu2,"{'functional': 'PBE', 'labels': ['Ce', 'Ru_pv'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Ru': 2.0}",GGA,mp-607,"['mp-928203', 'mp-912221', 'mp-928809', 'mp-607', 'mp-1071462', 'mp-1071593', 'mp-1071613', 'mp-1077792', 'mp-1440763', 'mp-1686879', 'mp-1803198', 'mp-1591928', 'mp-1591642', 'mp-1071635']",1.005e-05,"{'Ce': 2.0, 'Ru': 4.0}",108.82877852828122,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",1.846937939745105e-07,1.005e-05,0,2.01e-05,MP,data/source/MP/cleaned/cifs/MP-mp-607.cif,True,,data/final/MP/graphs/Ce1Pt0.2Ru1.8-MP-mp-607-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Cu0.95La2Zn0.05O4,2,0.0142857142857142,1.0,True,Cu0.95La2Zn0.05O4,Cu1La2O4,0.0,Cuprate,True,Cu13.571La28.571Zn0.714O57.142857142857146,Cu-La-Zn-O,4,Supercon,La2Sr0Cu0.95Zn0.05O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu0.95La2Zn0.05O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu0.95La2Zn0.05O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Nb2.934Sn1V0.066,2,0.0329999999999999,2.0,False,Nb5.868Sn2V0.132,Nb6Sn2,17.7,Other,True,Nb73.35Sn25V1.65,Nb-Sn-V,3,Supercon,Nb2.934V0.066Sn1,MP-mp-1326,Nb6Sn2,Nb-Sn,Nb75Sn25,P m -3 n,cubic,5.334611,5.334611,5.334611,data/final/MP/cifs/Nb2.934Sn1V0.066-MP-mp-1326-synth_doped.cif,data/source/MP/raw/cifs/mp-1326.cif,mp-1326,0.0,,2011-05-14 09:51:48,8.694218121896231,10.17188/1189484,"@misc{osti_1189484,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Sn (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189484"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668415'}},0.0,6.59372491,520.0,-69.93787048,-8.74223381,{'tags': ['Niobium tin (3/1)']},-69.93787048,-8.74223381,-0.163862066250001,"['xas', 'elasticity', 'bandstructure']",True,"[105230, 645503, 645489, 105231, 645498, 645485, 645474, 645496, 645480, 645488, 645482, 645487, 645500, 645493, 645477, 645484, 645502, 645483, 150878, 645479, 645481, 645486, 645473]",True,2021-05-12 10:56:12.755000,NM,8,9,mp-1326,,Nb3Sn,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Sn_d'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Sn': 1.0}",GGA,mp-1326,"['mp-930046', 'mp-913770', 'mp-930577', 'mp-1326', 'mp-1440651', 'mp-1668415', 'mp-1880085', 'mp-1594093', 'mp-1594507']",0.62023085,"{'Nb': 6.0, 'Sn': 2.0}",151.81275738025872,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0081709977567491,0.62023085,0,1.2404617,MP,data/source/MP/cleaned/cifs/MP-mp-1326.cif,True,,data/final/MP/graphs/Nb2.934Sn1V0.066-MP-mp-1326-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Fe0.1Ni0.9Zr2,3,0.0666666666666666,2.0,False,Fe0.2Ni1.8Zr4,Ni2Zr4,2.65,Other,True,Fe3.333Ni30Zr66.667,Fe-Ni-Zr,3,Supercon,Fe0.1Ni0.9Zr2,MP-mp-328,Zr4Ni2,Ni-Zr,Ni33.333Zr66.667,I 4/m c m,tetragonal,5.262569995425936,5.300086679397286,5.30008668,data/final/MP/cifs/Fe0.1Ni0.9Zr2-MP-mp-328-synth_doped.cif,data/source/MP/raw/cifs/mp-328.cif,mp-328,0.0,,2011-05-13 23:00:52,7.189329355994663,10.17188/1206385,"@misc{osti_1206385,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Zr2Ni (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1206385"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704571'}},0.0,5.05377097,520.0,-47.68946569,-7.948244281666667,{'tags': ['Nickel zirconium (1/2)']},-47.68946569,-7.948244281666667,-0.3230649683333328,"['xas', 'elasticity', 'bandstructure']",True,"[656070, 647167, 102805, 105479]",True,2021-05-12 10:56:20.740000,NM,6,11,mp-328,,Zr2Ni,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Ni_pv'], 'pot_type': 'paw'}","{'Zr': 2.0, 'Ni': 1.0}",GGA,mp-328,"['mp-918996', 'mp-919988', 'mp-906163', 'mp-604722', 'mp-328', 'mp-1076983', 'mp-1205320', 'mp-1413019', 'mp-1704571', 'mp-1802467', 'mp-1592827']",0.00134705,"{'Zr': 4.0, 'Ni': 2.0}",111.39417752247834,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0]",2.4185285621920005e-05,0.00134705,0,0.0026941,MP,data/source/MP/cleaned/cifs/MP-mp-328.cif,True,,data/final/MP/graphs/Fe0.1Ni0.9Zr2-MP-mp-328-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As1Co0.109Fe0.891Na1,3,0.0726666666666666,2.0,False,As2Co0.218Fe1.782Na2,As2Fe2Na2,0.0,Ferrite,True,As33.333Co3.633Fe29.7Na33.333,As-Co-Fe-Na,4,Supercon,Na1Fe0.891Co0.109As1,MP-mp-22152,Na2Fe2As2,As-Fe-Na,As33.333Fe33.333Na33.333,P 4/n m m,tetragonal,3.923688,3.923688,6.918844,data/final/MP/cifs/As1Co0.109Fe0.891Na1-MP-mp-22152-synth_doped.cif,data/source/MP/raw/cifs/mp-22152.cif,mp-22152,0.0,,2014-02-21 10:51:39,4.793908463406792,10.17188/1197381,"@misc{osti_1197381,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NaFeAs (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197381"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704688'}},0.0,4.10723066,520.0,-30.57538864,-5.095898106666667,{'tags': ['Sodium iron arsenide']},-30.57538864,-5.095898106666667,-0.2786807238505749,"['xas', 'elasticity', 'bandstructure']",True,"[163144, 163143]",True,2021-05-12 10:56:16.728000,FM,6,8,mp-22152,,NaFeAs,"{'functional': 'PBE', 'labels': ['Na_pv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Na': 1.0, 'Fe': 1.0, 'As': 1.0}",GGA,mp-22152,"['mp-906352', 'mp-920130', 'mp-919102', 'mp-22152', 'mp-1413190', 'mp-1704688', 'mp-1797758', 'mp-1594769']",0.0693226,"{'Na': 2.0, 'Fe': 2.0, 'As': 2.0}",106.5178694490858,[],FM,True,129,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.0]",0.0013016144682303,0.0693226,2,0.1386452,MP,data/source/MP/cleaned/cifs/MP-mp-22152.cif,True,,data/final/MP/graphs/As1Co0.109Fe0.891Na1-MP-mp-22152-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B2C1Ni2Y1,1,0.0,1.0,True,B2C1Ni2Y1,B2C1Ni2Y1,14.17727273,Other,True,B33.333C16.667Ni33.333Y16.667,B-C-Ni-Y,4,Supercon,Y1Ni2B2C1,MP-mp-6576,Y1Ni2B2C1,B-C-Ni-Y,B33.333C16.667Ni33.333Y16.667,I 4/m m m,tetragonal,3.548790000501972,3.548790000501972,5.76144136,data/final/MP/cifs/B2C1Ni2Y1-MP-mp-6576.cif,data/source/MP/raw/cifs/mp-6576.cif,mp-6576,0.0,,2011-05-13 05:21:43,6.099730998852292,10.17188/1281366,"@misc{osti_1281366,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281366"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688230'}},0.0,6.81083016,520.0,-43.677878,-7.279646333333333,{'tags': []},-43.677878,-7.279646333333333,-0.5109282141666659,"['xas', 'bandstructure']",True,"[75816, 89142, 83231, 79574, 41549]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6576,,YNi2B2C,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6576,"['mp-6576', 'mp-1007054', 'mp-1000583', 'mp-1439516', 'mp-1688230', 'mp-1794280', 'mp-1011792', 'mp-1597064']",0.0006603,"{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.3152437079014,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",1.010943177297096e-05,0.0006603,0,0.0006603,MP,data/source/MP/cleaned/cifs/MP-mp-6576.cif,False,,data/final/MP/graphs/B2C1Ni2Y1-MP-mp-6576.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ho1Ir1Si1,1,0.0,4.0,False,Ho4Ir4Si4,Ho4Ir4Si4,0.0,Other,True,Ho33.333Ir33.333Si33.333,Ho-Ir-Si,3,Supercon,Ho1Ir1Si1,MP-mp-22222,Ho4Si4Ir4,Ho-Ir-Si,Ho33.333Ir33.333Si33.333,P n m a,orthorhombic,4.231347,6.838905,7.435665,data/final/MP/cifs/Ho1Ir1Si1-MP-mp-22222.cif,data/source/MP/raw/cifs/mp-22222.cif,mp-22222,0.0,,2014-02-21 14:14:21,11.891792990787042,10.17188/1197440,"@misc{osti_1197440,
    author = ""Persson, Kristin"",
    title = ""Materials Data on HoSiIr (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197440"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698229'}},0.0,6.89553063,520.0,-88.34215257,-7.361846047499999,{'tags': ['Holmium iridium silicide (1/1/1)']},-88.34215257,-7.361846047499999,-1.079794944166667,"['xas', 'bandstructure']",True,"[93219, 411735, 93222]",True,2021-05-12 10:56:59.077000,NM,12,9,mp-22222,,HoSiIr,"{'functional': 'PBE', 'labels': ['Ho_3', 'Si', 'Ir'], 'pot_type': 'paw'}","{'Ho': 1.0, 'Si': 1.0, 'Ir': 1.0}",GGA,mp-22222,"['mp-910929', 'mp-926556', 'mp-927095', 'mp-22222', 'mp-1143744', 'mp-1432344', 'mp-1698229', 'mp-1790193', 'mp-1597879']",0.00061385,"{'Ho': 4.0, 'Si': 4.0, 'Ir': 4.0}",215.1716390764884,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.1411355188530048e-05,0.00061385,0,0.0024554,MP,data/source/MP/cleaned/cifs/MP-mp-22222.cif,False,,data/final/MP/graphs/Ho1Ir1Si1-MP-mp-22222.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
In1Nb3,1,0.0,2.0,False,In2Nb6,In2Nb6,4.9,Other,True,In25Nb75,In-Nb,2,Supercon,In1Nb3,MP-mp-22060,Nb6In2,In-Nb,In25Nb75,P m -3 n,cubic,5.339965,5.339965,5.339965,data/final/MP/cifs/In1Nb3-MP-mp-22060.cif,data/source/MP/raw/cifs/mp-22060.cif,mp-22060,0.0,,2014-02-22 11:37:41,8.58320700386115,10.17188/1197322,"@misc{osti_1197322,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3In (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197322"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695036'}},0.0322749112499991,6.27609493,520.0,-65.85299841,-8.23162480125,"{'tags': ['Niobium indide (3/1)', 'Indium niobium (1/3)']}",-65.85299841,-8.23162480125,0.0322749112499991,"['xas', 'elasticity', 'bandstructure']",True,"[640052, 640050, 51996, 640048, 51997]",True,2021-05-12 10:56:16.728000,NM,8,9,mp-22060,,Nb3In,"{'functional': 'PBE', 'labels': ['Nb_pv', 'In_d'], 'pot_type': 'paw'}","{'Nb': 3.0, 'In': 1.0}",GGA,mp-22060,"['mp-930622', 'mp-913900', 'mp-990740', 'mp-22060', 'mp-1078807', 'mp-1417559', 'mp-1695036', 'mp-1925918', 'mp-1590229']",0.00522355,"{'Nb': 6.0, 'In': 2.0}",152.27030988162448,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",6.860891008970571e-05,0.00522355,0,0.0104471,MP,data/source/MP/cleaned/cifs/MP-mp-22060.cif,False,,data/final/MP/graphs/In1Nb3-MP-mp-22060.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ce0.5Cu2Nb1Nd1.5Sr2O10,1,0.0,2.0,False,Ce1Cu4Nb2Nd3Sr4O20,Ce1Cu4Nb2Nd3Sr4O20,25.05,Cuprate,True,Ce2.941Cu11.765Nb5.882Nd8.824Sr11.765O58.82352941176471,Ce-Cu-Nb-Nd-Sr-O,6,Supercon,Nd1.5Ce0.5Sr2Cu2Nb1O10,MP-mp-1218607,Sr4Ce1Nd3Nb2Cu4O20,Ce-Cu-Nb-Nd-Sr-O,Ce2.941Cu11.765Nb5.882Nd8.824Sr11.765O58.82352941176471,A m m 2,orthorhombic,5.589748000917245,5.590158,14.79924348,data/final/MP/cifs/Ce0.5Cu2Nb1Nd1.5Sr2O10-MP-mp-1218607.cif,data/source/MP/raw/cifs/mp-1218607.cif,mp-1218607,0.0,,2019-01-12 19:44:49.762000,6.155206562874519,,,,0.0419985452696058,3.54829277,520.0,-245.35817739,-7.216416982058824,{'tags': []},-245.35817739,-7.216416982058824,-2.839530233284314,[],False,[],True,2021-05-12 11:00:42.526000,FiM,34,3,mp-1218607,oxide,Sr4CeNd3Nb2(CuO5)4,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ce', 'Nd_3', 'Nb_pv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 4.0, 'Ce': 1.0, 'Nd': 3.0, 'Nb': 2.0, 'Cu': 4.0, 'O': 20.0}",GGA,mp-1218607,"['mp-1218607', 'mp-1354957', 'mp-1816540']",0.1082937,"{'Sr': 4.0, 'Ce': 1.0, 'Nd': 3.0, 'Nb': 2.0, 'Cu': 4.0, 'O': 20.0}",454.1190628615551,[],FiM,True,38,4,"[-0.0, -0.0, -0.0, -0.0, -0.0, -0.0, 0.0, 0.0, -0.0, -0.0, 0.2, 0.2, -0.1, -0.2, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.000238469839424,0.1082937,4,0.1082937,MP,data/source/MP/cleaned/cifs/MP-mp-1218607.cif,False,,data/final/MP/graphs/Ce0.5Cu2Nb1Nd1.5Sr2O10-MP-mp-1218607.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Al11La3,1,0.0,1.0,True,Al11La3,Al11La3,0.0,Other,True,Al78.571La21.429,Al-La,2,Supercon,Al11La3,MP-mp-16505,La3Al11,Al-La,Al78.571La21.429,I m m m,orthorhombic,4.446215997915056,8.59152859,8.591528589276873,data/final/MP/cifs/Al11La3-MP-mp-16505.cif,data/source/MP/raw/cifs/mp-16505.cif,mp-16505,0.0,,2011-05-28 18:12:36,4.002686007064809,10.17188/1191956,"@misc{osti_1191956,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La3Al11 (SG:71) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191956"",
    place = ""United States"",
    year = ""2015"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1707831'}},0.0,7.73323769,520.0,-61.60823777,-4.400588412142858,"{'tags': ['Lanthanum aluminide (3/11)', 'Aluminium lanthanum (11/3)']}",-61.60823777,-4.400588412142858,-0.3999201660714289,"['xas', 'bandstructure']",True,"[57937, 608281]",True,2021-05-12 10:56:53.126000,NM,14,10,mp-16505,,La3Al11,"{'functional': 'PBE', 'labels': ['La', 'Al'], 'pot_type': 'paw'}","{'La': 3.0, 'Al': 11.0}",GGA,mp-16505,"['mp-940242', 'mp-940667', 'mp-925840', 'mp-16505', 'mp-1104722', 'mp-1256513', 'mp-1422018', 'mp-1707831', 'mp-1809209', 'mp-1598786']",0.0050747,"{'La': 3.0, 'Al': 11.0}",296.00542349615125,[],NM,False,71,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.7143942634773997e-05,0.0050747,0,0.0050747,MP,data/source/MP/cleaned/cifs/MP-mp-16505.cif,False,,data/final/MP/graphs/Al11La3-MP-mp-16505.json,0,True,mmm,0,0,0,7,0,0,0,0,0,1,0,1.0,False
Mo4Re2Te8,1,0.0,1.0,True,Mo4Re2Te8,Mo4Re2Te8,3.5,Chevrel,True,Mo28.571Re14.286Te57.143,Mo-Re-Te,3,Supercon,Mo4Re2Te8,MP-mp-1219145,Re2Te8Mo4,Mo-Re-Te,Mo28.571Re14.286Te57.143,P 1,triclinic,7.106992000000001,7.15081197,7.16903276,data/final/MP/cifs/Mo4Re2Te8-MP-mp-1219145.cif,data/source/MP/raw/cifs/mp-1219145.cif,mp-1219145,0.0,,2019-01-12 20:11:51.330000,8.130139055112906,,,,0.0106611421428572,6.21848524,520.0,-96.5733049,-6.898093207142857,{'tags': []},-96.5733049,-6.898093207142857,-0.4665193549999996,[],False,[],True,2021-05-12 11:00:44.908000,NM,14,3,mp-1219145,,Re(Te2Mo)2,"{'functional': 'PBE', 'labels': ['Re_pv', 'Te', 'Mo_pv'], 'pot_type': 'paw'}","{'Re': 1.0, 'Te': 4.0, 'Mo': 2.0}",GGA,mp-1219145,"['mp-1219145', 'mp-1332811', 'mp-1843303']",4.715e-05,"{'Re': 2.0, 'Te': 8.0, 'Mo': 4.0}",362.93779569204304,[],NM,False,1,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.598241382388696e-07,4.715e-05,0,9.43e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1219145.cif,False,,data/final/MP/graphs/Mo4Re2Te8-MP-mp-1219145.json,0,True,1,0,0,0,0,0,1,0,1,0,0,0,1.0,False
Ca1Ge3,1,0.0,4.0,False,Ca4Ge12,Ca4Ge12,3.4,Other,True,Ca25Ge75,Ca-Ge,2,Supercon,Ca1Ge3,MP-mp-1205360,Ca4Ge12,Ca-Ge,Ca25Ge75,I 4/m m m,tetragonal,7.722936001391563,7.91900345,7.722936001391563,data/final/MP/cifs/Ca1Ge3-MP-mp-1205360.cif,data/source/MP/raw/cifs/mp-1205360.cif,mp-1205360,0.0,,2019-01-12 08:52:58.551000,5.009990508273799,,,{'GGA': {'task_id': 'mp-1705396'}},0.0886449875000003,3.84925413,520.0,-67.8298073,-4.23936295625,{'tags': ['Calcium trigermanide']},-67.8298073,-4.23936295625,-0.2706920949999998,['bandstructure'],True,[262736],True,2021-05-12 10:58:37.524000,NM,16,5,mp-1205360,,CaGe3,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Ge_d'], 'pot_type': 'paw'}","{'Ca': 1.0, 'Ge': 3.0}",GGA,mp-1205360,"['mp-1205360', 'mp-1504943', 'mp-1705396', 'mp-1839029', 'mp-1605051']",0.002114,"{'Ca': 4.0, 'Ge': 12.0}",342.0491574961312,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.4721592831567324e-05,0.002114,0,0.008456,MP,data/source/MP/cleaned/cifs/MP-mp-1205360.cif,False,,data/final/MP/graphs/Ca1Ge3-MP-mp-1205360.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Bi2Cu2Pr1Sr2O8,1,0.0,1.0,True,Bi2Cu2Pr1Sr2O8,Bi2Cu2Pr1Sr2O8,0.0,Cuprate,True,Bi13.333Cu13.333Pr6.667Sr13.333O53.333333333333336,Bi-Cu-Pr-Sr-O,5,Supercon,Bi2Sr2Pr1Cu2O8,MP-mp-1208752,Sr2Pr1Cu2Bi2O8,Bi-Cu-Pr-Sr-O,Bi13.333Cu13.333Pr6.667Sr13.333O53.333333333333336,I 4/m m m,tetragonal,3.834136000030565,3.834136000030565,15.612086169999998,data/final/MP/cifs/Bi2Cu2Pr1Sr2O8-MP-mp-1208752.cif,data/source/MP/raw/cifs/mp-1208752.cif,mp-1208752,0.0,,2019-01-12 11:36:34.547000,7.267491513783425,,,{'GGA': {'task_id': 'mp-1737201'}},0.1119466963333302,5.05599766,520.0,-89.97734715,-5.99848981,"{'tags': ['Ba2CaCu2Tl2O8', 'high-Tc cuprate family', 'Sr2Cu2PrBi2O8']}",-89.97734715,-5.99848981,-2.1167527398888883,[],False,[],True,2021-05-12 11:00:21.818000,NM,15,4,mp-1208752,oxide,Sr2PrCu2(BiO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Pr_3', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Pr': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",GGA,mp-1208752,"['mp-1208752', 'mp-1390177', 'mp-1737201', 'mp-1934574']",0.0020197,"{'Sr': 2.0, 'Pr': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",226.019943500512,[],NM,False,139,0,"[0.0, 0.0, 0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",8.935937106786441e-06,0.0020197,0,0.0020197,MP,data/source/MP/cleaned/cifs/MP-mp-1208752.cif,False,,data/final/MP/graphs/Bi2Cu2Pr1Sr2O8-MP-mp-1208752.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ce0.02In1La2.98,2,0.01,1.0,True,Ce0.02In1La2.98,In1La3,8.2,Other,True,Ce0.5In25La74.5,Ce-In-La,3,Supercon,La2.98Ce0.02In1,MP-mp-20909,La3In1,In-La,In25La75,P m -3 m,cubic,5.076766,5.076766,5.076766,data/final/MP/cifs/Ce0.02In1La2.98-MP-mp-20909-synth_doped.cif,data/source/MP/raw/cifs/mp-20909.cif,mp-20909,0.0,,2014-02-21 06:52:52,6.7455760598452565,10.17188/1196104,"@misc{osti_1196104,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La3In (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196104"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671685'}},0.0,8.16935076,520.0,-18.73796121,-4.6844903025,"{'tags': ['Indium lanthanum (1/3)', 'Lanthanum indium (3/1)']}",-18.73796121,-4.6844903025,-0.2945640412500001,"['xas', 'bandstructure']",True,"[639844, 51950, 639851, 639840, 603208, 107019]",True,2021-05-12 10:56:57.051000,NM,4,8,mp-20909,,La3In,"{'functional': 'PBE', 'labels': ['La', 'In_d'], 'pot_type': 'paw'}","{'La': 3.0, 'In': 1.0}",GGA,mp-20909,"['mp-906743', 'mp-921394', 'mp-920373', 'mp-20909', 'mp-1476042', 'mp-1671685', 'mp-1778647', 'mp-1590323']",0.0489742,"{'La': 3.0, 'In': 1.0}",130.84629766481785,[],NM,False,221,0,"[0, 0, 0, 0]",0.0003742880071811,0.0489742,0,0.0489742,MP,data/source/MP/cleaned/cifs/MP-mp-20909.cif,True,,data/final/MP/graphs/Ce0.02In1La2.98-MP-mp-20909-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
As1Sn1,1,0.0,1.0,True,As1Sn1,As1Sn1,3.755,Other,True,As50Sn50,As-Sn,2,Supercon,As1Sn1,MP-mp-2182,Sn1As1,As-Sn,As50Sn50,F m -3 m,cubic,4.10782512,4.107825119999999,4.107825119999999,data/final/MP/cifs/As1Sn1-MP-mp-2182.cif,data/source/MP/raw/cifs/mp-2182.cif,mp-2182,0.0,,2011-05-12 18:30:29,6.560009820857189,10.17188/1197179,"@misc{osti_1197179,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SnAs (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197179"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688714'}},0.0298920543749998,6.56501699,520.0,-8.76729345,-4.383646725,{'tags': ['Tin arsenide (1/1)']},-8.76729345,-4.383646725,-0.0493015950000002,"['xas', 'elasticity', 'bandstructure']",True,"[611424, 44063]",True,2021-05-12 10:56:16.728000,NM,2,8,mp-2182,,SnAs,"{'functional': 'PBE', 'labels': ['Sn_d', 'As'], 'pot_type': 'paw'}","{'Sn': 1.0, 'As': 1.0}",GGA,mp-2182,"['mp-992882', 'mp-990901', 'mp-2182', 'mp-1439175', 'mp-1688714', 'mp-1794656', 'mp-994163', 'mp-1587166']",0.0001679,"{'Sn': 1.0, 'As': 1.0}",49.01407850121941,[],NM,False,225,0,"[0, 0]",3.425546396752575e-06,0.0001679,0,0.0001679,MP,data/source/MP/cleaned/cifs/MP-mp-2182.cif,False,,data/final/MP/graphs/As1Sn1-MP-mp-2182.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
B2C1Dy0.9Ni2Tb0.1,2,0.0333333333333333,1.0,True,B2C1Dy0.9Ni2Tb0.1,B2C1Dy1Ni2,4.7,Other,True,B33.333C16.667Dy15Ni33.333Tb1.667,B-C-Dy-Ni-Tb,5,Supercon,Dy0.9Tb0.1Ni2B2C1,MP-mp-6223,Dy1Ni2B2C1,B-C-Dy-Ni,B33.333C16.667Dy16.667Ni33.333,I 4/m m m,tetragonal,3.5485979995620824,3.548597999562083,5.74460959,data/final/MP/cifs/B2C1Dy0.9Ni2Tb0.1-MP-mp-6223-synth_doped.cif,data/source/MP/raw/cifs/mp-6223.cif,mp-6223,0.0,,2011-05-13 04:15:09,8.00036369104547,10.17188/1278123,"@misc{osti_1278123,
    author = ""Persson, Kristin"",
    title = ""Materials Data on DyNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278123"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687390'}},0.0,6.75219219,520.0,-41.84976027,-6.974960045,{'tags': []},-41.84976027,-6.974960045,-0.5161893047222215,"['xas', 'elasticity', 'bandstructure']",True,"[56596, 56593, 56595, 79573, 56649, 56594]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-6223,,DyNi2B2C,"{'functional': 'PBE', 'labels': ['Dy_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Dy': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6223,"['mp-1007344', 'mp-1000899', 'mp-6223', 'mp-1439353', 'mp-1687390', 'mp-1795426', 'mp-1012086', 'mp-1593735']",0.004911,"{'Dy': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.07346390684725,[],NM,False,139,0,"[0.0, -0.0, -0.0, 0.0, 0.0, 0.0]",7.546855054512086e-05,0.004911,0,0.004911,MP,data/source/MP/cleaned/cifs/MP-mp-6223.cif,True,,data/final/MP/graphs/B2C1Dy0.9Ni2Tb0.1-MP-mp-6223-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Cu2.1Gd1Ru0.9Sr2O8,2,0.0142857142857142,2.0,False,Cu4.2Gd2Ru1.8Sr4O16,Cu4Gd2Ru2Sr4O16,37.75,Cuprate,True,Cu15Gd7.143Ru6.429Sr14.286O57.142857142857146,Cu-Gd-Ru-Sr-O,5,Supercon,Gd1Sr2Ru0.9Cu2.1O8,MP-mp-1194240,Sr4Gd2Cu4Ru2O16,Cu-Gd-Ru-Sr-O,Cu14.286Gd7.143Ru7.143Sr14.286O57.142857142857146,P 4/m b m,tetragonal,5.472451,5.472451,11.740702,data/final/MP/cifs/Cu2.1Gd1Ru0.9Sr2O8-MP-mp-1194240-synth_doped.cif,data/source/MP/raw/cifs/mp-1194240.cif,mp-1194240,0.0,,2019-01-11 23:51:58.932000,6.504561898971391,,,{'GGA': {'task_id': 'mp-1765260'}},0.0213449239285443,3.93502801,520.0,-201.55352223,-7.198340079642857,"{'tags': ['Sr2Cu2GdRuO8 orth', 'Sr2Cu2GdRuO8', 'Ruthenium distrontium gadolinium dicopper octaoxide']}",-201.55352223,-7.198340079642857,-2.268654352380952,['bandstructure'],True,[245741],True,2021-05-12 10:58:35.561000,FiM,28,6,mp-1194240,oxide,Sr2GdCu2RuO8,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Gd', 'Cu_pv', 'Ru_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Gd': 1.0, 'Cu': 2.0, 'Ru': 1.0, 'O': 8.0}",GGA,mp-1194240,"['mp-1194240', 'mp-1396976', 'mp-1659973', 'mp-1765260', 'mp-1841948', 'mp-1638264']",4.23696715,"{'Sr': 4.0, 'Gd': 2.0, 'Cu': 4.0, 'Ru': 2.0, 'O': 16.0}",351.6072554818909,[],FiM,True,127,2,"[-0.0, -0.0, -0.0, -0.0, 6.9, 6.9, 0.0, 0.0, 0.0, 0.0, -1.8, -1.8, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0241005672319991,4.23696715,4,8.4739343,MP,data/source/MP/cleaned/cifs/MP-mp-1194240.cif,True,,data/final/MP/graphs/Cu2.1Gd1Ru0.9Sr2O8-MP-mp-1194240-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B5Mo1.9Zr0.1,2,0.0285714285714285,1.0,True,B5Mo1.9Zr0.1,B5Mo2,8.9,Other,True,B71.429Mo27.143Zr1.429,B-Mo-Zr,3,Supercon,B5Mo1.9Zr0.1,MP-mp-7229,B5Mo2,B-Mo,B71.429Mo28.571,R -3 m,trigonal,3.086062143206312,3.086062143206312,7.38317517,data/final/MP/cifs/B5Mo1.9Zr0.1-MP-mp-7229-synth_doped.cif,data/source/MP/raw/cifs/mp-7229.cif,mp-7229,0.0,,2011-05-27 17:15:57,6.910597742884047,10.17188/1287525,"@misc{osti_1287525,
    author = ""Persson, Kristin"",
    title = ""Materials Data on B5Mo2 (SG:166) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1287525"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678538'}},0.4354736101190504,10.26159619,520.0,-54.63026953,-7.804324218571429,"{'tags': ['Molybdenum boride (2/5)', 'Molybdenum boride (1/2.5) - epsilon']}",-54.63026953,-7.804324218571429,0.0654250548809522,['bandstructure'],True,"[157530, 614795, 614810, 24282]",True,2021-05-12 10:58:55.498000,NM,7,11,mp-7229,,B5Mo2,"{'functional': 'PBE', 'labels': ['B', 'Mo_pv'], 'pot_type': 'paw'}","{'B': 5.0, 'Mo': 2.0}",GGA,mp-7229,"['mp-1001204', 'mp-7229', 'mp-1007569', 'mp-1077992', 'mp-1078025', 'mp-1078031', 'mp-1441558', 'mp-1678538', 'mp-1793658', 'mp-1012321', 'mp-1593525']",0.0189101,"{'B': 5.0, 'Mo': 2.0}",59.09541989544843,[],NM,False,166,0,"[0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0]",0.0003199926497426,0.0189101,0,0.0189101,MP,data/source/MP/cleaned/cifs/MP-mp-7229.cif,True,,data/final/MP/graphs/B5Mo1.9Zr0.1-MP-mp-7229-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ba2Ca0.03Cu4Tm0.97O8,2,0.004,1.0,True,Ba2Ca0.03Cu4Tm0.97O8,Ba2Cu4Tm1O8,81.2,Cuprate,True,Ba13.333Ca0.2Cu26.667Tm6.467O53.333333333333336,Ba-Ca-Cu-Tm-O,5,Supercon,Tm0.97Ca0.03Ba2Cu4O8,MP-mp-6710,Ba2Tm1Cu4O8,Ba-Cu-Tm-O,Ba13.333Cu26.667Tm6.667O53.333333333333336,C m m m,orthorhombic,3.865297,3.8869580003373287,13.86982093,data/final/MP/cifs/Ba2Ca0.03Cu4Tm0.97O8-MP-mp-6710-synth_doped.cif,data/source/MP/raw/cifs/mp-6710.cif,mp-6710,0.0,,2011-05-16 03:10:26,6.645830128925235,10.17188/1281743,"@misc{osti_1281743,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Tm(CuO2)4 (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281743"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677992'}},0.0,3.30740365,520.0,-89.79535451,-5.986356967333333,"{'tags': ['Thulium dibarium tetracopper octaoxide', 'Thulium dibarium tricopper copper(III) oxide']}",-89.79535451,-5.986356967333333,-2.066470847111112,"['xas', 'bandstructure']",True,"[78622, 75686]",True,2021-05-12 10:57:32.679000,NM,15,7,mp-6710,oxide,Ba2Tm(CuO2)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Tm_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Tm': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-6710,"['mp-1007646', 'mp-1001301', 'mp-6710', 'mp-1420256', 'mp-1677992', 'mp-1831034', 'mp-1603852']",0.0025713,"{'Ba': 2.0, 'Tm': 1.0, 'Cu': 4.0, 'O': 8.0}",206.32772996439093,[],NM,False,65,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.2462212425076202e-05,0.0025713,0,0.0025713,MP,data/source/MP/cleaned/cifs/MP-mp-6710.cif,True,,data/final/MP/graphs/Ba2Ca0.03Cu4Tm0.97O8-MP-mp-6710-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
As1La0.8Ni1Sr0.2O1,3,0.0999999999999999,2.0,False,As2La1.6Ni2Sr0.4O2,As2La2Ni2O2,3.5,Ferrite,True,As25La20Ni25Sr5O25,As-La-Ni-Sr-O,5,Supercon,La0.8Sr0.2Ni1As1O1,MP-mp-1079362,La2Ni2As2O2,As-La-Ni-O,As25La25Ni25O25,P 4/n m m,tetragonal,4.17505,4.17505,8.043113,data/final/MP/cifs/As1La0.8Ni1Sr0.2O1-MP-mp-1079362-synth_doped.cif,data/source/MP/raw/cifs/mp-1079362.cif,mp-1079362,0.0,,2018-04-14 20:51:09,6.834508513823669,,,{'GGA+U': {'task_id': 'mp-1670926'}},0.4514602021279756,7.44178584,520.0,-46.79067614,-5.8488345175,{'tags': []},-46.79067614,-5.8488345175,-1.5750287187500005,['bandstructure'],True,"[163836, 246061]",True,2021-05-12 10:58:16.596000,NM,8,6,mp-1079362,oxide,LaNiAsO,"{'functional': 'PBE', 'labels': ['La', 'Ni_pv', 'As', 'O'], 'pot_type': 'paw'}","{'La': 1.0, 'Ni': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-1079362,"['mp-1079362', 'mp-1080674', 'mp-1301057', 'mp-1670926', 'mp-1925373', 'mp-1593774']",0.00017445,"{'La': 2.0, 'Ni': 2.0, 'As': 2.0, 'O': 2.0}",140.19984455541027,[],NM,False,129,0,"[0, 0, 0, 0, 0, 0, 0, 0]",2.488590490998059e-06,0.00017445,0,0.0003489,MP,data/source/MP/cleaned/cifs/MP-mp-1079362.cif,True,,data/final/MP/graphs/As1La0.8Ni1Sr0.2O1-MP-mp-1079362-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Pd1Si1,1,0.0,4.0,False,Pd4Si4,Pd4Si4,0.93,Other,True,Pd50Si50,Pd-Si,2,Supercon,Pd1Si1,MP-mp-389,Si4Pd4,Pd-Si,Pd50Si50,P n m a,orthorhombic,3.469074,5.645056,6.161739,data/final/MP/cifs/Pd1Si1-MP-mp-389.cif,data/source/MP/raw/cifs/mp-389.cif,mp-389,0.0,,2011-05-13 05:58:56,7.403959167675627,10.17188/1207579,"@misc{osti_1207579,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SiPd (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207579"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700748'}},0.0,7.81902762,520.0,-46.73196415,-5.84149551875,"{'tags': ['Palladium silicide', 'Palladium silicide (1/1)']}",-46.73196415,-5.84149551875,-0.5033976037500008,"['xas', 'elasticity', 'bandstructure']",True,"[79237, 648859, 659957, 15016, 76626]",True,2021-05-12 10:56:20.740000,NM,8,10,mp-389,,SiPd,"{'functional': 'PBE', 'labels': ['Si', 'Pd'], 'pot_type': 'paw'}","{'Si': 1.0, 'Pd': 1.0}",GGA,mp-389,"['mp-922800', 'mp-908473', 'mp-923575', 'mp-389', 'mp-1125120', 'mp-1146086', 'mp-1414577', 'mp-1700748', 'mp-1787823', 'mp-1592149']",0.000533625,"{'Si': 4.0, 'Pd': 4.0}",120.6660557490268,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.7689316077750517e-05,0.000533625,0,0.0021345,MP,data/source/MP/cleaned/cifs/MP-mp-389.cif,False,,data/final/MP/graphs/Pd1Si1-MP-mp-389.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
B1Pt1,1,0.0,2.0,False,B2Pt2,B2Pt2,0.0,Other,True,B50Pt50,B-Pt,2,Supercon,B1Pt1,MP-mp-1096829,B2Pt2,B-Pt,B50Pt50,P 63/m m c,hexagonal,3.229427995515874,3.2294274,5.261273,data/final/MP/cifs/B1Pt1-MP-mp-1096829.cif,data/source/MP/raw/cifs/mp-1096829.cif,mp-1096829,0.0,{'GGA': {'task_id': 'mp-1588909'}},2018-05-10 22:38:16,14.38971917085515,,,,0.1937046077083337,7.46293432,520.0,-25.25294805,-6.3132370125,{'tags': ['Platinum boride (1/1)']},-25.25294805,-6.3132370125,0.0619127279166669,[],False,"[24363, 615210]",True,2021-05-12 10:59:26.677000,NM,4,5,mp-1096829,,BPt,"{'functional': 'PBE', 'labels': ['B', 'Pt'], 'pot_type': 'paw'}","{'B': 1.0, 'Pt': 1.0}",GGA,mp-1096829,"['mp-1096829', 'mp-1097825', 'mp-1437644', 'mp-1794728', 'mp-1588909']",0.00075635,"{'B': 2.0, 'Pt': 2.0}",47.51957797898967,[],NM,False,194,0,"[0, 0, 0, 0]",3.1833195165765695e-05,0.00075635,0,0.0015127,MP,data/source/MP/cleaned/cifs/MP-mp-1096829.cif,False,,data/final/MP/graphs/B1Pt1-MP-mp-1096829.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Bi2Te3,1,0.0,1.0,True,Bi2Te3,Bi2Te3,3.7325,Other,True,Bi40Te60,Bi-Te,2,Supercon,Bi2Te3,MP-mp-34202,Bi2Te3,Bi-Te,Bi40Te60,R -3 m,trigonal,4.449490237790497,4.449490237790497,10.69668056,data/final/MP/cifs/Bi2Te3-MP-mp-34202.cif,data/source/MP/raw/cifs/mp-34202.cif,mp-34202,0.3861000000000008,,2014-02-19 07:06:45,7.468816518765769,10.17188/1206742,"@misc{osti_1206742,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Bi2Te3 (SG:166) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1206742"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686790'}},0.0,5.08063801,520.0,-18.3805204,-3.67610408,"{'tags': ['Tellurobismuthite', 'Dibismuth tritelluride', 'Dibismuth telluride', 'Bismuthium telluride (2/3)', 'Bismuth telluride', 'Bismuth telluride (2/3)']}",-18.3805204,-3.67610408,-0.4873097979999997,"['eos', 'bandstructure', 'xas', 'diel', 'elasticity']",True,"[193337, 193335, 193339, 193333, 193332, 193336, 193340, 193338, 193331, 193330, 193334, 158366, 617174, 44983, 15753, 658764, 184631, 617192, 42546, 654934, 74348, 617182, 617187]",True,2021-05-12 10:56:20.740000,NM,5,80,mp-34202,,Bi2Te3,"{'functional': 'PBE', 'labels': ['Bi', 'Te'], 'pot_type': 'paw'}","{'Bi': 2.0, 'Te': 3.0}",GGA,mp-34202,"['mp-925859', 'mp-924885', 'mp-909869', 'mp-541838', 'mp-34202', 'mp-34712', 'mp-1067927', 'mp-1067928', 'mp-1067946', 'mp-1067959', 'mp-1067958', 'mp-1068063', 'mp-1068074', 'mp-1067999', 'mp-1067991', 'mp-1067994', 'mp-1067997', 'mp-1068022', 'mp-1068105', 'mp-1068031', 'mp-1068044', 'mp-1068112', 'mp-1068066', 'mp-1068054', 'mp-1068092', 'mp-1068137', 'mp-1068142', 'mp-1068154', 'mp-1068161', 'mp-1068204', 'mp-1068181', 'mp-1068214', 'mp-1068186', 'mp-1068222', 'mp-1068233', 'mp-1068205', 'mp-1068262', 'mp-1068230', 'mp-1068247', 'mp-1068591', 'mp-1068604', 'mp-1068576', 'mp-1069331', 'mp-1069333', 'mp-1069353', 'mp-1069399', 'mp-1069337', 'mp-1069358', 'mp-1069630', 'mp-1069661', 'mp-1069612', 'mp-1070511', 'mp-1070519', 'mp-1070525', 'mp-1070749', 'mp-1070758', 'mp-1070763', 'mp-1140288', 'mp-1440569', 'mp-1686790', 'mp-1779027', 'mp-1593997', 'mp-1592222', 'mp-1068061', 'mp-1069356', 'mp-1069660', 'mp-1068605', 'mp-1068116', 'mp-1068159', 'mp-1068257', 'mp-1068231', 'mp-1068089', 'mp-1067992', 'mp-1067996', 'mp-1068185', 'mp-1068030', 'mp-1069396', 'mp-1070527', 'mp-1070764', 'mp-1068255']",0.0162275,"{'Bi': 2.0, 'Te': 3.0}",178.03283666976503,[],NM,False,166,0,"[0, 0, 0, 0, 0]",9.114891557954872e-05,0.0162275,0,0.0162275,MP,data/source/MP/cleaned/cifs/MP-mp-34202.cif,False,,data/final/MP/graphs/Bi2Te3-MP-mp-34202.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
C2Ir1U2,1,0.0,1.0,True,C2Ir1U2,C2Ir1U2,0.0,Heavy_fermion,True,C40Ir20U40,C-Ir-U,3,Supercon,C2Ir1U2,MP-mp-6940,U2Ir1C2,C-Ir-U,C40Ir20U40,I 4/m m m,tetragonal,3.477283999065741,3.4772839990657416,6.71165416,data/final/MP/cifs/C2Ir1U2-MP-mp-6940.cif,data/source/MP/raw/cifs/mp-6940.cif,mp-6940,0.0,,2011-05-28 02:45:13,15.223880623743504,10.17188/1284666,"@misc{osti_1284666,
    author = ""Persson, Kristin"",
    title = ""Materials Data on U2IrC2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1284666"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678067'}},0.0,10.96205282,520.0,-51.58664361,-10.317328722,"{'tags': ['Iridium uranium carbide (1/2/2)', 'Uranium iridium carbide (2/1/2)']}",-51.58664361,-10.317328722,-0.3423663539999992,"['bandstructure', 'elasticity']",True,"[9114, 618136, 618138]",True,2021-05-12 10:56:27.046000,FM,5,16,mp-6940,,U2IrC2,"{'functional': 'PBE', 'labels': ['U', 'Ir', 'C'], 'pot_type': 'paw'}","{'U': 2.0, 'Ir': 1.0, 'C': 2.0}",GGA,mp-6940,"['mp-1000588', 'mp-1007059', 'mp-6940', 'mp-1070322', 'mp-1070296', 'mp-1070629', 'mp-1070666', 'mp-1070465', 'mp-1070788', 'mp-1437706', 'mp-1678067', 'mp-1801434', 'mp-1011802', 'mp-1592583', 'mp-1070417', 'mp-1070751']",1.6094266,"{'U': 2.0, 'Ir': 1.0, 'C': 2.0}",75.51195042718541,[],FM,True,139,1,"[0.9, 0.9, 0.0, 0.0, 0.0]",0.0213135350218762,1.6094266,2,1.6094266,MP,data/source/MP/cleaned/cifs/MP-mp-6940.cif,False,,data/final/MP/graphs/C2Ir1U2-MP-mp-6940.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Bi1K0.85La0.15O3,3,0.06,1.0,True,Bi1K0.85La0.15O3,Bi1K1O3,10.25,Oxide,True,Bi20K17La3O60,Bi-K-La-O,4,Supercon,K0.85La0.15Bi1O3,MP-mp-982040,K1Bi1O3,Bi-K-O,Bi20K20O60,P m -3 m,cubic,4.284204,4.284204,4.284204,data/final/MP/cifs/Bi1K0.85La0.15O3-MP-mp-982040-synth_doped.cif,data/source/MP/raw/cifs/mp-982040.cif,mp-982040,0.0,,2015-10-12 11:25:13,6.252348761231978,10.17188/1316390,"@misc{osti_1316390,
    author = ""Persson, Kristin"",
    title = ""Materials Data on KBiO3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1316390"",
    place = ""United States"",
    year = ""2016"",
    month = ""9"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1717462'}},0.0928686834999998,1.80216133,520.0,-25.20286901,-5.040573802,{'tags': []},-25.20286901,-5.040573802,-1.4839105476,"['xas', 'elasticity']",False,[],True,2021-05-12 10:56:37.246000,NM,5,9,mp-982040,oxide,KBiO3,"{'functional': 'PBE', 'labels': ['K_sv', 'Bi', 'O'], 'pot_type': 'paw'}","{'K': 1.0, 'Bi': 1.0, 'O': 3.0}",GGA,mp-982040,"['mp-982222', 'mp-1006156', 'mp-982040', 'mp-1006117', 'mp-1431172', 'mp-1717462', 'mp-1798749', 'mp-1011221', 'mp-1585048']",0.0005425,"{'K': 1.0, 'Bi': 1.0, 'O': 3.0}",78.63401066432932,[],NM,False,221,0,"[0, 0, 0, 0, 0]",6.899050365315956e-06,0.0005425,0,0.0005425,MP,data/source/MP/cleaned/cifs/MP-mp-982040.cif,True,,data/final/MP/graphs/Bi1K0.85La0.15O3-MP-mp-982040-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
In0.95Te1,2,0.0256410256410256,1.0,True,In0.95Te1,In1Te1,2.7,Other,True,In48.718Te51.282,In-Te,2,Supercon,In0.95Te1,MP-mp-2597,In1Te1,In-Te,In50Te50,F m -3 m,cubic,4.44363296,4.44363296,4.44363296,data/final/MP/cifs/In0.95Te1-MP-mp-2597-synth_doped.cif,data/source/MP/raw/cifs/mp-2597.cif,mp-2597,0.0,,2011-05-12 18:35:42,6.488053472608879,10.17188/1201088,"@misc{osti_1201088,
    author = ""Persson, Kristin"",
    title = ""Materials Data on InTe (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201088"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668520'}},0.0,6.3140604,520.0,-6.47268679,-3.236343395,"{'tags': ['Indium telluride (1/1)', 'Indium tellurium (1/1) - HP, HT', 'High pressure experimental phase', 'Indium telluride  - II']}",-6.47268679,-3.236343395,-0.4998510649999996,"['xas', 'elasticity', 'bandstructure']",True,"[169425, 44653, 169422, 59547, 169428, 640620, 640614, 169431, 169419, 640622]",True,2021-05-12 10:56:18.721000,NM,2,9,mp-2597,,InTe,"{'functional': 'PBE', 'labels': ['In_d', 'Te'], 'pot_type': 'paw'}","{'In': 1.0, 'Te': 1.0}",GGA,mp-2597,"['mp-1000805', 'mp-1007252', 'mp-2597', 'mp-1440879', 'mp-1668520', 'mp-1793575', 'mp-1011993', 'mp-1588148', 'mp-1589064']",0.0001824,"{'In': 1.0, 'Te': 1.0}",62.04396451824765,[],NM,False,225,0,"[0, 0]",2.939850820563773e-06,0.0001824,0,0.0001824,MP,data/source/MP/cleaned/cifs/MP-mp-2597.cif,True,,data/final/MP/graphs/In0.95Te1-MP-mp-2597-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ir0.82Mo0.18,3,0.1399999999999999,8.0,False,Ir6.56Mo1.44,Ir6Mo2,0.5,Other,True,Ir82Mo18,Ir-Mo,2,Supercon,Ir0.82Mo0.18,MP-mp-11482,Mo2Ir6,Ir-Mo,Ir75Mo25,P 63/m m c,hexagonal,4.423083,5.546684001093023,5.54668465,data/final/MP/cifs/Ir0.82Mo0.18-MP-mp-11482-synth_doped.cif,data/source/MP/raw/cifs/mp-11482.cif,mp-11482,0.0,,2011-05-29 09:22:08,18.95428940976868,10.17188/1187875,"@misc{osti_1187875,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MoIr3 (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187875"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700599'}},0.0,9.7847681,520.0,-77.45417496,-9.68177187,{'tags': ['Iridium molybdenum (3/1) - HT']},-77.45417496,-9.68177187,-0.3415382975000014,"['xas', 'elasticity', 'bandstructure']",True,[104506],True,2021-05-12 10:56:12.755000,NM,8,8,mp-11482,,MoIr3,"{'functional': 'PBE', 'labels': ['Mo_pv', 'Ir'], 'pot_type': 'paw'}","{'Mo': 1.0, 'Ir': 3.0}",GGA,mp-11482,"['mp-929010', 'mp-912589', 'mp-929388', 'mp-11482', 'mp-1432173', 'mp-1700599', 'mp-1804366', 'mp-1596011']",2.88e-05,"{'Mo': 2.0, 'Ir': 6.0}",117.84811418653877,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",4.88764715477979e-07,2.88e-05,0,5.76e-05,MP,data/source/MP/cleaned/cifs/MP-mp-11482.cif,True,,data/final/MP/graphs/Ir0.82Mo0.18-MP-mp-11482-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ir1Sc1,1,0.0,1.0,True,Ir1Sc1,Ir1Sc1,0.0,Other,True,Ir50Sc50,Ir-Sc,2,Supercon,Ir1Sc1,MP-mp-1129,Sc1Ir1,Ir-Sc,Ir50Sc50,P m -3 m,cubic,3.232512,3.232512,3.232512,data/final/MP/cifs/Ir1Sc1-MP-mp-1129.cif,data/source/MP/raw/cifs/mp-1129.cif,mp-1129,0.0,,2011-05-12 18:39:40,11.65987101077144,10.17188/1187713,"@misc{osti_1187713,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ScIr (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187713"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686397'}},0.0,7.08362767,520.0,-17.28783517,-8.643917585,{'tags': ['Iridium scandium (1/1)']},-17.28783517,-8.643917585,-1.0584678225000008,"['xas', 'elasticity', 'bandstructure']",True,"[640974, 104557, 657998]",True,2021-05-12 10:56:10.715000,NM,2,8,mp-1129,,ScIr,"{'functional': 'PBE', 'labels': ['Sc_sv', 'Ir'], 'pot_type': 'paw'}","{'Sc': 1.0, 'Ir': 1.0}",GGA,mp-1129,"['mp-663353', 'mp-663057', 'mp-657277', 'mp-1129', 'mp-1440270', 'mp-1686397', 'mp-1795043', 'mp-1593819']",6.3e-06,"{'Sc': 1.0, 'Ir': 1.0}",33.77695049554644,[],NM,False,221,0,"[0, 0]",1.8651772606975482e-07,6.3e-06,0,6.3e-06,MP,data/source/MP/cleaned/cifs/MP-mp-1129.cif,False,,data/final/MP/graphs/Ir1Sc1-MP-mp-1129.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Hf1N0.989,2,0.0055304172951231,1.0,True,Hf1N0.989,Hf1N1,6.6,Other,True,Hf50.277N49.723,Hf-N,2,Supercon,Hf1N0.989,MP-mp-2828,Hf1N1,Hf-N,Hf50N50,F m -3 m,cubic,3.2086681400000003,3.208668139999999,3.208668139999999,data/final/MP/cifs/Hf1N0.989-MP-mp-2828-synth_doped.cif,data/source/MP/raw/cifs/mp-2828.cif,mp-2828,0.0,,2011-05-12 17:40:50,13.68399724663909,10.17188/1202411,"@misc{osti_1202411,
    author = ""Persson, Kristin"",
    title = ""Materials Data on HfN (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1202411"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686752'}},0.0,8.29873188,520.0,-21.78975196,-10.89487598,"{'tags': ['Hafnium nitride (1/1)', 'Hafnium(III) nitride', 'Hafnium nitride - B1, NP', 'Hafnium nitride (1/1) - rocksalt type', 'Hafnium nitride']}",-21.78975196,-10.89487598,-1.9285340925000007,"['xas', 'elasticity', 'bandstructure']",True,"[638651, 187190, 638654, 53026, 167859, 186385, 183419, 638655, 192050, 638652, 76129, 181797, 658397, 638656, 658335, 638649, 53025, 638657, 638660, 638650]",True,2021-05-12 10:56:18.721000,NM,2,25,mp-2828,,HfN,"{'functional': 'PBE', 'labels': ['Hf_pv', 'N'], 'pot_type': 'paw'}","{'Hf': 1.0, 'N': 1.0}",GGA,mp-2828,"['mp-1000866', 'mp-1007308', 'mp-2828', 'mp-1057010', 'mp-1057058', 'mp-1057028', 'mp-1058002', 'mp-1058045', 'mp-1058108', 'mp-1058016', 'mp-1058092', 'mp-1058128', 'mp-1058950', 'mp-1058967', 'mp-1059002', 'mp-1440960', 'mp-1686752', 'mp-1793787', 'mp-1012051', 'mp-1595739', 'mp-1596504', 'mp-1058993', 'mp-1058122', 'mp-1058043', 'mp-1057049']",0.000136,"{'Hf': 1.0, 'N': 1.0}",23.35927761313228,[],NM,False,225,0,"[0, 0]",5.822097851328356e-06,0.000136,0,0.000136,MP,data/source/MP/cleaned/cifs/MP-mp-2828.cif,True,,data/final/MP/graphs/Hf1N0.989-MP-mp-2828-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Co1Ga5Np0.1U0.9,2,0.0285714285714285,1.0,True,Co1Ga5Np0.1U0.9,Co1Ga5U1,7.2,Heavy_fermion,True,Co14.286Ga71.429Np1.429U12.857,Co-Ga-Np-U,4,Supercon,U0.9Np0.1Co1Ga5,MP-mp-4732,U1Ga5Co1,Co-Ga-U,Co14.286Ga71.429U14.286,P 4/m m m,tetragonal,4.243816,4.243816,6.697816,data/final/MP/cifs/Co1Ga5Np0.1U0.9-MP-mp-4732-synth_doped.cif,data/source/MP/raw/cifs/mp-4732.cif,mp-4732,0.0,,2011-05-14 05:40:08,8.886912684961567,10.17188/1208363,"@misc{osti_1208363,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UGa5Co (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208363"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695878'}},0.0,5.66771293,520.0,-35.81873974,-5.11696282,"{'tags': ['Cobalt uranium gallide (1/1/5)', 'Cobalt gallium uranium (1/5/1)']}",-35.81873974,-5.11696282,-0.3255045460714285,"['xas', 'elasticity', 'bandstructure']",True,"[102455, 106469, 603079]",True,2021-05-12 10:56:20.740000,FiM,7,8,mp-4732,,UGa5Co,"{'functional': 'PBE', 'labels': ['U', 'Ga_d', 'Co'], 'pot_type': 'paw'}","{'U': 1.0, 'Ga': 5.0, 'Co': 1.0}",GGA,mp-4732,"['mp-934727', 'mp-941507', 'mp-941208', 'mp-4732', 'mp-1436195', 'mp-1695878', 'mp-1804860', 'mp-1596781']",0.336802,"{'U': 1.0, 'Ga': 5.0, 'Co': 1.0}",120.627493636691,[],FiM,True,123,2,"[0.4, 0.0, 0.0, 0.0, 0.0, 0.0, -0.2]",0.0027920832129231,0.336802,2,0.336802,MP,data/source/MP/cleaned/cifs/MP-mp-4732.cif,True,,data/final/MP/graphs/Co1Ga5Np0.1U0.9-MP-mp-4732-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ba1.8Cu3La1.2O8,3,0.0285714285714285,1.0,True,Ba1.8Cu3La1.2O8,Ba2Cu3La1O8,0.0,Cuprate,True,Ba12.857Cu21.429La8.571O57.142857142857146,Ba-Cu-La-O,4,Supercon,La1.2Ba1.8Cu3O8,MP-mp-505315,Ba2La1Cu3O8,Ba-Cu-La-O,Ba14.286Cu21.429La7.143O57.142857142857146,P 4/m m m,tetragonal,3.984187,3.984187,11.739171,data/final/MP/cifs/Ba1.8Cu3La1.2O8-MP-mp-505315-synth_doped.cif,data/source/MP/raw/cifs/mp-505315.cif,mp-505315,0.0,,2014-02-26 00:58:20,6.524655970006006,10.17188/1262476,"@misc{osti_1262476,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2LaCu3O8 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1262476"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695786'}},0.0619549533749976,3.82156834,520.0,-83.77349416,-5.983821011428572,{'tags': ['Lanthanum barium copper oxide (1/2/3/8)']},-83.77349416,-5.983821011428572,-2.043874096071428,"['xas', 'bandstructure']",True,[85291],True,2021-05-12 10:57:08.928000,NM,14,11,mp-505315,oxide,Ba2LaCu3O8,"{'functional': 'PBE', 'labels': ['Ba_sv', 'La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'La': 1.0, 'Cu': 3.0, 'O': 8.0}",GGA,mp-505315,"['mp-939898', 'mp-937368', 'mp-916757', 'mp-505315', 'mp-1104647', 'mp-1182365', 'mp-1236975', 'mp-1424056', 'mp-1695786', 'mp-1828189', 'mp-1598719']",0.002039,"{'Ba': 2.0, 'La': 1.0, 'Cu': 3.0, 'O': 8.0}",186.34461930289984,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.094209217109533e-05,0.002039,0,0.002039,MP,data/source/MP/cleaned/cifs/MP-mp-505315.cif,True,,data/final/MP/graphs/Ba1.8Cu3La1.2O8-MP-mp-505315-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ce0.15Cu1Eu1.85O4,2,0.0428571428571428,1.0,True,Ce0.15Cu1Eu1.85O4,Cu1Eu2O4,7.75,Cuprate,True,Ce2.143Cu14.286Eu26.429O57.142857142857146,Ce-Cu-Eu-O,4,Supercon,Eu1.85Ce0.15Cu1O4,MP-mp-22306,Eu2Cu1O4,Cu-Eu-O,Cu14.286Eu28.571O57.142857142857146,I 4/m m m,tetragonal,3.9182440032784944,3.918244003278494,6.69629925,data/final/MP/cifs/Ce0.15Cu1Eu1.85O4-MP-mp-22306-synth_doped.cif,data/source/MP/raw/cifs/mp-22306.cif,mp-22306,0.0,,2014-02-21 13:19:34,7.6551995440047325,10.17188/1197540,"@misc{osti_1197540,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Eu2CuO4 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197540"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678558'}},0.0,3.03657377,520.0,-59.80247182,-8.54321026,"{'tags': ['Europium cuprate', 'Dieuropium copper oxide']}",-59.80247182,-8.54321026,-2.582190597142857,"['xas', 'elasticity', 'bandstructure']",True,"[72244, 71183]",True,2021-05-12 10:56:16.728000,FiM,7,9,mp-22306,oxide,Eu2CuO4,"{'functional': 'PBE', 'labels': ['Eu', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Eu': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-22306,"['mp-992891', 'mp-990884', 'mp-22306', 'mp-1351444', 'mp-1658560', 'mp-1678558', 'mp-1932836', 'mp-994246', 'mp-1595175']",11.7976481,"{'Eu': 2.0, 'Cu': 1.0, 'O': 4.0}",93.59330789613776,[],FiM,True,139,4,"[6.2, 6.2, -0.1, -0.2, -0.2, 0.0, 0.0]",0.1260522612694923,11.7976481,5,11.7976481,MP,data/source/MP/cleaned/cifs/MP-mp-22306.cif,True,,data/final/MP/graphs/Ce0.15Cu1Eu1.85O4-MP-mp-22306-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ba2Cu4Ga0.1Y0.9O8,2,0.0133333333333333,1.0,True,Ba2Cu4Ga0.1Y0.9O8,Ba2Cu4Y1O8,74.0,Cuprate,True,Ba13.333Cu26.667Ga0.667Y6O53.333333333333336,Ba-Cu-Ga-Y-O,5,Supercon,Y0.9Ga0.1Ba2Cu4O8,MP-mp-6790,Ba2Y1Cu4O8,Ba-Cu-Y-O,Ba13.333Cu26.667Y6.667O53.333333333333336,C m m m,orthorhombic,3.889922,3.899603999537882,13.88942687,data/final/MP/cifs/Ba2Cu4Ga0.1Y0.9O8-MP-mp-6790-synth_doped.cif,data/source/MP/raw/cifs/mp-6790.cif,mp-6790,0.0,,2011-05-16 03:21:24,5.936250568336678,10.17188/1283441,"@misc{osti_1283441,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Y(CuO2)4 (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1283441"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686864'}},0.0,3.31391536,520.0,-91.58381472,-6.105587648,"{'tags': ['Yttrium barium copper oxide (1/2/4/8)', 'High pressure experimental phase']}",-91.58381472,-6.105587648,-2.0529924817777783,"['xas', 'bandstructure']",True,"[72261, 85273, 74251, 400273, 85277, 85275, 400280, 67632, 85272, 67631, 83920, 66613, 85279, 400277, 75689, 74259, 85278, 85280, 66603, 94265, 400276, 88873, 71417, 75712, 97052, 66605, 72258, 85281, 85274, 400279, 66604, 69698]",True,2021-05-12 10:57:34.594000,NM,15,10,mp-6790,oxide,Ba2Y(CuO2)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-6790,"['mp-1000664', 'mp-6790', 'mp-1007136', 'mp-1237713', 'mp-1440937', 'mp-1686864', 'mp-1834179', 'mp-1011883', 'mp-1590064', 'mp-1590433']",0.0004643,"{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",208.60454115924333,[],NM,False,65,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.225742533790601e-06,0.0004643,0,0.0004643,MP,data/source/MP/cleaned/cifs/MP-mp-6790.cif,True,,data/final/MP/graphs/Ba2Cu4Ga0.1Y0.9O8-MP-mp-6790-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ir1La1Si3,1,0.0,1.0,True,Ir1La1Si3,Ir1La1Si3,1.473333333,Other,True,Ir20La20Si60,Ir-La-Si,3,Supercon,La1Ir1Si3,MP-mp-2914,La1Si3Ir1,Ir-La-Si,Ir20La20Si60,I 4 m m,tetragonal,4.295291998754493,4.295291998754493,5.817336820000001,data/final/MP/cifs/Ir1La1Si3-MP-mp-2914.cif,data/source/MP/raw/cifs/mp-2914.cif,mp-2914,0.0,,2011-05-12 21:09:32,7.535183277826356,10.17188/1203272,"@misc{osti_1203272,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaSi3Ir (SG:107) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1203272"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698227'}},0.0,9.33623013,520.0,-34.34052022,-6.868104044000001,"{'tags': ['Lanthanum iridium trisilicide', 'Lanthanum iridium silicide (1/1/3)']}",-34.34052022,-6.868104044000001,-0.8580281270000001,"['xas', 'elasticity', 'bandstructure']",True,"[30751, 38342]",True,2021-05-12 10:56:18.721000,NM,5,10,mp-2914,,LaSi3Ir,"{'functional': 'PBE', 'labels': ['La', 'Si', 'Ir'], 'pot_type': 'paw'}","{'La': 1.0, 'Si': 3.0, 'Ir': 1.0}",GGA,mp-2914,"['mp-921701', 'mp-907214', 'mp-920658', 'mp-2914', 'mp-1125135', 'mp-1136284', 'mp-1438408', 'mp-1698227', 'mp-1796052', 'mp-1596464']",0.0002019,"{'La': 1.0, 'Si': 3.0, 'Ir': 1.0}",91.53765498429118,[],NM,False,107,0,"[0, 0, 0, 0, 0]",2.2056496862919216e-06,0.0002019,0,0.0002019,MP,data/source/MP/cleaned/cifs/MP-mp-2914.cif,False,,data/final/MP/graphs/Ir1La1Si3-MP-mp-2914.json,0,True,4mm,0,0,0,0,5,0,0,0,0,1,0,1.0,False
Pr1,1,0.0,4.0,False,Pr4,Pr4,0.0,Heavy_fermion,True,Pr100,Pr,1,Supercon,Pr1,MP-mp-38,Pr4,Pr,Pr100,P 63/m m c,hexagonal,3.742987995227837,3.74298826,12.022758,data/final/MP/cifs/Pr1-MP-mp-38.cif,data/source/MP/raw/cifs/mp-38.cif,mp-38,0.0,,2011-05-13 00:10:28,6.416113132121284,10.17188/1207450,"@misc{osti_1207450,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Pr (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207450"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686582'}},0.0,3.53790603,520.0,-19.12359658,-4.780899145,"{'tags': ['Praseodymium - alpha', 'Praseodymium']}",-19.12359658,-4.780899145,0.0,"['surfaces', 'eos', 'bandstructure', 'xas', 'elasticity']",True,"[649176, 649177, 108681, 649182, 43576, 77905, 649187, 649183]",True,2021-05-12 10:56:20.740000,NM,4,8,mp-38,,Pr,"{'functional': 'PBE', 'labels': ['Pr_3'], 'pot_type': 'paw'}",{'Pr': 1.0},GGA,mp-38,"['mp-925687', 'mp-926098', 'mp-910221', 'mp-38', 'mp-1440373', 'mp-1686582', 'mp-1862688', 'mp-1592576']",0.00524495,{'Pr': 4.0},145.87190268600548,[],NM,False,194,0,"[-0.0, -0.0, -0.0, -0.0]",0.0001438234479271,0.00524495,0,0.0209798,MP,data/source/MP/cleaned/cifs/MP-mp-38.cif,False,,data/final/MP/graphs/Pr1-MP-mp-38.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
As1F0.15Fe1Sm1O0.85,3,0.075,2.0,False,As2F0.3Fe2Sm2O1.7,As2Fe2Sm2O2,44.48888889,Ferrite,True,As25F3.75Fe25Sm25O21.25,As-F-Fe-Sm-O,5,Supercon,Sm1Fe1As1F0.15O0.85,MP-mp-20349,Sm2Fe2As2O2,As-Fe-Sm-O,As25Fe25Sm25O25,P 4/n m m,tetragonal,4.026492,4.026492,9.046755,data/final/MP/cifs/As1F0.15Fe1Sm1O0.85-MP-mp-20349-synth_doped.cif,data/source/MP/raw/cifs/mp-20349.cif,mp-20349,0.0,,2014-02-19 11:24:42,6.727802583283198,,,{'GGA+U': {'task_id': 'mp-1695938'}},0.3015723809374986,3.77685593,520.0,-52.73407138,-6.5917589225,{'tags': ['Samarium iron arsenic oxide (1/1/1/1)']},-52.73407138,-6.5917589225,-1.6285904237499995,"['xas', 'elasticity', 'bandstructure']",True,"[236652, 236653, 422002, 163457, 163458]",True,2021-05-12 10:56:16.728000,FM,8,10,mp-20349,oxide,SmFeAsO,"{'functional': 'PBE', 'labels': ['Sm_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Sm': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-20349,"['mp-24944', 'mp-1078897', 'mp-1079866', 'mp-1173321', 'mp-20349', 'mp-1425472', 'mp-1695938', 'mp-1772503', 'mp-1789694', 'mp-1588381']",3.75729895,"{'Sm': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",146.67176231613362,[],FM,True,129,1,"[0.0, 0.0, 3.5, 3.5, -0.0, -0.0, -0.0, -0.0]",0.0512341147425717,3.75729895,2,7.5145979,MP,data/source/MP/cleaned/cifs/MP-mp-20349.cif,True,,data/final/MP/graphs/As1F0.15Fe1Sm1O0.85-MP-mp-20349-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ba1.87Cu4La0.13Y1O8,2,0.0173333333333333,1.0,True,Ba1.87Cu4La0.13Y1O8,Ba2Cu4Y1O8,61.0,Cuprate,True,Ba12.467Cu26.667La0.867Y6.667O53.333333333333336,Ba-Cu-La-Y-O,5,Supercon,Y1Ba1.87La0.13Cu4O8,MP-mp-6790,Ba2Y1Cu4O8,Ba-Cu-Y-O,Ba13.333Cu26.667Y6.667O53.333333333333336,C m m m,orthorhombic,3.889922,3.899603999537882,13.88942687,data/final/MP/cifs/Ba1.87Cu4La0.13Y1O8-MP-mp-6790-synth_doped.cif,data/source/MP/raw/cifs/mp-6790.cif,mp-6790,0.0,,2011-05-16 03:21:24,5.936250568336678,10.17188/1283441,"@misc{osti_1283441,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Y(CuO2)4 (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1283441"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686864'}},0.0,3.31391536,520.0,-91.58381472,-6.105587648,"{'tags': ['Yttrium barium copper oxide (1/2/4/8)', 'High pressure experimental phase']}",-91.58381472,-6.105587648,-2.0529924817777783,"['xas', 'bandstructure']",True,"[72261, 85273, 74251, 400273, 85277, 85275, 400280, 67632, 85272, 67631, 83920, 66613, 85279, 400277, 75689, 74259, 85278, 85280, 66603, 94265, 400276, 88873, 71417, 75712, 97052, 66605, 72258, 85281, 85274, 400279, 66604, 69698]",True,2021-05-12 10:57:34.594000,NM,15,10,mp-6790,oxide,Ba2Y(CuO2)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-6790,"['mp-1000664', 'mp-6790', 'mp-1007136', 'mp-1237713', 'mp-1440937', 'mp-1686864', 'mp-1834179', 'mp-1011883', 'mp-1590064', 'mp-1590433']",0.0004643,"{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",208.60454115924333,[],NM,False,65,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.225742533790601e-06,0.0004643,0,0.0004643,MP,data/source/MP/cleaned/cifs/MP-mp-6790.cif,True,,data/final/MP/graphs/Ba1.87Cu4La0.13Y1O8-MP-mp-6790-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
B2Mg0.8,3,0.0952380952380952,1.0,True,B2Mg0.8,B2Mg1,38.0,Other,True,B71.429Mg28.571,B-Mg,2,Supercon,B2Mg0.8,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B2Mg0.8-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B2Mg0.8-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Pb0.996Te1Tl0.004,2,0.004,1.0,True,Pb0.996Te1Tl0.004,Pb1Te1,0.061,Other,True,Pb49.8Te50Tl0.2,Pb-Te-Tl,3,Supercon,Pb0.996Tl0.004Te1,MP-mp-19717,Te1Pb1,Pb-Te,Pb50Te50,F m -3 m,cubic,4.64263261,4.64263261,4.64263261,data/final/MP/cifs/Pb0.996Te1Tl0.004-MP-mp-19717-synth_doped.cif,data/source/MP/raw/cifs/mp-19717.cif,mp-19717,1.0581999999999994,,2013-09-21 09:56:54,7.856997090559908,10.17188/1194927,"@misc{osti_1194927,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TePb (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1194927"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686920'}},0.0,4.9735213,520.0,-7.66743933,-3.833719665,"{'tags': ['Altaite', 'Lead telluride (1/1)', 'High pressure experimental phase', 'Lead telluride']}",-7.66743933,-3.833719665,-0.6167456649999998,"['eos', 'xas', 'bandstructure', 'diel', 'phonons', 'elasticity']",True,"[194220, 648583, 648588, 648607, 63099, 648584, 648590, 604178, 648595, 96500, 648608, 648596, 648597, 182660, 648599, 648593, 648603, 96504, 648591, 648586, 96506, 600843, 600522, 648614, 182662, 648606, 186788, 96505, 153711, 648581, 648605, 648587, 248494, 648585, 190437, 648600, 648617, 602956, 38295, 648589, 648615, 63098, 648592, 290707, 648612, 648594, 182661, 648616, 248495, 648613]",True,2021-05-12 10:56:14.760000,NM,2,34,mp-19717,,TePb,"{'functional': 'PBE', 'labels': ['Te', 'Pb_d'], 'pot_type': 'paw'}","{'Te': 1.0, 'Pb': 1.0}",GGA,mp-19717,"['mp-658057', 'mp-655294', 'mp-656827', 'mp-19717', 'mp-1056883', 'mp-1056867', 'mp-1056875', 'mp-1059285', 'mp-1059296', 'mp-1059300', 'mp-1059866', 'mp-1059872', 'mp-1059851', 'mp-1060231', 'mp-1060244', 'mp-1060254', 'mp-1061267', 'mp-1061381', 'mp-1061396', 'mp-1061412', 'mp-1061239', 'mp-1061250', 'mp-1142129', 'mp-1440755', 'mp-1686920', 'mp-1801248', 'mp-1594316', 'mp-1595339', 'mp-1059310', 'mp-1060260', 'mp-1061273', 'mp-1061416', 'mp-1056891', 'mp-1059878']",0.0014838,"{'Te': 1.0, 'Pb': 1.0}",70.75839192630549,[],NM,False,225,0,"[0, 0]",2.096995083700277e-05,0.0014838,0,0.0014838,MP,data/source/MP/cleaned/cifs/MP-mp-19717.cif,True,,data/final/MP/graphs/Pb0.996Te1Tl0.004-MP-mp-19717-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Si1Ta1.86,2,0.0326340326340326,2.0,False,Si2Ta3.72,Si2Ta4,0.0,Other,True,Si34.965Ta65.035,Si-Ta,2,Supercon,Si1Ta1.86,MP-mp-2783,Ta4Si2,Si-Ta,Si33.333Ta66.667,I 4/m c m,tetragonal,5.064350521166502,5.06435052,5.064350519999999,data/final/MP/cifs/Si1Ta1.86-MP-mp-2783-synth_doped.cif,data/source/MP/raw/cifs/mp-2783.cif,mp-2783,0.0,,2011-05-13 04:15:18,13.2745948473238,10.17188/1202002,"@misc{osti_1202002,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ta2Si (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1202002"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697009'}},0.0016131517708348,7.45958288,520.0,-61.62053009,-10.270088348333331,{'tags': ['Tantalum silicide (2/1)']},-61.62053009,-10.270088348333331,-0.5327985883333343,"['xas', 'elasticity', 'bandstructure']",True,"[652302, 76160, 42526]",True,2021-05-12 10:56:18.721000,NM,6,16,mp-2783,,Ta2Si,"{'functional': 'PBE', 'labels': ['Ta_pv', 'Si'], 'pot_type': 'paw'}","{'Ta': 2.0, 'Si': 1.0}",GGA,mp-2783,"['mp-924868', 'mp-909837', 'mp-925426', 'mp-2783', 'mp-1072341', 'mp-1072298', 'mp-1072369', 'mp-1138632', 'mp-1146351', 'mp-1258626', 'mp-1263104', 'mp-1441064', 'mp-1697009', 'mp-1795946', 'mp-1595051', 'mp-1072362']",6.855e-05,"{'Ta': 4.0, 'Si': 2.0}",97.56668657988396,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0]",1.4051927436087278e-06,6.855e-05,0,0.0001371,MP,data/source/MP/cleaned/cifs/MP-mp-2783.cif,True,,data/final/MP/graphs/Si1Ta1.86-MP-mp-2783-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As2Pt1,1,0.0,4.0,False,As8Pt4,As8Pt4,0.0,Other,True,As66.667Pt33.333,As-Pt,2,Supercon,As2Pt1,MP-mp-2513,As8Pt4,As-Pt,As66.667Pt33.333,P a -3,cubic,6.064127,6.064127,6.064127,data/final/MP/cifs/As2Pt1-MP-mp-2513.cif,data/source/MP/raw/cifs/mp-2513.cif,mp-2513,0.2850000000000001,,2011-05-13 23:17:16,10.273813258770884,10.17188/1200514,"@misc{osti_1200514,
    author = ""Persson, Kristin"",
    title = ""Materials Data on As2Pt (SG:205) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1200514"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703806'}},0.0,6.00095178,520.0,-67.76840999,-5.647367499166666,"{'tags': ['Platinum diarsenide', 'Sperrylite', 'Platinum arsenide (1/2)']}",-67.76840999,-5.647367499166666,-0.5176526591666661,"['xas', 'elasticity', 'bandstructure']",True,"[24203, 611230, 611228, 43104, 38428, 52375, 24156, 56021]",True,2021-05-12 10:56:16.728000,NM,12,8,mp-2513,,As2Pt,"{'functional': 'PBE', 'labels': ['As', 'Pt'], 'pot_type': 'paw'}","{'As': 2.0, 'Pt': 1.0}",GGA,mp-2513,"['mp-921599', 'mp-920561', 'mp-907019', 'mp-2513', 'mp-1428861', 'mp-1703806', 'mp-1788429', 'mp-1595705']",0.0,"{'As': 8.0, 'Pt': 4.0}",223.00000060599683,[],NM,False,205,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0,0.0,0,0.0,MP,data/source/MP/cleaned/cifs/MP-mp-2513.cif,False,,data/final/MP/graphs/As2Pt1-MP-mp-2513.json,0,True,m-3,2,0,0,0,0,0,0,1,0,0,0,1.0,False
As2Fe1.8Pt0.2Sr1,3,0.0799999999999999,1.0,True,As2Fe1.8Pt0.2Sr1,As2Fe2Sr1,15.8,Ferrite,True,As40Fe36Pt4Sr20,As-Fe-Pt-Sr,4,Supercon,Sr1Fe1.8Pt0.2As2,MP-mp-4488,Sr1Fe2As2,As-Fe-Sr,As40Fe40Sr20,I 4/m m m,tetragonal,3.9729799997357778,3.9729799997357778,6.45523327,data/final/MP/cifs/As2Fe1.8Pt0.2Sr1-MP-mp-4488-synth_doped.cif,data/source/MP/raw/cifs/mp-4488.cif,mp-4488,0.0,,2011-05-13 03:37:13,6.319998834487784,10.17188/1208187,"@misc{osti_1208187,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr(FeAs)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208187"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672865'}},0.0,5.13397273,520.0,-30.61898897,-6.123797794,"{'tags': ['Strontium diiron arsenide - HT', 'Strontium diiron arsenide', 'Strontium diiron diarsenide', 'Iron strontium arsenide (2/1/2)', 'Strontium diiron arsenide - LT']}",-30.61898897,-6.123797794,-0.5342483613333335,"['xas', 'elasticity', 'bandstructure']",True,"[182330, 181993, 610527, 163209, 163208, 163869]",True,2021-05-12 10:56:20.740000,NM,5,8,mp-4488,,Sr(FeAs)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Fe': 2.0, 'As': 2.0}",GGA,mp-4488,"['mp-906356', 'mp-920135', 'mp-919110', 'mp-4488', 'mp-1439153', 'mp-1672865', 'mp-1873948', 'mp-1592272']",0.0029206,"{'Sr': 1.0, 'Fe': 2.0, 'As': 2.0}",91.7377588211838,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",3.183640016422098e-05,0.0029206,0,0.0029206,MP,data/source/MP/cleaned/cifs/MP-mp-4488.cif,True,,data/final/MP/graphs/As2Fe1.8Pt0.2Sr1-MP-mp-4488-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B0.95C0.95Lu1Ni1,2,0.0256410256410256,2.0,False,B1.9C1.9Lu2Ni2,B2C2Lu2Ni2,2.5,Other,True,B24.359C24.359Lu25.641Ni25.641,B-C-Lu-Ni,4,Supercon,Lu1Ni1B0.95C0.95,MP-mp-6188,Lu2Ni2B2C2,B-C-Lu-Ni,B25C25Lu25Ni25,P 4/n m m,tetragonal,3.499459,3.499459,7.54108,data/final/MP/cifs/B0.95C0.95Lu1Ni1-MP-mp-6188-synth_doped.cif,data/source/MP/raw/cifs/mp-6188.cif,mp-6188,0.0,,2011-05-13 11:39:58,9.22360692471969,10.17188/1277950,"@misc{osti_1277950,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LuNiBC (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277950"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701902'}},0.0,5.56637243,520.0,-56.94584528,-7.11823066,{'tags': []},-56.94584528,-7.11823066,-0.5664157422916656,"['xas', 'bandstructure']",True,"[54041, 75610]",True,2021-05-12 10:57:28.836000,NM,8,8,mp-6188,,LuNiBC,"{'functional': 'PBE', 'labels': ['Lu_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Lu': 1.0, 'Ni': 1.0, 'B': 1.0, 'C': 1.0}",GGA,mp-6188,"['mp-6188', 'mp-1007095', 'mp-1000629', 'mp-1426768', 'mp-1701902', 'mp-1796435', 'mp-1011840', 'mp-1591367']",0.0004347,"{'Lu': 2.0, 'Ni': 2.0, 'B': 2.0, 'C': 2.0}",92.34967413717082,[],NM,False,129,0,"[0, 0, 0, 0, 0, 0, 0, 0]",9.414218383798992e-06,0.0004347,0,0.0008694,MP,data/source/MP/cleaned/cifs/MP-mp-6188.cif,True,,data/final/MP/graphs/B0.95C0.95Lu1Ni1-MP-mp-6188-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Cr1Cu1O2,1,0.0,1.0,True,Cr1Cu1O2,Cr1Cu1O2,132.0,Cuprate,True,Cr25Cu25O50,Cr-Cu-O,3,Supercon,Cu1Cr1O2,MP-mp-510625,Cr2Cu2O4,Cr-Cu-O,Cr25Cu25O50,R -3 m,trigonal,3.0581244400000003,3.0581244400000003,5.978846852858602,data/final/MP/cifs/Cr1Cu1O2-MP-mp-510625.cif,data/source/MP/raw/cifs/mp-510625.cif,mp-510625,1.6568999999999998,,2013-05-24 06:28:56,5.295622232369865,10.17188/1263037,"@misc{osti_1263037,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CrCuO2 (SG:166) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1263037"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-1668463'}},0.0,3.93382979,520.0,-54.8289095,-6.8536136875,"{'tags': ['Copper(I) chromium(III) oxide', 'Copper chromate(II)', 'Mcconnellite', 'Delafossite', 'Copper(I) chromium oxide', 'High pressure experimental phase', 'Copper chromate(III)', 'Copper phyllo-chromate(III)']}",-54.8289095,-6.8536136875,-1.7848196500000002,"['diel', 'xas', 'elasticity', 'bandstructure']",True,"[194152, 194151, 163255, 157800, 163254, 163253, 189047, 402290, 26676, 184467]",True,2021-05-12 10:56:20.740000,AFM,8,76,mp-510625,oxide,CrCuO2,"{'functional': 'PBE', 'labels': ['Cr_pv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Cr': 1.0, 'Cu': 1.0, 'O': 2.0}",GGA+U,mp-510625,"['mp-795616', 'mp-797327', 'mp-797897', 'mp-773929', 'mp-797253', 'mp-797810', 'mp-796545', 'mp-818910', 'mp-603355', 'mp-510625', 'mp-1063675', 'mp-1063694', 'mp-1063667', 'mp-1063806', 'mp-1063784', 'mp-1063789', 'mp-1065894', 'mp-1065949', 'mp-1065921', 'mp-1066767', 'mp-1066725', 'mp-1066738', 'mp-1141280', 'mp-774030', 'mp-773391', 'mp-826047', 'mp-826790', 'mp-826786', 'mp-827727', 'mp-654963', 'mp-795614', 'mp-1273190', 'mp-1273411', 'mp-1273225', 'mp-1273677', 'mp-1273699', 'mp-1288167', 'mp-1274828', 'mp-1298222', 'mp-1294903', 'mp-1280458', 'mp-1279356', 'mp-1278287', 'mp-1278301', 'mp-1298390', 'mp-1292886', 'mp-1281782', 'mp-1276336', 'mp-1294276', 'mp-1295444', 'mp-1279881', 'mp-1278777', 'mp-1298808', 'mp-1296621', 'mp-1296628', 'mp-1281142', 'mp-1280053', 'mp-1298984', 'mp-1276750', 'mp-1291252', 'mp-1279028', 'mp-1442290', 'mp-1658860', 'mp-1668463', 'mp-1798257', 'mp-827547', 'mp-849126', 'mp-827819', 'mp-819586', 'mp-849147', 'mp-1593873', 'mp-1588350', 'mp-1063797', 'mp-1063685', 'mp-1066750', 'mp-1065935']",0.0,"{'Cr': 2.0, 'Cu': 2.0, 'O': 4.0}",92.52828756317238,[],AFM,True,166,1,"[-3.0, 3.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0,0.0,2,0.0,MP,data/source/MP/cleaned/cifs/MP-mp-510625.cif,False,,data/final/MP/graphs/Cr1Cu1O2-MP-mp-510625.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ga3Nb5,2,0.0499999999999999,1.2,True,Ga3.6Nb6,Ga4Nb6,1.35,Other,True,Ga37.5Nb62.5,Ga-Nb,2,Supercon,Ga3Nb5,MP-mp-11393,Nb6Ga4,Ga-Nb,Ga40Nb60,P 4/m b m,tetragonal,3.530963,6.95252,6.95252,data/final/MP/cifs/Ga3Nb5-MP-mp-11393-synth_doped.cif,data/source/MP/raw/cifs/mp-11393.cif,mp-11393,0.0,,2011-06-03 11:33:52,8.13671787756433,10.17188/1187796,"@misc{osti_1187796,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Ga2 (SG:127) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187796"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695514'}},0.0,4.77657274,520.0,-76.35239219,-7.635239219000001,{'tags': ['Gallium niobium (2/3)']},-76.35239219,-7.635239219000001,-0.3632177859999999,"['xas', 'elasticity', 'bandstructure']",True,[103832],True,2021-05-12 10:56:10.715000,NM,10,8,mp-11393,,Nb3Ga2,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Ga_d'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Ga': 2.0}",GGA,mp-11393,"['mp-11393', 'mp-912443', 'mp-928938', 'mp-929330', 'mp-1420809', 'mp-1695514', 'mp-1785628', 'mp-1601211']",0.00212295,"{'Nb': 6.0, 'Ga': 4.0}",170.67804530249143,[],NM,False,127,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.48766617433134e-05,0.00212295,0,0.0042459,MP,data/source/MP/cleaned/cifs/MP-mp-11393.cif,True,,data/final/MP/graphs/Ga3Nb5-MP-mp-11393-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Cu1Eu0.02La1.98O4,2,0.0057142857142857,1.0,True,Cu1Eu0.02La1.98O4,Cu1La2O4,0.0,Cuprate,True,Cu14.286Eu0.286La28.286O57.142857142857146,Cu-Eu-La-O,4,Supercon,La1.98Eu0.02Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1Eu0.02La1.98O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1Eu0.02La1.98O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ir4Lu5Si10,1,0.0,2.0,False,Ir8Lu10Si20,Ir8Lu10Si20,3.82,Other,True,Ir21.053Lu26.316Si52.632,Ir-Lu-Si,3,Supercon,Lu5Ir4Si10,MP-mp-542170,Lu10Si20Ir8,Ir-Lu-Si,Ir21.053Lu26.316Si52.632,P 4/m b m,tetragonal,4.209968,12.553443,12.553443,data/final/MP/cifs/Ir4Lu5Si10-MP-mp-542170.cif,data/source/MP/raw/cifs/mp-542170.cif,mp-542170,0.0,,2014-02-26 06:26:45,9.633976714725442,10.17188/1266443,"@misc{osti_1266443,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Lu5(Si5Ir2)2 (SG:127) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1266443"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1730128'}},0.0,7.10692048,520.0,-258.01102272,-6.789763755789474,"{'tags': ['Lutetium iridium silicide (5/4/10) - whiskers', 'Lutetium iridium silicide (5/4/10)']}",-258.01102272,-6.789763755789474,-0.8465208884210526,"['xas', 'bandstructure']",True,"[640788, 168655, 56695, 640790]",True,2021-05-12 10:57:15.388000,NM,38,10,mp-542170,,Lu5(Si5Ir2)2,"{'functional': 'PBE', 'labels': ['Lu_3', 'Si', 'Ir'], 'pot_type': 'paw'}","{'Lu': 5.0, 'Si': 10.0, 'Ir': 4.0}",GGA,mp-542170,"['mp-940622', 'mp-940197', 'mp-925770', 'mp-542170', 'mp-1144050', 'mp-1197492', 'mp-1203653', 'mp-1236864', 'mp-1389871', 'mp-1730128']",0.00209085,"{'Lu': 10.0, 'Si': 20.0, 'Ir': 8.0}",663.4443573135914,[],NM,False,127,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.303015398205322e-06,0.00209085,0,0.0041817,MP,data/source/MP/cleaned/cifs/MP-mp-542170.cif,False,,data/final/MP/graphs/Ir4Lu5Si10-MP-mp-542170.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
In1.1Te1,2,0.0476190476190476,3.636181818181818,False,In4Te3.636,In4Te4,2.8,Other,True,In52.381Te47.619,In-Te,2,Supercon,In1.1Te1,MP-mp-20320,In4Te4,In-Te,In50Te50,I 4/m c m,tetragonal,7.09032241992039,7.09032242,7.090322419999999,data/final/MP/cifs/In1.1Te1-MP-mp-20320-synth_doped.cif,data/source/MP/raw/cifs/mp-20320.cif,mp-20320,0.0137999999999998,,2014-02-21 15:12:57,5.986866155889604,10.17188/1195443,"@misc{osti_1195443,
    author = ""Persson, Kristin"",
    title = ""Materials Data on InTe (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195443"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701451'}},0.0119628062500001,5.53454906,520.0,-25.79504471,-3.22438058875,"{'tags': ['Indium telluride (1/1)', 'Indium telluride  - I']}",-25.79504471,-3.22438058875,-0.4878882587499995,"['xas', 'elasticity', 'bandstructure']",True,"[169418, 169424, 169421, 73389, 169430, 606, 640624, 169427, 60526]",True,2021-05-12 10:56:14.760000,NM,8,9,mp-20320,,InTe,"{'functional': 'PBE', 'labels': ['In_d', 'Te'], 'pot_type': 'paw'}","{'In': 1.0, 'Te': 1.0}",GGA,mp-20320,"['mp-922033', 'mp-922262', 'mp-907670', 'mp-20320', 'mp-1079589', 'mp-1238945', 'mp-1432943', 'mp-1701451', 'mp-1588026']",2.02e-05,"{'In': 4.0, 'Te': 4.0}",268.95176806385354,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0, 0, 0]",3.004256137881821e-07,2.02e-05,0,8.08e-05,MP,data/source/MP/cleaned/cifs/MP-mp-20320.cif,True,,data/final/MP/graphs/In1.1Te1-MP-mp-20320-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Pb1Pd2Yb1,1,0.0,1.0,True,Pb1Pd2Yb1,Pb1Pd2Yb1,2.65,Heavy_fermion,True,Pb25Pd50Yb25,Pb-Pd-Yb,3,Supercon,Pd2Yb1Pb1,MP-mp-865816,Yb1Pd2Pb1,Pb-Pd-Yb,Pb25Pd50Yb25,F m -3 m,cubic,4.845020709999999,4.845020709999999,4.845020709999999,data/final/MP/cifs/Pb1Pd2Yb1-MP-mp-865816.cif,data/source/MP/raw/cifs/mp-865816.cif,mp-865816,0.0,,2014-09-01 03:04:55,12.24589300180801,10.17188/1311018,"@misc{osti_1311018,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YbPd2Pb (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1311018"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1766652'}},0.0,5.39764114,520.0,-18.24488429,-4.5612210725,{'tags': []},-18.24488429,-4.5612210725,-0.6582163300000001,"['xas', 'bandstructure']",True,[],True,2021-05-12 10:57:53.781000,NM,4,8,mp-865816,,YbPd2Pb,"{'functional': 'PBE', 'labels': ['Yb_2', 'Pd', 'Pb_d'], 'pot_type': 'paw'}","{'Yb': 1.0, 'Pd': 2.0, 'Pb': 1.0}",GGA,mp-865816,"['mp-865816', 'mp-1053494', 'mp-1053482', 'mp-1425727', 'mp-1766652', 'mp-1798744', 'mp-1614517', 'mp-1053496']",0.0008138,"{'Yb': 1.0, 'Pd': 2.0, 'Pb': 1.0}",80.4214530923735,[],NM,False,225,0,"[0, 0, 0, 0]",1.011919044866368e-05,0.0008138,0,0.0008138,MP,data/source/MP/cleaned/cifs/MP-mp-865816.cif,False,,data/final/MP/graphs/Pb1Pd2Yb1-MP-mp-865816.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Mo1P2,1,0.0,2.0,False,Mo2P4,Mo2P4,0.0,Other,True,Mo33.333P66.667,Mo-P,2,Supercon,Mo1P2,MP-mp-1887,Mo2P4,Mo-P,Mo33.333P66.667,C m c 21,orthorhombic,3.158605997234015,5.010659,5.842050850000001,data/final/MP/cifs/Mo1P2-MP-mp-1887.cif,data/source/MP/raw/cifs/mp-1887.cif,mp-1887,0.0,,2011-05-13 00:37:57,5.8904735664473815,10.17188/1193576,"@misc{osti_1193576,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MoP2 (SG:36) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1193576"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698107'}},0.0,9.15797389,520.0,-46.43735931,-7.739559884999999,{'tags': ['Molybdenum phosphide']},-46.43735931,-7.739559884999999,-0.5154772038888886,"['xas', 'bandstructure']",True,"[43331, 37222]",True,2021-05-12 10:56:55.092000,NM,6,9,mp-1887,,MoP2,"{'functional': 'PBE', 'labels': ['Mo_pv', 'P'], 'pot_type': 'paw'}","{'Mo': 1.0, 'P': 2.0}",GGA,mp-1887,"['mp-921864', 'mp-907441', 'mp-920822', 'mp-1887', 'mp-1115949', 'mp-1476118', 'mp-1698107', 'mp-1784537', 'mp-1595181']",2.11e-05,"{'Mo': 2.0, 'P': 4.0}",89.01776700064818,[],NM,False,36,0,"[0, 0, 0, 0, 0, 0]",4.74062666610057e-07,2.11e-05,0,4.22e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1887.cif,False,,data/final/MP/graphs/Mo1P2-MP-mp-1887.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Nb4Ni1Si1,1,0.0,2.0,False,Nb8Ni2Si2,Nb8Ni2Si2,7.7,Other,True,Nb66.667Ni16.667Si16.667,Nb-Ni-Si,3,Supercon,Nb4Ni1Si1,MP-mp-22396,Nb8Si2Ni2,Nb-Ni-Si,Nb66.667Ni16.667Si16.667,P 4/m c c,tetragonal,4.9694,6.252903,6.252903,data/final/MP/cifs/Nb4Ni1Si1-MP-mp-22396.cif,data/source/MP/raw/cifs/mp-22396.cif,mp-22396,0.0,,2014-02-22 15:02:52,7.835388787135263,10.17188/1197611,"@misc{osti_1197611,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb4SiNi (SG:124) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197611"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697471'}},0.004152825277778,6.16529934,520.0,-107.54547239,-8.962122699166667,{'tags': ['Niobium nickel silicide (4/1/1)']},-107.54547239,-8.962122699166667,-0.3603442225000002,"['xas', 'elasticity', 'bandstructure']",True,[76559],True,2021-05-12 10:56:16.728000,NM,12,10,mp-22396,,Nb4SiNi,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Si', 'Ni_pv'], 'pot_type': 'paw'}","{'Nb': 4.0, 'Si': 1.0, 'Ni': 1.0}",GGA,mp-22396,"['mp-921211', 'mp-940035', 'mp-940461', 'mp-22396', 'mp-1125102', 'mp-1264829', 'mp-1436546', 'mp-1697471', 'mp-1832863', 'mp-1599391']",0.00022595,"{'Nb': 8.0, 'Si': 2.0, 'Ni': 2.0}",194.2975564816663,[],NM,False,89,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0]",2.32581411821636e-06,0.00022595,0,0.0004519,MP,data/source/MP/cleaned/cifs/MP-mp-22396.cif,False,,data/final/MP/graphs/Nb4Ni1Si1-MP-mp-22396.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
H0.9Pd1,3,0.0526315789473684,2.0,False,H1.8Pd2,H2Pd2,4.11,Other,True,H47.368Pd52.632,H-Pd,2,Supercon,H0.9Pd1,MP-mp-1184548,H2Pd2,H-Pd,H50Pd50,P 63 m c,hexagonal,2.968136003881316,2.96813585,5.040799,data/final/MP/cifs/H0.9Pd1-MP-mp-1184548-synth_doped.cif,data/source/MP/raw/cifs/mp-1184548.cif,mp-1184548,0.0,,2019-01-11 12:52:40.348000,9.276812227294194,,,{'GGA': {'task_id': 'mp-1734957'}},0.0,3.52113336,520.0,-17.47744839,-4.3693620975,{'tags': []},-17.47744839,-4.3693620975,-0.0830581699999992,['bandstructure'],True,[],True,2021-05-12 10:58:27.755000,NM,4,5,mp-1184548,,HPd,"{'functional': 'PBE', 'labels': ['H', 'Pd'], 'pot_type': 'paw'}","{'H': 1.0, 'Pd': 1.0}",GGA,mp-1184548,"['mp-1184548', 'mp-1426775', 'mp-1734957', 'mp-1792734', 'mp-1612181']",3.7e-05,"{'H': 2.0, 'Pd': 2.0}",38.45896345503417,[],NM,False,186,0,"[0, 0, 0, 0]",1.924128820749941e-06,3.7e-05,0,7.4e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1184548.cif,True,,data/final/MP/graphs/H0.9Pd1-MP-mp-1184548-synth_doped.json,0,True,6mm,0,5,0,0,0,0,0,1,0,0,0,1.0,False
Pd1Sb1Se1,1,0.0,4.0,False,Pd4Sb4Se4,Pd4Sb4Se4,1.0,Other,True,Pd33.333Sb33.333Se33.333,Pd-Sb-Se,3,Supercon,Pd1Sb1Se1,MP-mp-4368,Sb4Pd4Se4,Pd-Sb-Se,Pd33.333Sb33.333Se33.333,P 21 3,cubic,6.425214,6.425214,6.425214,data/final/MP/cifs/Pd1Sb1Se1-MP-mp-4368.cif,data/source/MP/raw/cifs/mp-4368.cif,mp-4368,0.0,,2011-05-14 01:34:13,7.690997634645339,10.17188/1208104,"@misc{osti_1208104,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SbPdSe (SG:198) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208104"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695661'}},0.0,6.11021002,520.0,-56.22419468,-4.685349556666666,"{'tags': ['Palladium antimonide selenide', 'Palladium antimonide selenide (1/1/1)', 'Milotaite']}",-56.22419468,-4.685349556666666,-0.6384180474479161,"['xas', 'elasticity', 'bandstructure']",True,"[648784, 93905, 171030]",True,2021-05-12 10:56:20.740000,NM,12,9,mp-4368,,SbPdSe,"{'functional': 'PBE', 'labels': ['Sb', 'Pd', 'Se'], 'pot_type': 'paw'}","{'Sb': 1.0, 'Pd': 1.0, 'Se': 1.0}",GGA,mp-4368,"['mp-927866', 'mp-911478', 'mp-927417', 'mp-4368', 'mp-1095636', 'mp-1116351', 'mp-1414127', 'mp-1695661', 'mp-1598067']",1.0125e-05,"{'Sb': 4.0, 'Pd': 4.0, 'Se': 4.0}",265.25451866897777,[],NM,False,198,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.526835441040748e-07,1.0125e-05,0,4.05e-05,MP,data/source/MP/cleaned/cifs/MP-mp-4368.cif,False,,data/final/MP/graphs/Pd1Sb1Se1-MP-mp-4368.json,0,True,23,1,0,0,0,0,0,0,1,0,0,0,1.0,False
Hf1Sb2,1,0.0,8.0,False,Hf8Sb16,Hf8Sb16,0.0,Other,True,Hf33.333Sb66.667,Hf-Sb,2,Supercon,Hf1Sb2,MP-mp-2180,Hf8Sb16,Hf-Sb,Hf33.333Sb66.667,P n n m,orthorhombic,3.902563,9.993212,15.119023,data/final/MP/cifs/Hf1Sb2-MP-mp-2180.cif,data/source/MP/raw/cifs/mp-2180.cif,mp-2180,0.0,,2011-05-16 18:36:31,9.507866505251217,10.17188/1197172,"@misc{osti_1197172,
    author = ""Persson, Kristin"",
    title = ""Materials Data on HfSb2 (SG:58) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197172"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1761295'}},0.0,7.84339669,520.0,-155.38570955,-6.474404564583334,"{'tags': ['Hafnium antimonide (1/2) - alpha', 'Hafnium antimonide (1/2)']}",-155.38570955,-6.474404564583334,-0.5306741212500002,"['xas', 'elasticity', 'bandstructure']",True,"[638875, 66780, 42879]",True,2021-05-12 10:56:16.728000,NM,24,9,mp-2180,,HfSb2,"{'functional': 'PBE', 'labels': ['Hf_pv', 'Sb'], 'pot_type': 'paw'}","{'Hf': 1.0, 'Sb': 2.0}",GGA,mp-2180,"['mp-908419', 'mp-923544', 'mp-922786', 'mp-2180', 'mp-1190825', 'mp-1437105', 'mp-1761295', 'mp-1887726', 'mp-1613742']",0.0009960875,"{'Hf': 8.0, 'Sb': 16.0}",589.6288856044265,[],NM,False,58,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.3514772078764957e-05,0.0009960875,0,0.0079687,MP,data/source/MP/cleaned/cifs/MP-mp-2180.cif,False,,data/final/MP/graphs/Hf1Sb2-MP-mp-2180.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
B2Mo5Si1,1,0.0,2.0,False,B4Mo10Si2,B4Mo10Si2,5.8,Other,True,B25Mo62.5Si12.5,B-Mo-Si,3,Supercon,Mo5Si1B2,MP-mp-4984,Si2B4Mo10,B-Mo-Si,B25Mo62.5Si12.5,I 4/m c m,tetragonal,6.053262003589644,6.053262003589644,7.032389360000001,data/final/MP/cifs/B2Mo5Si1-MP-mp-4984.cif,data/source/MP/raw/cifs/mp-4984.cif,mp-4984,0.0,,2011-05-16 02:25:24,8.599559367995916,10.17188/1208540,"@misc{osti_1208540,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SiB2Mo5 (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208540"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703196'}},0.0089142506250006,9.21890978,520.0,-152.5568123,-9.53480076875,"{'tags': ['Molybdenum boride silicide (5/2/1)', 'Molybdenum silicide boride (5/1/2)']}",-152.5568123,-9.53480076875,-0.3993866797916663,"['bandstructure', 'elasticity']",True,"[44454, 614839, 614840, 44489]",True,2021-05-12 10:56:20.740000,NM,16,9,mp-4984,,SiB2Mo5,"{'functional': 'PBE', 'labels': ['Si', 'B', 'Mo_pv'], 'pot_type': 'paw'}","{'Si': 1.0, 'B': 2.0, 'Mo': 5.0}",GGA,mp-4984,"['mp-925727', 'mp-926143', 'mp-910275', 'mp-4984', 'mp-1156468', 'mp-1420581', 'mp-1703196', 'mp-1834963', 'mp-1608389']",0.0040335,"{'Si': 2.0, 'B': 4.0, 'Mo': 10.0}",204.4527628177558,[],NM,False,140,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",3.9456546777950495e-05,0.0040335,0,0.008067,MP,data/source/MP/cleaned/cifs/MP-mp-4984.cif,False,,data/final/MP/graphs/B2Mo5Si1-MP-mp-4984.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
La0.25Sn3Th0.75,3,0.125,1.0,True,La0.25Sn3Th0.75,Sn3Th1,3.94,Other,True,La6.25Sn75Th18.75,La-Sn-Th,3,Supercon,La0.25Th0.75Sn3,MP-mp-435,Th1Sn3,Sn-Th,Sn75Th25,P m -3 m,cubic,4.766161,4.766161,4.766161,data/final/MP/cifs/La0.25Sn3Th0.75-MP-mp-435-synth_doped.cif,data/source/MP/raw/cifs/mp-435.cif,mp-435,0.0,,2011-05-13 04:44:32,9.020786584768093,10.17188/1208088,"@misc{osti_1208088,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ThSn3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208088"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1670958'}},0.0,8.72220011,520.0,-21.23825961,-5.3095649025,{'tags': ['Tin thorium (3/1)']},-21.23825961,-5.3095649025,-0.4489214487500002,"['xas', 'elasticity', 'bandstructure']",True,"[652775, 106083, 106082, 652770]",True,2021-05-12 10:56:20.740000,NM,4,8,mp-435,,ThSn3,"{'functional': 'PBE', 'labels': ['Th', 'Sn_d'], 'pot_type': 'paw'}","{'Th': 1.0, 'Sn': 3.0}",GGA,mp-435,"['mp-929162', 'mp-912835', 'mp-929520', 'mp-435', 'mp-1437678', 'mp-1670958', 'mp-1781858', 'mp-1588601']",0.0015074,"{'Th': 1.0, 'Sn': 3.0}",108.26949869377064,[],NM,False,221,0,"[0, 0, 0, 0]",1.3922665369159314e-05,0.0015074,0,0.0015074,MP,data/source/MP/cleaned/cifs/MP-mp-435.cif,True,,data/final/MP/graphs/La0.25Sn3Th0.75-MP-mp-435-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Fe1Se0.88,3,0.0638297872340425,2.0,False,Fe2Se1.76,Fe2Se2,8.843333333,Ferrite,True,Fe53.191Se46.809,Fe-Se,2,Supercon,Fe1Se0.88,MP-mp-20311,Fe2Se2,Fe-Se,Fe50Se50,P 4/n m m,tetragonal,3.688905,3.688905,5.854194,data/final/MP/cifs/Fe1Se0.88-MP-mp-20311-synth_doped.cif,data/source/MP/raw/cifs/mp-20311.cif,mp-20311,0.0,,2013-10-20 07:09:24,5.619828229873189,10.17188/1195438,"@misc{osti_1195438,
    author = ""Persson, Kristin"",
    title = ""Materials Data on FeSe (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195438"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668877'}},0.0,3.48880228,520.0,-25.01949237,-6.2548730925,"{'tags': ['Iron selenide - NN AFM', 'Iron selenide - orthorhombic, LT', 'Iron selenide', 'Iron sulfide', 'Iron selenide (1/1) - nonmagnetic', 'Iron selenide - tetragonal', 'Iron selenide - alpha LT', 'Iron selenide - LT', 'High pressure experimental phase', 'Iron selenide - alpha']}",-25.01949237,-6.2548730925,-0.5079131286718743,"['xas', 'elasticity', 'bandstructure']",True,"[196301, 196298, 196299, 196297, 290701, 165958, 185464, 163561, 169257, 163560, 977900, 169311, 169303, 26889, 166440, 162901, 169283, 165957, 169271, 977903, 169259, 977901, 185465, 165959, 169306, 169267, 163557, 169287, 169297, 169289, 163556, 169299, 163562, 166441, 182544, 163559, 169269, 169263, 169265, 169315, 169255, 166439, 169293, 169313, 163555, 169291, 169301, 165960, 169253, 169295, 169970, 163558, 169285, 169261, 169309]",True,2021-05-12 10:56:14.760000,NM,4,55,mp-20311,,FeSe,"{'functional': 'PBE', 'labels': ['Fe_pv', 'Se'], 'pot_type': 'paw'}","{'Fe': 1.0, 'Se': 1.0}",GGA,mp-20311,"['mp-684656', 'mp-20311', 'mp-1063646', 'mp-1063662', 'mp-1063681', 'mp-1063669', 'mp-1063680', 'mp-1063695', 'mp-1063686', 'mp-1063699', 'mp-1063715', 'mp-1063717', 'mp-1063876', 'mp-1063734', 'mp-1063891', 'mp-1063735', 'mp-1063910', 'mp-1063918', 'mp-1063922', 'mp-1063931', 'mp-1063774', 'mp-1063781', 'mp-1064091', 'mp-1064111', 'mp-1063801', 'mp-1064112', 'mp-1064180', 'mp-1064138', 'mp-1064153', 'mp-1065102', 'mp-1065123', 'mp-1065075', 'mp-1065161', 'mp-1065131', 'mp-1065030', 'mp-1065055', 'mp-1065085', 'mp-1065094', 'mp-1440814', 'mp-1668877', 'mp-1799618', 'mp-1593782', 'mp-1592730', 'mp-1065081', 'mp-1065148', 'mp-1063928', 'mp-1063726', 'mp-1063683', 'mp-1063709', 'mp-1063911', 'mp-1063795', 'mp-1065121', 'mp-1063725', 'mp-1064139', 'mp-1064165']",3.455e-05,"{'Fe': 2.0, 'Se': 2.0}",79.66398961559156,[],NM,False,129,0,"[0, 0, 0, 0]",8.673931638803586e-07,3.455e-05,0,6.91e-05,MP,data/source/MP/cleaned/cifs/MP-mp-20311.cif,True,,data/final/MP/graphs/Fe1Se0.88-MP-mp-20311-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Hg1Mg1,1,0.0,1.0,True,Hg1Mg1,Hg1Mg1,0.935,Other,True,Hg50Mg50,Hg-Mg,2,Supercon,Hg1Mg1,MP-mp-1408,Mg1Hg1,Hg-Mg,Hg50Mg50,P m -3 m,cubic,3.499559,3.499559,3.499559,data/final/MP/cifs/Hg1Mg1-MP-mp-1408.cif,data/source/MP/raw/cifs/mp-1408.cif,mp-1408,0.0,,2011-05-12 18:41:13,8.713425817011279,10.17188/1189919,"@misc{osti_1189919,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MgHg (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189919"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671315'}},0.0,3.99918141,520.0,-2.33452761,-1.167263805,{'tags': ['Mercury magnesium (1/1)']},-2.33452761,-1.167263805,-0.2152835974999999,"['xas', 'elasticity', 'bandstructure']",True,"[639081, 639094, 104313, 104314]",True,2021-05-12 10:56:12.755000,NM,2,7,mp-1408,,MgHg,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Hg'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Hg': 1.0}",GGA,mp-1408,"['mp-912569', 'mp-928978', 'mp-929370', 'mp-1408', 'mp-1442255', 'mp-1671315', 'mp-1793803']",0.000368,"{'Mg': 1.0, 'Hg': 1.0}",42.85879529196474,[],NM,False,221,0,"[0, 0]",8.586335604934594e-06,0.000368,0,0.000368,MP,data/source/MP/cleaned/cifs/MP-mp-1408.cif,False,,data/final/MP/graphs/Hg1Mg1-MP-mp-1408.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ce1In5Ir0.828Pt0.172,3,0.0491428571428571,1.0,True,Ce1In5Ir0.828Pt0.172,Ce1In5Ir1,0.0,Heavy_fermion,True,Ce14.286In71.429Ir11.829Pt2.457,Ce-In-Ir-Pt,4,Supercon,Ce1Ir0.828Pt0.172In5,MP-mp-20975,Ce1In5Ir1,Ce-In-Ir,Ce14.286In71.429Ir14.286,P 4/m m m,tetragonal,4.724199,4.724199,7.575801,data/final/MP/cifs/Ce1In5Ir0.828Pt0.172-MP-mp-20975-synth_doped.cif,data/source/MP/raw/cifs/mp-20975.cif,mp-20975,0.0,,2014-02-21 16:15:16,8.902153726103897,10.17188/1196209,"@misc{osti_1196209,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeIn5Ir (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196209"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688300'}},0.0,8.1498488,520.0,-31.20695684,-4.458136691428572,{'tags': ['Cerium iridium indide (1/1/5)']},-31.20695684,-4.458136691428572,-0.3824312307142854,"['xas', 'bandstructure']",True,[150225],True,2021-05-12 10:56:57.051000,FM,7,8,mp-20975,,CeIn5Ir,"{'functional': 'PBE', 'labels': ['Ce', 'In_d', 'Ir'], 'pot_type': 'paw'}","{'Ce': 1.0, 'In': 5.0, 'Ir': 1.0}",GGA,mp-20975,"['mp-919528', 'mp-918523', 'mp-905302', 'mp-20975', 'mp-1300982', 'mp-1688300', 'mp-1832383', 'mp-1591628']",0.1040192,"{'Ce': 1.0, 'In': 5.0, 'Ir': 1.0}",169.077152414387,[],FM,True,123,1,"[0.1, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0006152173638757,0.1040192,1,0.1040192,MP,data/source/MP/cleaned/cifs/MP-mp-20975.cif,True,,data/final/MP/graphs/Ce1In5Ir0.828Pt0.172-MP-mp-20975-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Al0.5Nb3Sn0.5,1,0.0,2.0,False,Al1Nb6Sn1,Al1Nb6Sn1,16.0,Other,True,Al12.5Nb75Sn12.5,Al-Nb-Sn,3,Supercon,Nb3Al0.5Sn0.5,MP-mp-1220362,Nb6Al1Sn1,Al-Nb-Sn,Al12.5Nb75Sn12.5,P m -3,cubic,5.271766,5.271766,5.271766,data/final/MP/cifs/Al0.5Nb3Sn0.5-MP-mp-1220362.cif,data/source/MP/raw/cifs/mp-1220362.cif,mp-1220362,0.0,,2019-01-12 21:13:16.743000,7.969227759613809,,,{'GGA': {'task_id': 'mp-1729666'}},0.0333399244999998,6.10276458,520.0,-69.63111786,-8.7038897325,{'tags': []},-69.63111786,-8.7038897325,-0.1585174918749992,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,8,5,mp-1220362,,Nb6AlSn,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al', 'Sn_d'], 'pot_type': 'paw'}","{'Nb': 6.0, 'Al': 1.0, 'Sn': 1.0}",GGA,mp-1220362,"['mp-1220362', 'mp-1393884', 'mp-1729666', 'mp-1779724', 'mp-1620242']",0.0883244,"{'Nb': 6.0, 'Al': 1.0, 'Sn': 1.0}",146.51037313724012,[],NM,False,200,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0006028542423904,0.0883244,0,0.0883244,MP,data/source/MP/cleaned/cifs/MP-mp-1220362.cif,False,,data/final/MP/graphs/Al0.5Nb3Sn0.5-MP-mp-1220362.json,0,True,m-3,2,0,0,0,0,0,0,1,0,0,0,1.0,False
Ce0.975Cu2Si2,2,0.0080402010050252,1.0,True,Ce0.975Cu2Si2,Ce1Cu2Si2,0.0,Heavy_fermion,True,Ce19.598Cu40.201Si40.201,Ce-Cu-Si,3,Supercon,Ce0.975Cu2Si2,MP-mp-5452,Ce1Cu2Si2,Ce-Cu-Si,Ce20Cu40Si40,I 4/m m m,tetragonal,4.075731996715381,4.075731996715381,5.70132195,data/final/MP/cifs/Ce0.975Cu2Si2-MP-mp-5452-synth_doped.cif,data/source/MP/raw/cifs/mp-5452.cif,mp-5452,0.0,,2011-05-13 06:29:11,6.571257460055593,10.17188/1266988,"@misc{osti_1266988,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ce(SiCu)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1266988"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668622'}},0.0,8.51519913,520.0,-27.86039596,-5.572079192,"{'tags': ['Cerium copper silicon (1/2/2)', 'Cerium copper silicide (1/2/2)']}",-27.86039596,-5.572079192,-0.5472530850000006,"['xas', 'elasticity', 'bandstructure']",True,"[620924, 620948, 102140, 620940, 620921, 620914, 164068, 620946, 620920, 620949, 102141, 620930, 620939, 620931, 620951, 620944, 657643, 657672, 620943, 55797, 52851]",True,2021-05-12 10:56:22.739000,NM,5,9,mp-5452,,Ce(CuSi)2,"{'functional': 'PBE', 'labels': ['Ce', 'Cu_pv', 'Si'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Cu': 2.0, 'Si': 2.0}",GGA,mp-5452,"['mp-5452', 'mp-1097881', 'mp-1156698', 'mp-1248439', 'mp-1440927', 'mp-1668622', 'mp-1798875', 'mp-1594230', 'mp-1595235']",0.01041,"{'Ce': 1.0, 'Cu': 2.0, 'Si': 2.0}",81.71700258012696,[],NM,False,139,0,"[-0.0, 0.0, 0.0, 0.0, 0.0]",0.0001273908693578,0.01041,0,0.01041,MP,data/source/MP/cleaned/cifs/MP-mp-5452.cif,True,,data/final/MP/graphs/Ce0.975Cu2Si2-MP-mp-5452-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B2C1Gd0.22Ni2Y0.78,3,0.0733333333333335,1.0,True,B2C1Gd0.22Ni2Y0.78,B2C1Ni2Y1,7.02,Other,True,B33.333C16.667Gd3.667Ni33.333Y13,B-C-Gd-Ni-Y,5,Supercon,Y0.78Gd0.22Ni2B2C1,MP-mp-6576,Y1Ni2B2C1,B-C-Ni-Y,B33.333C16.667Ni33.333Y16.667,I 4/m m m,tetragonal,3.548790000501972,3.548790000501972,5.76144136,data/final/MP/cifs/B2C1Gd0.22Ni2Y0.78-MP-mp-6576-synth_doped.cif,data/source/MP/raw/cifs/mp-6576.cif,mp-6576,0.0,,2011-05-13 05:21:43,6.099730998852292,10.17188/1281366,"@misc{osti_1281366,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281366"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688230'}},0.0,6.81083016,520.0,-43.677878,-7.279646333333333,{'tags': []},-43.677878,-7.279646333333333,-0.5109282141666659,"['xas', 'bandstructure']",True,"[75816, 89142, 83231, 79574, 41549]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6576,,YNi2B2C,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6576,"['mp-6576', 'mp-1007054', 'mp-1000583', 'mp-1439516', 'mp-1688230', 'mp-1794280', 'mp-1011792', 'mp-1597064']",0.0006603,"{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.3152437079014,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",1.010943177297096e-05,0.0006603,0,0.0006603,MP,data/source/MP/cleaned/cifs/MP-mp-6576.cif,True,,data/final/MP/graphs/B2C1Gd0.22Ni2Y0.78-MP-mp-6576-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Cu1Pr0.1Sr0.9O2,2,0.0499999999999999,2.0,False,Cu2Pr0.2Sr1.8O4,Cu2Sr2O4,41.5,Cuprate,True,Cu25Pr2.5Sr22.5O50,Cu-Pr-Sr-O,4,Supercon,Sr0.9Pr0.1Cu1O2,MP-mp-5787,Sr2Cu2O4,Cu-Sr-O,Cu25Sr25O50,C m c m,orthorhombic,3.644437999912225,3.974263,8.32909336,data/final/MP/cifs/Cu1Pr0.1Sr0.9O2-MP-mp-5787-synth_doped.cif,data/source/MP/raw/cifs/mp-5787.cif,mp-5787,0.0,,2011-05-13 22:43:08,5.167573150857569,10.17188/1276630,"@misc{osti_1276630,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SrCuO2 (SG:63) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1276630"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703560'}},0.0,3.45760864,520.0,-45.24374469,-5.65546808625,"{'tags': ['Strontium cuprate', 'Strontium copper oxide']}",-45.24374469,-5.65546808625,-2.0778125529166664,"['xas', 'elasticity', 'bandstructure']",True,"[77291, 93653, 202992, 16217, 83051, 77293]",True,2021-05-12 10:56:27.046000,NM,8,8,mp-5787,oxide,SrCuO2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Cu': 1.0, 'O': 2.0}",GGA,mp-5787,"['mp-924142', 'mp-909103', 'mp-5787', 'mp-924940', 'mp-1475985', 'mp-1703560', 'mp-1802910', 'mp-1593696']",4e-07,"{'Sr': 2.0, 'Cu': 2.0, 'O': 4.0}",117.71572347282628,[],NM,False,63,0,"[0, 0, 0, 0, 0, 0, 0, 0]",6.796033498317439e-09,4e-07,0,8e-07,MP,data/source/MP/cleaned/cifs/MP-mp-5787.cif,True,,data/final/MP/graphs/Cu1Pr0.1Sr0.9O2-MP-mp-5787-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Cu1K0.065La1.935O4,2,0.0185714285714285,1.0,True,Cu1K0.065La1.935O4,Cu1La2O4,20.0,Cuprate,True,Cu14.286K0.929La27.643O57.142857142857146,Cu-K-La-O,4,Supercon,La1.935K0.065Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1K0.065La1.935O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1K0.065La1.935O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ge0.27V0.73,2,0.04,8.0,False,Ge2.16V5.84,Ge2V6,6.6,Other,True,Ge27V73,Ge-V,2,Supercon,Ge0.27V0.73,MP-mp-1221,V6Ge2,Ge-V,Ge25V75,P m -3 n,cubic,4.766075,4.766075,4.766075,data/final/MP/cifs/Ge0.27V0.73-MP-mp-1221-synth_doped.cif,data/source/MP/raw/cifs/mp-1221.cif,mp-1221,0.0,,2011-05-14 09:51:59,6.9163131280226695,10.17188/1188652,"@misc{osti_1188652,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Ge (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188652"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668516'}},0.0,6.92904659,520.0,-66.42968935,-8.30371116875,"{'tags': ['Vanadium germanium (3/1)', 'Germanium vanadium (1/3)', 'Vanadium germanide (3/1)']}",-66.42968935,-8.30371116875,-0.3350246525000004,"['xas', 'elasticity', 'bandstructure']",True,"[638096, 186004, 638087, 20212, 603983, 638107, 56052, 638103, 638102, 638101, 638083, 638099, 638105, 638106, 638082, 638097, 638090]",True,2021-05-12 10:56:12.755000,FM,8,10,mp-1221,,V3Ge,"{'functional': 'PBE', 'labels': ['V_pv', 'Ge_d'], 'pot_type': 'paw'}","{'V': 3.0, 'Ge': 1.0}",GGA,mp-1221,"['mp-927353', 'mp-911391', 'mp-927792', 'mp-1221', 'mp-1078697', 'mp-1440633', 'mp-1668516', 'mp-1925837', 'mp-1587840', 'mp-1589746']",0.35270295,"{'V': 6.0, 'Ge': 2.0}",108.26363799652664,[],FM,True,223,1,"[0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.0, 0.0]",0.006515630853109,0.35270295,6,0.7054059,MP,data/source/MP/cleaned/cifs/MP-mp-1221.cif,True,,data/final/MP/graphs/Ge0.27V0.73-MP-mp-1221-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ge0.23Mo0.77,2,0.04,8.0,False,Ge1.84Mo6.16,Ge2Mo6,2.16,Other,True,Ge23Mo77,Ge-Mo,2,Supercon,Ge0.23Mo0.77,MP-mp-494,Ge2Mo6,Ge-Mo,Ge25Mo75,P m -3 n,cubic,4.971812,4.971812,4.971812,data/final/MP/cifs/Ge0.23Mo0.77-MP-mp-494-synth_doped.cif,data/source/MP/raw/cifs/mp-494.cif,mp-494,0.0,,2011-05-14 14:16:25,9.740742815086204,10.17188/1208502,"@misc{osti_1208502,
    author = ""Persson, Kristin"",
    title = ""Materials Data on GeMo3 (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208502"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696172'}},0.0,8.2831284,520.0,-75.51854952,-9.43981869,"{'tags': ['Germanium molybdenum (1/3)', 'Molybdenum germanide (3/1)']}",-75.51854952,-9.43981869,-0.149829453749998,"['xas', 'bandstructure']",True,"[53717, 637137, 637141]",True,2021-05-12 10:57:08.928000,NM,8,6,mp-494,,GeMo3,"{'functional': 'PBE', 'labels': ['Ge_d', 'Mo_pv'], 'pot_type': 'paw'}","{'Ge': 1.0, 'Mo': 3.0}",GGA,mp-494,"['mp-494', 'mp-990695', 'mp-1427432', 'mp-1696172', 'mp-1784792', 'mp-1588710']",0.00019645,"{'Ge': 2.0, 'Mo': 6.0}",122.89779605300846,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",3.1969653860231457e-06,0.00019645,0,0.0003929,MP,data/source/MP/cleaned/cifs/MP-mp-494.cif,True,,data/final/MP/graphs/Ge0.23Mo0.77-MP-mp-494-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Mo0.25Ru0.75,1,0.0,8.0,False,Mo2Ru6,Mo2Ru6,2.6,Other,True,Mo25Ru75,Mo-Ru,2,Supercon,Mo0.25Ru0.75,MP-mp-975834,Mo2Ru6,Mo-Ru,Mo25Ru75,P 63/m m c,hexagonal,4.372838,5.515080002607994,5.51507967,data/final/MP/cifs/Mo0.25Ru0.75-MP-mp-975834.cif,data/source/MP/raw/cifs/mp-975834.cif,mp-975834,0.0,,2015-09-17 12:17:25,11.508470490145957,10.17188/1314893,"@misc{osti_1314893,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MoRu3 (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1314893"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1755187'}},0.0,8.00366563,520.0,-77.82641629,-9.72830203625,{'tags': []},-77.82641629,-9.72830203625,-0.0610990375,"['xas', 'elasticity', 'bandstructure']",True,[],True,2021-05-12 10:56:35.166000,NM,8,8,mp-975834,,MoRu3,"{'functional': 'PBE', 'labels': ['Mo_pv', 'Ru_pv'], 'pot_type': 'paw'}","{'Mo': 1.0, 'Ru': 3.0}",GGA,mp-975834,"['mp-975903', 'mp-975871', 'mp-975834', 'mp-1411550', 'mp-1755187', 'mp-1786752', 'mp-975944', 'mp-1622055']",0.0002813,"{'Mo': 2.0, 'Ru': 6.0}",115.18544866599105,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",4.884297509066437e-06,0.0002813,0,0.0005626,MP,data/source/MP/cleaned/cifs/MP-mp-975834.cif,False,,data/final/MP/graphs/Mo0.25Ru0.75-MP-mp-975834.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Be17Zr2,1,0.0,1.0,True,Be17Zr2,Be17Zr2,0.0,Other,True,Be89.474Zr10.526,Be-Zr,2,Supercon,Be17Zr2,MP-mp-2544,Zr2Be17,Be-Zr,Be89.474Zr10.526,R -3 m,trigonal,5.6745839,5.6745839,5.67458371,data/final/MP/cifs/Be17Zr2-MP-mp-2544.cif,data/source/MP/raw/cifs/mp-2544.cif,mp-2544,0.0,,2011-05-14 08:07:32,3.11580557750263,10.17188/1200621,"@misc{osti_1200621,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Zr2Be17 (SG:166) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1200621"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1670354'}},0.0,4.22142721,520.0,-85.17318712,-4.482799322105262,{'tags': ['Beryllium zirconium (17/2)']},-85.17318712,-4.482799322105262,-0.2372509028947366,"['xas', 'bandstructure']",True,"[616514, 58759]",True,2021-05-12 10:57:01.079000,NM,19,8,mp-2544,,Zr2Be17,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Be_sv'], 'pot_type': 'paw'}","{'Zr': 2.0, 'Be': 17.0}",GGA,mp-2544,"['mp-941404', 'mp-931954', 'mp-941085', 'mp-2544', 'mp-1419512', 'mp-1670354', 'mp-1832143', 'mp-1598372']",8.6e-06,"{'Zr': 2.0, 'Be': 17.0}",178.88420269695877,[],NM,False,166,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.8075793559976615e-08,8.6e-06,0,8.6e-06,MP,data/source/MP/cleaned/cifs/MP-mp-2544.cif,False,,data/final/MP/graphs/Be17Zr2-MP-mp-2544.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ag1B2,1,0.0,1.0,True,Ag1B2,Ag1B2,6.7,Other,True,Ag33.333B66.667,Ag-B,2,Supercon,Ag1B2,MP-mp-12062,Ag1B2,Ag-B,Ag33.333B66.667,P 6/m m m,hexagonal,3.0268039954203663,3.02680386,4.063922,data/final/MP/cifs/Ag1B2-MP-mp-12062.cif,data/source/MP/raw/cifs/mp-12062.cif,mp-12062,0.0,,2011-05-27 17:57:33,6.668703845978472,10.17188/1188544,"@misc{osti_1188544,
    author = ""Persson, Kristin"",
    title = ""Materials Data on AgB2 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188544"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1674390'}},0.5238218649999995,4.46193248,520.0,-14.61987395,-4.873291316666667,{'tags': ['Silver boride (1/2)']},-14.61987395,-4.873291316666667,0.5238218650000004,"['xas', 'elasticity', 'bandstructure']",True,"[43821, 604797, 187031]",True,2021-05-12 10:56:12.755000,NM,3,16,mp-12062,,AgB2,"{'functional': 'PBE', 'labels': ['Ag', 'B'], 'pot_type': 'paw'}","{'Ag': 1.0, 'B': 2.0}",GGA,mp-12062,"['mp-991632', 'mp-993549', 'mp-12062', 'mp-1061831', 'mp-1061879', 'mp-1061858', 'mp-1062981', 'mp-1062923', 'mp-1062953', 'mp-1440168', 'mp-1674390', 'mp-1781467', 'mp-994842', 'mp-1596140', 'mp-1061878', 'mp-1062968']",0.0006201,"{'Ag': 1.0, 'B': 2.0}",32.243677453380414,[],NM,False,191,0,"[0, 0, 0]",1.923167730779384e-05,0.0006201,0,0.0006201,MP,data/source/MP/cleaned/cifs/MP-mp-12062.cif,False,,data/final/MP/graphs/Ag1B2-MP-mp-12062.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ba0.95K0.05Sb2Ti2O1,2,0.0166666666666666,1.0,True,Ba0.95K0.05Sb2Ti2O1,Ba1Sb2Ti2O1,4.25,Oxide,True,Ba15.833K0.833Sb33.333Ti33.333O16.666666666666668,Ba-K-Sb-Ti-O,5,Supercon,Ba0.95K0.05Ti2Sb2O1,MP-mp-1070806,Ba1Ti2Sb2O1,Ba-Sb-Ti-O,Ba16.667Sb33.333Ti33.333O16.666666666666668,P 4/m m m,tetragonal,4.113474,4.113474,8.312382,data/final/MP/cifs/Ba0.95K0.05Sb2Ti2O1-MP-mp-1070806-synth_doped.cif,data/source/MP/raw/cifs/mp-1070806.cif,mp-1070806,0.0,,2018-03-22 04:02:04,5.8154485533321445,,,{'GGA': {'task_id': 'mp-1702174'}},0.0,5.89751533,520.0,-39.14932631,-6.524887718333333,{'tags': []},-39.14932631,-6.524887718333333,-1.5507346602777776,['bandstructure'],True,"[430061, 237789, 430060]",True,2021-05-12 10:58:14.654000,NM,6,16,mp-1070806,oxide,BaTi2Sb2O,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ti_pv', 'Sb', 'O'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Ti': 2.0, 'Sb': 2.0, 'O': 1.0}",GGA,mp-1070806,"['mp-1071055', 'mp-1071068', 'mp-1071083', 'mp-1071088', 'mp-1070806', 'mp-1071124', 'mp-1070846', 'mp-1070900', 'mp-1071137', 'mp-1423542', 'mp-1702174', 'mp-1785425', 'mp-1588663', 'mp-1070899', 'mp-1071129', 'mp-1071119']",0.001055,"{'Ba': 1.0, 'Ti': 2.0, 'Sb': 2.0, 'O': 1.0}",140.65105900950408,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0]",7.500832254158225e-06,0.001055,0,0.001055,MP,data/source/MP/cleaned/cifs/MP-mp-1070806.cif,True,,data/final/MP/graphs/Ba0.95K0.05Sb2Ti2O1-MP-mp-1070806-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
La1P12Ru4,1,0.0,1.0,True,La1P12Ru4,La1P12Ru4,6.923333333,Other,True,La5.882P70.588Ru23.529,La-P-Ru,3,Supercon,La1Ru4P12,MP-mp-15727,La1P12Ru4,La-P-Ru,La5.882P70.588Ru23.529,I m -3,cubic,7.024796241557287,7.02479624,7.02479624,data/final/MP/cifs/La1P12Ru4-MP-mp-15727.cif,data/source/MP/raw/cifs/mp-15727.cif,mp-15727,0.0,,2011-06-04 01:34:53,5.692846467357808,10.17188/1191342,"@misc{osti_1191342,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La(P3Ru)4 (SG:204) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191342"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1674189'}},0.0,8.3313753,520.0,-118.66109886,-6.980064638823529,{'tags': ['Lanthanum ruthenium phosphide (1/4/12)']},-118.66109886,-6.980064638823529,-0.6863472385294116,"['xas', 'bandstructure']",True,"[50596, 641633]",True,2021-05-12 10:56:53.126000,NM,17,7,mp-15727,,La(P3Ru)4,"{'functional': 'PBE', 'labels': ['La', 'P', 'Ru_pv'], 'pot_type': 'paw'}","{'La': 1.0, 'P': 12.0, 'Ru': 4.0}",GGA,mp-15727,"['mp-994000', 'mp-992442', 'mp-15727', 'mp-1419602', 'mp-1674189', 'mp-995090', 'mp-1600306']",0.0007731,"{'La': 1.0, 'P': 12.0, 'Ru': 4.0}",266.8574331210477,[],NM,False,204,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",2.8970525233573632e-06,0.0007731,0,0.0007731,MP,data/source/MP/cleaned/cifs/MP-mp-15727.cif,False,,data/final/MP/graphs/La1P12Ru4-MP-mp-15727.json,0,True,m-3,2,0,0,0,0,0,0,0,0,1,0,1.0,False
Pb1Pd2U1,1,0.0,1.0,True,Pb1Pd2U1,Pb1Pd2U1,0.0,Heavy_fermion,True,Pb25Pd50U25,Pb-Pd-U,3,Supercon,Pd2U1Pb1,MP-mp-1206611,U1Pd2Pb1,Pb-Pd-U,Pb25Pd50U25,F m -3 m,cubic,4.89968148,4.899681479999999,4.899681479999999,data/final/MP/cifs/Pb1Pd2U1-MP-mp-1206611.cif,data/source/MP/raw/cifs/mp-1206611.cif,mp-1206611,0.0,,2019-01-12 09:53:13.939000,13.13808066805788,,,{'GGA': {'task_id': 'mp-1766433'}},0.1708449829166669,8.45035634,520.0,-26.12382456,-6.53095614,"{'tags': ['b.c.c. atom arrangement', 'Cu2MnAl', 'UPd2Pb']}",-26.12382456,-6.53095614,-0.1900009649999994,['bandstructure'],True,[],True,2021-05-12 10:58:39.488000,FM,4,5,mp-1206611,,UPd2Pb,"{'functional': 'PBE', 'labels': ['U', 'Pd', 'Pb_d'], 'pot_type': 'paw'}","{'U': 1.0, 'Pd': 2.0, 'Pb': 1.0}",GGA,mp-1206611,"['mp-1206611', 'mp-1427552', 'mp-1766433', 'mp-1799662', 'mp-1616642']",0.1349573,"{'U': 1.0, 'Pd': 2.0, 'Pb': 1.0}",83.17418359491724,[],FM,True,225,1,"[0.2, -0.0, -0.0, -0.0]",0.0016225864104333,0.1349573,1,0.1349573,MP,data/source/MP/cleaned/cifs/MP-mp-1206611.cif,False,,data/final/MP/graphs/Pb1Pd2U1-MP-mp-1206611.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Al0.93Ge0.07Nb3,2,0.0349999999999999,2.0,False,Al1.86Ge0.14Nb6,Al2Nb6,20.0,Other,True,Al23.25Ge1.75Nb75,Al-Ge-Nb,3,Supercon,Nb3Al0.93Ge0.07,MP-mp-796,Nb6Al2,Al-Nb,Al25Nb75,P m -3 n,cubic,5.215254,5.215254,5.215254,data/final/MP/cifs/Al0.93Ge0.07Nb3-MP-mp-796-synth_doped.cif,data/source/MP/raw/cifs/mp-796.cif,mp-796,0.0,,2011-05-13 16:07:37,7.157298025966356,,,{'GGA': {'task_id': 'mp-1686893'}},0.0460773865000003,5.52947534,520.0,-69.48918494,-8.6861481175,"{'tags': ['Aluminium niobium (1/3)', 'Niobium aluminide (3/1)', 'Aluminum niobium (1/3)']}",-69.48918494,-8.6861481175,-0.1737753800000003,"['bandstructure', 'elasticity']",True,"[608675, 608654, 608688, 608668, 608669, 608685, 608676, 608683, 58014, 608657, 107856, 608655, 608666, 608691, 608656, 608665, 608673, 608653, 608661]",True,2021-05-12 10:56:31.128000,NM,8,10,mp-796,,Nb3Al,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Al': 1.0}",GGA,mp-796,"['mp-911586', 'mp-927906', 'mp-796', 'mp-927472', 'mp-1260512', 'mp-1440919', 'mp-1686893', 'mp-1927652', 'mp-1591599', 'mp-1587739']",0.16323955,"{'Nb': 6.0, 'Al': 2.0}",141.8490379078192,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0023015954483396,0.16323955,0,0.3264791,MP,data/source/MP/cleaned/cifs/MP-mp-796.cif,True,,data/final/MP/graphs/Al0.93Ge0.07Nb3-MP-mp-796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Cu3Y0.9Zn0.1O7,2,0.0153846153846153,1.0,True,Ba2Cu3Y0.9Zn0.1O7,Ba2Cu3Y1O7,54.9,Cuprate,True,Ba15.385Cu23.077Y6.923Zn0.769O53.84615384615385,Ba-Cu-Y-Zn-O,5,Supercon,Y0.9Zn0.1Ba2Cu3O7,MP-mp-20674,Ba2Y1Cu3O7,Ba-Cu-Y-O,Ba15.385Cu23.077Y7.692O53.84615384615385,P m m m,orthorhombic,3.844668,3.926152,11.823664,data/final/MP/cifs/Ba2Cu3Y0.9Zn0.1O7-MP-mp-20674-synth_doped.cif,data/source/MP/raw/cifs/mp-20674.cif,mp-20674,0.0,,2014-02-22 18:23:22,6.198285186087997,10.17188/1195834,"@misc{osti_1195834,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2YCu3O7 (SG:47) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195834"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686609'}},0.0313759126602519,3.28295453,520.0,-80.7708035,-6.213138730769231,"{'tags': ['Yttrium barium copper oxide (1/2/3/7)', 'Dibarium yttrium dicopper copper(III) oxide', 'Yttrium barium copper oxide (1/2/3/6.93)', 'Dibarium yttrium copper(III) dicopper oxide', 'High pressure experimental phase', 'Yttrium dibarium dicopper copper(III) oxide']}",-80.7708035,-6.213138730769231,-2.180157206282052,"['xas', 'elasticity', 'bandstructure']",True,"[196266, 196264, 196265, 71423, 66620, 63483, 66621, 164530, 56507, 63487, 66602, 66601, 68394, 63486, 63485, 202774, 62466, 62465, 41646, 65224, 202773, 66600, 63335, 66611, 78598, 66617, 81175, 66610, 66619, 66615, 63484, 86958, 262809, 66609, 184677, 202775, 66616, 63488, 66618, 66623, 202771, 66622, 202772, 77737, 202770, 62928, 77745]",True,2021-05-12 10:56:14.760000,NM,13,14,mp-20674,oxide,Ba2YCu3O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Cu': 3.0, 'O': 7.0}",GGA,mp-20674,"['mp-923155', 'mp-917354', 'mp-922372', 'mp-20674', 'mp-1103385', 'mp-1103741', 'mp-1103748', 'mp-1104329', 'mp-1104589', 'mp-1440689', 'mp-1686609', 'mp-1832558', 'mp-1596594', 'mp-1592890']",0.0001806,"{'Ba': 2.0, 'Y': 1.0, 'Cu': 3.0, 'O': 7.0}",178.47526348558395,[],NM,False,47,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.0119049355799813e-06,0.0001806,0,0.0001806,MP,data/source/MP/cleaned/cifs/MP-mp-20674.cif,True,,data/final/MP/graphs/Ba2Cu3Y0.9Zn0.1O7-MP-mp-20674-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
B5Mo1.7Nb0.3,3,0.0857142857142857,1.0,True,B5Mo1.7Nb0.3,B5Mo2,8.3,Other,True,B71.429Mo24.286Nb4.286,B-Mo-Nb,3,Supercon,B5Mo1.7Nb0.3,MP-mp-7229,B5Mo2,B-Mo,B71.429Mo28.571,R -3 m,trigonal,3.086062143206312,3.086062143206312,7.38317517,data/final/MP/cifs/B5Mo1.7Nb0.3-MP-mp-7229-synth_doped.cif,data/source/MP/raw/cifs/mp-7229.cif,mp-7229,0.0,,2011-05-27 17:15:57,6.910597742884047,10.17188/1287525,"@misc{osti_1287525,
    author = ""Persson, Kristin"",
    title = ""Materials Data on B5Mo2 (SG:166) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1287525"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678538'}},0.4354736101190504,10.26159619,520.0,-54.63026953,-7.804324218571429,"{'tags': ['Molybdenum boride (2/5)', 'Molybdenum boride (1/2.5) - epsilon']}",-54.63026953,-7.804324218571429,0.0654250548809522,['bandstructure'],True,"[157530, 614795, 614810, 24282]",True,2021-05-12 10:58:55.498000,NM,7,11,mp-7229,,B5Mo2,"{'functional': 'PBE', 'labels': ['B', 'Mo_pv'], 'pot_type': 'paw'}","{'B': 5.0, 'Mo': 2.0}",GGA,mp-7229,"['mp-1001204', 'mp-7229', 'mp-1007569', 'mp-1077992', 'mp-1078025', 'mp-1078031', 'mp-1441558', 'mp-1678538', 'mp-1793658', 'mp-1012321', 'mp-1593525']",0.0189101,"{'B': 5.0, 'Mo': 2.0}",59.09541989544843,[],NM,False,166,0,"[0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0]",0.0003199926497426,0.0189101,0,0.0189101,MP,data/source/MP/cleaned/cifs/MP-mp-7229.cif,True,,data/final/MP/graphs/B5Mo1.7Nb0.3-MP-mp-7229-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ce1Cu6,1,0.0,4.0,False,Ce4Cu24,Ce4Cu24,0.0,Heavy_fermion,True,Ce14.286Cu85.714,Ce-Cu,2,Supercon,Ce1Cu6,MP-mp-581942,Ce4Cu24,Ce-Cu,Ce14.286Cu85.714,P 1 21/c 1,monoclinic,5.027011,8.06466072,10.104341,data/final/MP/cifs/Ce1Cu6-MP-mp-581942.cif,data/source/MP/raw/cifs/mp-581942.cif,mp-581942,0.0,,2014-02-24 21:13:30,8.455393218363962,10.17188/1276918,"@misc{osti_1276918,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeCu6 (SG:14) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1276918"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1765366'}},0.0,7.10951255,520.0,-125.23915767,-4.472827059642857,"{'tags': ['Cerium copper (1/6)', 'Cerium copper (1/6) - LT']}",-125.23915767,-4.472827059642857,-0.1116371774999999,['xas'],False,"[102128, 174100]",True,2021-05-12 10:57:26.891000,FM,28,4,mp-581942,,CeCu6,"{'functional': 'PBE', 'labels': ['Ce', 'Cu_pv'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Cu': 6.0}",GGA,mp-581942,"['mp-581942', 'mp-1384053', 'mp-1765366', 'mp-1820179']",0.5645802,"{'Ce': 4.0, 'Cu': 24.0}",409.5808498331339,[],FM,True,14,1,"[0.4, 0.4, 0.4, 0.4, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0055137363011968,0.5645802,4,2.2583208,MP,data/source/MP/cleaned/cifs/MP-mp-581942.cif,False,,data/final/MP/graphs/Ce1Cu6-MP-mp-581942.json,0,True,2/m,0,0,3,0,0,0,0,1,0,0,0,1.0,False
Ba2Cu1Hg1O4.033,2,0.004108054276111,0.9919543763947434,True,Ba1.984Cu0.992Hg0.992O4,Ba2Cu1Hg1O4,48.0,Cuprate,True,Ba24.897Cu12.449Hg12.449O50.20540271380555,Ba-Cu-Hg-O,4,Supercon,Hg1Ba2Cu1O4.033,MP-mp-6562,Ba2Cu1Hg1O4,Ba-Cu-Hg-O,Ba25Cu12.5Hg12.5O50,P 4/m m m,tetragonal,3.933714,3.933714,9.827602,data/final/MP/cifs/Ba2Cu1Hg1O4.033-MP-mp-6562-synth_doped.cif,data/source/MP/raw/cifs/mp-6562.cif,mp-6562,0.0,,2011-05-13 18:18:06,6.582036471328142,10.17188/1281336,"@misc{osti_1281336,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2CuHgO4 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281336"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697135'}},0.0234340381250053,2.58068675,520.0,-40.91481298,-5.1143516225,"{'tags': ['Mercury dibarium copper oxide', 'High pressure experimental phase']}",-40.91481298,-5.1143516225,-1.953767533125,"['xas', 'bandstructure']",True,"[75722, 75720, 75724, 75721, 75723]",True,2021-05-12 10:57:32.679000,NM,8,8,mp-6562,oxide,Ba2CuHgO4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Cu_pv', 'Hg', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",GGA,mp-6562,"['mp-6562', 'mp-990899', 'mp-992892', 'mp-1435690', 'mp-1697135', 'mp-1878488', 'mp-994198', 'mp-1592659']",0.0003984,"{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",152.07335344042525,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0, 0, 0]",2.619788352047311e-06,0.0003984,0,0.0003984,MP,data/source/MP/cleaned/cifs/MP-mp-6562.cif,True,,data/final/MP/graphs/Ba2Cu1Hg1O4.033-MP-mp-6562-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
C1.45Th1,2,0.0163265306122449,8.0,False,C11.6Th8,C12Th8,4.1,Other,True,C59.184Th40.816,C-Th,2,Supercon,C1.45Th1,MP-mp-1188514,Th8C12,C-Th,C60Th40,I -4 3 d,cubic,7.414620251643706,7.41462025,7.41462025,data/final/MP/cifs/C1.45Th1-MP-mp-1188514-synth_doped.cif,data/source/MP/raw/cifs/mp-1188514.cif,mp-1188514,0.0,,2019-01-11 19:30:01.530000,10.585910862659652,,,{'GGA': {'task_id': 'mp-1669546'}},0.0,8.12401413,520.0,-175.32363419,-8.7661817095,"{'tags': ['Pu2C3', 'Th2C3 hp', 'Thorium carbide (2/3)']}",-175.32363419,-8.7661817095,-0.2645699894999992,['bandstructure'],True,[618903],True,2021-05-12 10:58:33.577000,NM,20,5,mp-1188514,,Th2C3,"{'functional': 'PBE', 'labels': ['Th', 'C'], 'pot_type': 'paw'}","{'Th': 2.0, 'C': 3.0}",GGA,mp-1188514,"['mp-1188514', 'mp-1415692', 'mp-1669546', 'mp-1811506', 'mp-1605961']",0.000101475,"{'Th': 8.0, 'C': 12.0}",313.7941543668512,[],NM,False,220,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.2935231404134748e-06,0.000101475,0,0.0004059,MP,data/source/MP/cleaned/cifs/MP-mp-1188514.cif,True,,data/final/MP/graphs/C1.45Th1-MP-mp-1188514-synth_doped.json,0,True,-43m,5,0,0,0,0,0,0,0,0,1,0,1.0,False
Bi2Ca0.9Cu2Sr2Y0.1O8,2,0.0133333333333333,2.0,False,Bi4Ca1.8Cu4Sr4Y0.2O16,Bi4Ca2Cu4Sr4O16,76.5,Cuprate,True,Bi13.333Ca6Cu13.333Sr13.333Y0.667O53.333333333333336,Bi-Ca-Cu-Sr-Y-O,6,Supercon,Bi2Sr2Ca0.9Y0.1Cu2O8,MP-mp-1218930,Sr4Ca2Cu4Bi4O16,Bi-Ca-Cu-Sr-O,Bi13.333Ca6.667Cu13.333Sr13.333O53.333333333333336,C c c 2,orthorhombic,5.417115,5.472898000129128,16.11398919,data/final/MP/cifs/Bi2Ca0.9Cu2Sr2Y0.1O8-MP-mp-1218930-synth_doped.cif,data/source/MP/raw/cifs/mp-1218930.cif,mp-1218930,0.0,,2019-01-12 20:01:06.544000,6.266668983881059,,,,0.039252223722225,4.51768334,520.0,-173.15021002,-5.771673667333333,{'tags': []},-173.15021002,-5.771673667333333,-2.074956548222222,[],False,[],True,2021-05-12 11:00:42.526000,NM,30,3,mp-1218930,oxide,Sr2CaCu2(BiO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",GGA,mp-1218930,"['mp-1218930', 'mp-1359698', 'mp-1817714']",0.00011165,"{'Sr': 4.0, 'Ca': 2.0, 'Cu': 4.0, 'Bi': 4.0, 'O': 16.0}",470.7976286073367,[],NM,False,37,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.743014544498498e-07,0.00011165,0,0.0002233,MP,data/source/MP/cleaned/cifs/MP-mp-1218930.cif,True,,data/final/MP/graphs/Bi2Ca0.9Cu2Sr2Y0.1O8-MP-mp-1218930-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
C0.99Nb1,2,0.0050251256281407,1.0,True,C0.99Nb1,C1Nb1,10.6,Other,True,C49.749Nb50.251,C-Nb,2,Supercon,C0.99Nb1,MP-mp-910,Nb1C1,C-Nb,C50Nb50,F m -3 m,cubic,3.18634336,3.1863433599999995,3.1863433599999995,data/final/MP/cifs/C0.99Nb1-MP-mp-910-synth_doped.cif,data/source/MP/raw/cifs/mp-910.cif,mp-910,0.0,,2011-05-12 17:28:40,7.616098778357742,10.17188/1282001,"@misc{osti_1282001,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbC (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1282001"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686610'}},0.0408750508333302,7.39992982,520.0,-20.24633413,-10.123167065,"{'tags': ['Niobium carbide (1/1)', 'Niobium carbide (1/1) - RS-type']}",-20.24633413,-10.123167065,-0.4591241950000011,"['xas', 'elasticity', 'bandstructure']",True,"[618465, 77214, 187077, 618456, 181792, 618453, 94449, 618472, 183163, 237582, 618457, 159872, 618480, 618475, 618482, 618469, 155164, 618466, 44355, 618450, 618458, 618449, 44496, 618463, 618462, 618460, 618481, 618471, 618476, 181052, 601142, 618448, 189089, 618478, 26955, 618473, 618484, 618483]",True,2021-05-12 10:56:35.166000,NM,2,25,mp-910,,NbC,"{'functional': 'PBE', 'labels': ['Nb_pv', 'C'], 'pot_type': 'paw'}","{'Nb': 1.0, 'C': 1.0}",GGA,mp-910,"['mp-1000444', 'mp-1001333', 'mp-910', 'mp-1057158', 'mp-1057178', 'mp-1057130', 'mp-1057651', 'mp-1057669', 'mp-1057682', 'mp-1057771', 'mp-1057779', 'mp-1057802', 'mp-1060960', 'mp-1060978', 'mp-1061015', 'mp-1440938', 'mp-1686610', 'mp-1805660', 'mp-1007673', 'mp-1593845', 'mp-1596940', 'mp-1061007', 'mp-1057677', 'mp-1057792', 'mp-1057174']",3.33e-05,"{'Nb': 1.0, 'C': 1.0}",22.87508541625878,[],NM,False,225,0,"[0, 0]",1.4557322691495426e-06,3.33e-05,0,3.33e-05,MP,data/source/MP/cleaned/cifs/MP-mp-910.cif,True,,data/final/MP/graphs/C0.99Nb1-MP-mp-910-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
C3La2,1,0.0,4.0,False,C12La8,C12La8,10.66,Other,True,C60La40,C-La,2,Supercon,C3La2,MP-mp-1184,La8C12,C-La,C60La40,I -4 3 d,cubic,7.637375841693086,7.63737584,7.63737584,data/final/MP/cifs/C3La2-MP-mp-1184.cif,data/source/MP/raw/cifs/mp-1184.cif,mp-1184,0.0,,2011-05-15 20:02:16,6.078703935325423,10.17188/1188425,"@misc{osti_1188425,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La2C3 (SG:220) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188425"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1705323'}},0.0,8.62068433,520.0,-153.54505024,-7.677252512,"{'tags': ['Dilanthanum tricarbide', 'Lanthanum carbide (2/3)', 'High pressure experimental phase']}",-153.54505024,-7.677252512,-0.1667812499999982,"['xas', 'bandstructure']",True,"[601151, 618149, 602770, 153809, 26588, 618154, 618165, 74660, 153808]",True,2021-05-12 10:56:51.169000,NM,20,8,mp-1184,,La2C3,"{'functional': 'PBE', 'labels': ['La', 'C'], 'pot_type': 'paw'}","{'La': 2.0, 'C': 3.0}",GGA,mp-1184,"['mp-908695', 'mp-1184', 'mp-922935', 'mp-923731', 'mp-1430354', 'mp-1705323', 'mp-1841098', 'mp-1597811']",0.000412725,"{'La': 8.0, 'C': 12.0}",342.93404268099584,[],NM,False,220,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.814045252240241e-06,0.000412725,0,0.0016509,MP,data/source/MP/cleaned/cifs/MP-mp-1184.cif,False,,data/final/MP/graphs/C3La2-MP-mp-1184.json,0,True,-43m,5,0,0,0,0,0,0,0,0,1,0,1.0,False
Rh1Si1Y1,1,0.0,4.0,False,Rh4Si4Y4,Rh4Si4Y4,0.0,Other,True,Rh33.333Si33.333Y33.333,Rh-Si-Y,3,Supercon,Y1Rh1Si1,MP-mp-19728,Y4Si4Rh4,Rh-Si-Y,Rh33.333Si33.333Y33.333,P n m a,orthorhombic,4.248755,6.916845,7.458898,data/final/MP/cifs/Rh1Si1Y1-MP-mp-19728.cif,data/source/MP/raw/cifs/mp-19728.cif,mp-19728,0.0,,2014-02-22 14:23:34,6.663213000160179,10.17188/1194936,"@misc{osti_1194936,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YSiRh (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1194936"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696220'}},0.0,6.1886136,520.0,-89.65117031,-7.470930859166667,"{'tags': ['Rhodium yttrium silicide (1/1/1)', 'Yttrium rhodium silicide (1/1/1)']}",-89.65117031,-7.470930859166667,-1.0285665247222215,"['xas', 'elasticity', 'bandstructure']",True,"[650347, 32562]",True,2021-05-12 10:56:14.760000,NM,12,12,mp-19728,,YSiRh,"{'functional': 'PBE', 'labels': ['Y_sv', 'Si', 'Rh_pv'], 'pot_type': 'paw'}","{'Y': 1.0, 'Si': 1.0, 'Rh': 1.0}",GGA,mp-19728,"['mp-921767', 'mp-920742', 'mp-907296', 'mp-19728', 'mp-1102894', 'mp-1124989', 'mp-1133285', 'mp-1254454', 'mp-1431138', 'mp-1696220', 'mp-1830935', 'mp-1602645']",0.000220425,"{'Y': 4.0, 'Si': 4.0, 'Rh': 4.0}",219.20194358997816,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.022318349737074e-06,0.000220425,0,0.0008817,MP,data/source/MP/cleaned/cifs/MP-mp-19728.cif,False,,data/final/MP/graphs/Rh1Si1Y1-MP-mp-19728.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
As2Ba0.5Fe1.96K0.5Mn0.04,2,0.016,2.0,False,As4Ba1Fe3.92K1Mn0.08,As4Ba1Fe4K1,25.85,Ferrite,True,As40Ba10Fe39.2K10Mn0.8,As-Ba-Fe-K-Mn,5,Supercon,Ba0.5K0.5Fe1.96Mn0.04As2,MP-mp-1223517,K1Ba1Fe4As4,As-Ba-Fe-K,As40Ba10Fe40K10,C m m m,orthorhombic,5.479027,5.480024002658328,7.13170472,data/final/MP/cifs/As2Ba0.5Fe1.96K0.5Mn0.04-MP-mp-1223517-synth_doped.cif,data/source/MP/raw/cifs/mp-1223517.cif,mp-1223517,0.0,,2019-01-12 23:54:03.876000,5.87534599912672,,,{'GGA': {'task_id': 'mp-1743010'}},0.0132513644999994,4.21185628,520.0,-59.66633886,-5.966633886,{'tags': []},-59.66633886,-5.966633886,-0.4120461663000007,[],False,[],True,2021-05-12 11:00:52.054000,FM,10,4,mp-1223517,,KBa(FeAs)4,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",GGA,mp-1223517,"['mp-1223517', 'mp-1396881', 'mp-1743010', 'mp-1827585']",0.9947188,"{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",197.6961518155852,[],FM,True,65,1,"[0.0, 0.0, 0.3, 0.3, 0.3, 0.3, 0.0, 0.0, 0.0, 0.0]",0.0050315536790412,0.9947188,4,0.9947188,MP,data/source/MP/cleaned/cifs/MP-mp-1223517.cif,True,,data/final/MP/graphs/As2Ba0.5Fe1.96K0.5Mn0.04-MP-mp-1223517-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
C0.98Nb1,2,0.0101010101010101,1.0,True,C0.98Nb1,C1Nb1,11.68,Other,True,C49.495Nb50.505,C-Nb,2,Supercon,C0.98Nb1,MP-mp-910,Nb1C1,C-Nb,C50Nb50,F m -3 m,cubic,3.18634336,3.1863433599999995,3.1863433599999995,data/final/MP/cifs/C0.98Nb1-MP-mp-910-synth_doped.cif,data/source/MP/raw/cifs/mp-910.cif,mp-910,0.0,,2011-05-12 17:28:40,7.616098778357742,10.17188/1282001,"@misc{osti_1282001,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbC (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1282001"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686610'}},0.0408750508333302,7.39992982,520.0,-20.24633413,-10.123167065,"{'tags': ['Niobium carbide (1/1)', 'Niobium carbide (1/1) - RS-type']}",-20.24633413,-10.123167065,-0.4591241950000011,"['xas', 'elasticity', 'bandstructure']",True,"[618465, 77214, 187077, 618456, 181792, 618453, 94449, 618472, 183163, 237582, 618457, 159872, 618480, 618475, 618482, 618469, 155164, 618466, 44355, 618450, 618458, 618449, 44496, 618463, 618462, 618460, 618481, 618471, 618476, 181052, 601142, 618448, 189089, 618478, 26955, 618473, 618484, 618483]",True,2021-05-12 10:56:35.166000,NM,2,25,mp-910,,NbC,"{'functional': 'PBE', 'labels': ['Nb_pv', 'C'], 'pot_type': 'paw'}","{'Nb': 1.0, 'C': 1.0}",GGA,mp-910,"['mp-1000444', 'mp-1001333', 'mp-910', 'mp-1057158', 'mp-1057178', 'mp-1057130', 'mp-1057651', 'mp-1057669', 'mp-1057682', 'mp-1057771', 'mp-1057779', 'mp-1057802', 'mp-1060960', 'mp-1060978', 'mp-1061015', 'mp-1440938', 'mp-1686610', 'mp-1805660', 'mp-1007673', 'mp-1593845', 'mp-1596940', 'mp-1061007', 'mp-1057677', 'mp-1057792', 'mp-1057174']",3.33e-05,"{'Nb': 1.0, 'C': 1.0}",22.87508541625878,[],NM,False,225,0,"[0, 0]",1.4557322691495426e-06,3.33e-05,0,3.33e-05,MP,data/source/MP/cleaned/cifs/MP-mp-910.cif,True,,data/final/MP/graphs/C0.98Nb1-MP-mp-910-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ba2Cu1Hg1O4.15,2,0.0184049079754601,0.9639638554216868,True,Ba1.928Cu0.964Hg0.964O4,Ba2Cu1Hg1O4,97.0,Cuprate,True,Ba24.54Cu12.27Hg12.27O50.92024539877301,Ba-Cu-Hg-O,4,Supercon,Hg1Ba2Cu1O4.15,MP-mp-6562,Ba2Cu1Hg1O4,Ba-Cu-Hg-O,Ba25Cu12.5Hg12.5O50,P 4/m m m,tetragonal,3.933714,3.933714,9.827602,data/final/MP/cifs/Ba2Cu1Hg1O4.15-MP-mp-6562-synth_doped.cif,data/source/MP/raw/cifs/mp-6562.cif,mp-6562,0.0,,2011-05-13 18:18:06,6.582036471328142,10.17188/1281336,"@misc{osti_1281336,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2CuHgO4 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281336"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697135'}},0.0234340381250053,2.58068675,520.0,-40.91481298,-5.1143516225,"{'tags': ['Mercury dibarium copper oxide', 'High pressure experimental phase']}",-40.91481298,-5.1143516225,-1.953767533125,"['xas', 'bandstructure']",True,"[75722, 75720, 75724, 75721, 75723]",True,2021-05-12 10:57:32.679000,NM,8,8,mp-6562,oxide,Ba2CuHgO4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Cu_pv', 'Hg', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",GGA,mp-6562,"['mp-6562', 'mp-990899', 'mp-992892', 'mp-1435690', 'mp-1697135', 'mp-1878488', 'mp-994198', 'mp-1592659']",0.0003984,"{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",152.07335344042525,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0, 0, 0]",2.619788352047311e-06,0.0003984,0,0.0003984,MP,data/source/MP/cleaned/cifs/MP-mp-6562.cif,True,,data/final/MP/graphs/Ba2Cu1Hg1O4.15-MP-mp-6562-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Sb2Zr1,1,0.0,8.0,False,Sb16Zr8,Sb16Zr8,0.0,Other,True,Sb66.667Zr33.333,Sb-Zr,2,Supercon,Sb2Zr1,MP-mp-979,Zr8Sb16,Sb-Zr,Sb66.667Zr33.333,P n n m,orthorhombic,3.929864,10.086929,15.111716,data/final/MP/cifs/Sb2Zr1-MP-mp-979.cif,data/source/MP/raw/cifs/mp-979.cif,mp-979,0.0,,2011-05-17 16:10:21,7.423378721613104,10.17188/1316067,"@misc{osti_1316067,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrSb2 (SG:58) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1316067"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1761153'}},0.0,7.58046903,520.0,-147.6601358,-6.152505658333333,{'tags': ['Zirconium antimonide (1/2)']},-147.6601358,-6.152505658333333,-0.6786046216666671,"['xas', 'elasticity', 'bandstructure']",True,"[66779, 42878, 651784]",True,2021-05-12 10:56:37.246000,NM,24,9,mp-979,,ZrSb2,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Sb'], 'pot_type': 'paw'}","{'Zr': 1.0, 'Sb': 2.0}",GGA,mp-979,"['mp-992382', 'mp-908418', 'mp-979', 'mp-922759', 'mp-1191599', 'mp-1416653', 'mp-1761153', 'mp-1866827', 'mp-1638123']",0.0001653375,"{'Zr': 8.0, 'Sb': 16.0}",599.0323384057795,[],NM,False,58,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.208061093195964e-06,0.0001653375,0,0.0013227,MP,data/source/MP/cleaned/cifs/MP-mp-979.cif,False,,data/final/MP/graphs/Sb2Zr1-MP-mp-979.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
As1Co0.05Fe0.95Li1,2,0.0333333333333333,2.0,False,As2Co0.1Fe1.9Li2,As2Fe2Li2,10.29,Ferrite,True,As33.333Co1.667Fe31.667Li33.333,As-Co-Fe-Li,4,Supercon,Li1Fe0.95Co0.05As1,MP-mp-21471,Li2Fe2As2,As-Fe-Li,As33.333Fe33.333Li33.333,P 4/n m m,tetragonal,3.790629,3.790629,6.107451,data/final/MP/cifs/As1Co0.05Fe0.95Li1-MP-mp-21471-synth_doped.cif,data/source/MP/raw/cifs/mp-21471.cif,mp-21471,0.0,,2013-10-29 11:57:13,5.21140049061562,10.17188/1196927,"@misc{osti_1196927,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LiFeAs (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196927"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686578'}},0.0,4.20304559,520.0,-32.72438031,-5.454063385,"{'tags': ['Lithium iron arsenide', 'Iron lithium arsenide']}",-32.72438031,-5.454063385,-0.4413801444444445,"['xas', 'elasticity']",False,"[290700, 168206, 610480, 169175, 162250, 162056, 166457, 163870]",True,2021-05-12 10:56:16.728000,FM,6,18,mp-21471,,LiFeAs,"{'functional': 'PBE', 'labels': ['Li_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Li': 1.0, 'Fe': 1.0, 'As': 1.0}",GGA,mp-21471,"['mp-917215', 'mp-674647', 'mp-919059', 'mp-920059', 'mp-1071407', 'mp-21471', 'mp-1071451', 'mp-38403', 'mp-33848', 'mp-37001', 'mp-34336', 'mp-36599', 'mp-36822', 'mp-36276', 'mp-1439936', 'mp-1686578', 'mp-1784376', 'mp-1071444']",0.2682074,"{'Li': 2.0, 'Fe': 2.0, 'As': 2.0}",87.75715855248485,[],FM,True,129,1,"[-0.0, -0.0, 0.3, 0.3, -0.0, -0.0]",0.0061124905232567,0.2682074,2,0.5364148,MP,data/source/MP/cleaned/cifs/MP-mp-21471.cif,True,,data/final/MP/graphs/As1Co0.05Fe0.95Li1-MP-mp-21471-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ir1.05Nb0.95,2,0.05,1.0,True,Ir1.05Nb0.95,Ir1Nb1,4.75,Other,True,Ir52.5Nb47.5,Ir-Nb,2,Supercon,Ir1.05Nb0.95,MP-mp-1359,Nb1Ir1,Ir-Nb,Ir50Nb50,P 4/m m m,tetragonal,2.884095,2.884095,3.897234,data/final/MP/cifs/Ir1.05Nb0.95-MP-mp-1359-synth_doped.cif,data/source/MP/raw/cifs/mp-1359.cif,mp-1359,0.0,,2011-05-12 22:45:42,14.60516010633782,10.17188/1189675,"@misc{osti_1189675,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbIr (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189675"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688420'}},0.0,7.1614056,520.0,-19.97897518,-9.98948759,{'tags': ['Iridium niobium (1/1)']},-19.97897518,-9.98948759,-0.5196198599999988,"['xas', 'elasticity', 'bandstructure']",True,"[640846, 104509, 640836, 104510, 640829]",True,2021-05-12 10:56:12.755000,NM,2,8,mp-1359,,NbIr,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Ir'], 'pot_type': 'paw'}","{'Nb': 1.0, 'Ir': 1.0}",GGA,mp-1359,"['mp-929389', 'mp-912591', 'mp-929015', 'mp-1359', 'mp-1476237', 'mp-1688420', 'mp-1790803', 'mp-1587899']",2e-06,"{'Nb': 1.0, 'Ir': 1.0}",32.41720788021917,[],NM,False,123,0,"[0, 0]",6.169562805624574e-08,2e-06,0,2e-06,MP,data/source/MP/cleaned/cifs/MP-mp-1359.cif,True,,data/final/MP/graphs/Ir1.05Nb0.95-MP-mp-1359-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Al0.4Nb3Sn0.6,2,0.0499999999999999,2.0,False,Al0.8Nb6Sn1.2,Al1Nb6Sn1,15.4,Other,True,Al10Nb75Sn15,Al-Nb-Sn,3,Supercon,Nb3Sn0.6Al0.4,MP-mp-1220362,Nb6Al1Sn1,Al-Nb-Sn,Al12.5Nb75Sn12.5,P m -3,cubic,5.271766,5.271766,5.271766,data/final/MP/cifs/Al0.4Nb3Sn0.6-MP-mp-1220362-synth_doped.cif,data/source/MP/raw/cifs/mp-1220362.cif,mp-1220362,0.0,,2019-01-12 21:13:16.743000,7.969227759613809,,,{'GGA': {'task_id': 'mp-1729666'}},0.0333399244999998,6.10276458,520.0,-69.63111786,-8.7038897325,{'tags': []},-69.63111786,-8.7038897325,-0.1585174918749992,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,8,5,mp-1220362,,Nb6AlSn,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al', 'Sn_d'], 'pot_type': 'paw'}","{'Nb': 6.0, 'Al': 1.0, 'Sn': 1.0}",GGA,mp-1220362,"['mp-1220362', 'mp-1393884', 'mp-1729666', 'mp-1779724', 'mp-1620242']",0.0883244,"{'Nb': 6.0, 'Al': 1.0, 'Sn': 1.0}",146.51037313724012,[],NM,False,200,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0006028542423904,0.0883244,0,0.0883244,MP,data/source/MP/cleaned/cifs/MP-mp-1220362.cif,True,,data/final/MP/graphs/Al0.4Nb3Sn0.6-MP-mp-1220362-synth_doped.json,0,True,m-3,2,0,0,0,0,0,0,1,0,0,0,1.0,False
Al2C1Mo3,1,0.0,4.0,False,Al8C4Mo12,Al8C4Mo12,9.61,Other,True,Al33.333C16.667Mo50,Al-C-Mo,3,Supercon,Al2C1Mo3,MP-mp-18093,Al8Mo12C4,Al-C-Mo,Al33.333C16.667Mo50,P 41 3 2,cubic,6.889947,6.889947,6.889947,data/final/MP/cifs/Al2C1Mo3-MP-mp-18093.cif,data/source/MP/raw/cifs/mp-18093.cif,mp-18093,0.0,,2014-02-16 19:18:42,7.184749572589145,10.17188/1192885,"@misc{osti_1192885,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Al2Mo3C (SG:213) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1192885"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1711464'}},0.0521299888095239,8.94653217,520.0,-201.2264642,-8.384436008333333,{'tags': ['Molybdenum aluminum carbide (3/2/1)']},-201.2264642,-8.384436008333333,-0.1752924333333337,"['xas', 'elasticity', 'bandstructure']",True,[42917],True,2021-05-12 10:56:14.760000,NM,24,10,mp-18093,,Al2Mo3C,"{'functional': 'PBE', 'labels': ['Al', 'Mo_pv', 'C'], 'pot_type': 'paw'}","{'Al': 2.0, 'Mo': 3.0, 'C': 1.0}",GGA,mp-18093,"['mp-924889', 'mp-909872', 'mp-925891', 'mp-18093', 'mp-1115920', 'mp-1261209', 'mp-1418040', 'mp-1711464', 'mp-1807142', 'mp-1629956']",0.0014859,"{'Al': 8.0, 'Mo': 12.0, 'C': 4.0}",327.0752209941619,[],NM,False,213,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.8171966625701952e-05,0.0014859,0,0.0059436,MP,data/source/MP/cleaned/cifs/MP-mp-18093.cif,False,,data/final/MP/graphs/Al2C1Mo3-MP-mp-18093.json,0,True,432,4,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba1Bi0.2Pb0.8O3,3,0.0799999999999999,2.0,False,Ba2Bi0.4Pb1.6O6,Ba2Pb2O6,9.875,Oxide,True,Ba20Bi4Pb16O60,Ba-Bi-Pb-O,4,Supercon,Ba1Pb0.8Bi0.2O3,MP-mp-20461,Ba2Pb2O6,Ba-Pb-O,Ba20Pb20O60,C 1 2/m 1,monoclinic,6.13110795,6.15036645,6.15036645,data/final/MP/cifs/Ba1Bi0.2Pb0.8O3-MP-mp-20461-synth_doped.cif,data/source/MP/raw/cifs/mp-20461.cif,mp-20461,0.2051999999999996,,2014-02-21 12:57:54,7.877180851020856,10.17188/1195591,"@misc{osti_1195591,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BaPbO3 (SG:12) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195591"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688120'}},0.0,2.99844765,520.0,-57.91699323,-5.7916993230000005,"{'tags': ['Barium plumbate', 'Barium lead(IV) oxide']}",-57.91699323,-5.7916993230000005,-2.108799140000001,"['diel', 'xas', 'bandstructure']",True,"[67299, 51656]",True,2021-05-12 10:56:45.290000,NM,10,10,mp-20461,oxide,BaPbO3,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Pb_d', 'O'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Pb': 1.0, 'O': 3.0}",GGA,mp-20461,"['mp-919763', 'mp-918765', 'mp-905786', 'mp-551164', 'mp-20461', 'mp-1141988', 'mp-1439228', 'mp-1688120', 'mp-1833847', 'mp-1588870']",5.695e-05,"{'Ba': 2.0, 'Pb': 2.0, 'O': 6.0}",165.49154870311418,[],NM,False,12,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.882526684449154e-07,5.695e-05,0,0.0001139,MP,data/source/MP/cleaned/cifs/MP-mp-20461.cif,True,,data/final/MP/graphs/Ba1Bi0.2Pb0.8O3-MP-mp-20461-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,0.5,False
Dy1Mo6S8,1,0.0,1.0,True,Dy1Mo6S8,Dy1Mo6S8,1.6,Chevrel,True,Dy6.667Mo40S53.333,Dy-Mo-S,3,Supercon,Dy1Mo6S8,MP-mp-1103518,Dy1Mo6S8,Dy-Mo-S,Dy6.667Mo40S53.333,R -3,trigonal,6.50568082,6.50568082,6.50568094,data/final/MP/cifs/Dy1Mo6S8-MP-mp-1103518.cif,data/source/MP/raw/cifs/mp-1103518.cif,mp-1103518,0.0,,2018-07-18 18:33:32,5.999495240053263,,,{'GGA': {'task_id': 'mp-1705198'}},0.0118780111666634,6.21941034,520.0,-116.21057161,-7.747371440666667,"{'tags': ['Dysprosium(III) molybdenum(II/III) sulfide (1/6/8)', 'Dysprosium molybdenum sulfide (1/6/8)']}",-116.21057161,-7.747371440666667,-1.1641551770000007,['bandstructure'],True,"[629953, 603463]",True,2021-05-12 10:58:20.361000,NM,15,6,mp-1103518,,Dy(Mo3S4)2,"{'functional': 'PBE', 'labels': ['Dy_3', 'Mo_pv', 'S'], 'pot_type': 'paw'}","{'Dy': 1.0, 'Mo': 6.0, 'S': 8.0}",GGA,mp-1103518,"['mp-1103518', 'mp-1104058', 'mp-1431306', 'mp-1705198', 'mp-1929323', 'mp-1604510']",0.001303,"{'Dy': 1.0, 'Mo': 6.0, 'S': 8.0}",275.3017915503325,[],NM,False,148,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.732987724715829e-06,0.001303,0,0.001303,MP,data/source/MP/cleaned/cifs/MP-mp-1103518.cif,False,,data/final/MP/graphs/Dy1Mo6S8-MP-mp-1103518.json,0,True,-3,0,0,0,0,0,0,2,1,0,0,0,1.0,False
As1Fe1Sm0.8U0.2O1,3,0.0999999999999999,2.0,False,As2Fe2Sm1.6U0.4O2,As2Fe2Sm2O2,46.0,Ferrite,True,As25Fe25Sm20U5O25,As-Fe-Sm-U-O,5,Supercon,Sm0.8U0.2Fe1As1O1,MP-mp-20349,Sm2Fe2As2O2,As-Fe-Sm-O,As25Fe25Sm25O25,P 4/n m m,tetragonal,4.026492,4.026492,9.046755,data/final/MP/cifs/As1Fe1Sm0.8U0.2O1-MP-mp-20349-synth_doped.cif,data/source/MP/raw/cifs/mp-20349.cif,mp-20349,0.0,,2014-02-19 11:24:42,6.727802583283198,,,{'GGA+U': {'task_id': 'mp-1695938'}},0.3015723809374986,3.77685593,520.0,-52.73407138,-6.5917589225,{'tags': ['Samarium iron arsenic oxide (1/1/1/1)']},-52.73407138,-6.5917589225,-1.6285904237499995,"['xas', 'elasticity', 'bandstructure']",True,"[236652, 236653, 422002, 163457, 163458]",True,2021-05-12 10:56:16.728000,FM,8,10,mp-20349,oxide,SmFeAsO,"{'functional': 'PBE', 'labels': ['Sm_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Sm': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-20349,"['mp-24944', 'mp-1078897', 'mp-1079866', 'mp-1173321', 'mp-20349', 'mp-1425472', 'mp-1695938', 'mp-1772503', 'mp-1789694', 'mp-1588381']",3.75729895,"{'Sm': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",146.67176231613362,[],FM,True,129,1,"[0.0, 0.0, 3.5, 3.5, -0.0, -0.0, -0.0, -0.0]",0.0512341147425717,3.75729895,2,7.5145979,MP,data/source/MP/cleaned/cifs/MP-mp-20349.cif,True,,data/final/MP/graphs/As1Fe1Sm0.8U0.2O1-MP-mp-20349-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Al0.924Nb3Se0.076,2,0.0379999999999999,2.0,False,Al1.848Nb6Se0.152,Al2Nb6,17.6,Other,True,Al23.1Nb75Se1.9,Al-Nb-Se,3,Supercon,Nb3Al0.924Se0.076,MP-mp-796,Nb6Al2,Al-Nb,Al25Nb75,P m -3 n,cubic,5.215254,5.215254,5.215254,data/final/MP/cifs/Al0.924Nb3Se0.076-MP-mp-796-synth_doped.cif,data/source/MP/raw/cifs/mp-796.cif,mp-796,0.0,,2011-05-13 16:07:37,7.157298025966356,,,{'GGA': {'task_id': 'mp-1686893'}},0.0460773865000003,5.52947534,520.0,-69.48918494,-8.6861481175,"{'tags': ['Aluminium niobium (1/3)', 'Niobium aluminide (3/1)', 'Aluminum niobium (1/3)']}",-69.48918494,-8.6861481175,-0.1737753800000003,"['bandstructure', 'elasticity']",True,"[608675, 608654, 608688, 608668, 608669, 608685, 608676, 608683, 58014, 608657, 107856, 608655, 608666, 608691, 608656, 608665, 608673, 608653, 608661]",True,2021-05-12 10:56:31.128000,NM,8,10,mp-796,,Nb3Al,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Al': 1.0}",GGA,mp-796,"['mp-911586', 'mp-927906', 'mp-796', 'mp-927472', 'mp-1260512', 'mp-1440919', 'mp-1686893', 'mp-1927652', 'mp-1591599', 'mp-1587739']",0.16323955,"{'Nb': 6.0, 'Al': 2.0}",141.8490379078192,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0023015954483396,0.16323955,0,0.3264791,MP,data/source/MP/cleaned/cifs/MP-mp-796.cif,True,,data/final/MP/graphs/Al0.924Nb3Se0.076-MP-mp-796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Nb1,1,0.0,12.0,False,Nb12,Nb12,8.9976875,Other,True,Nb100,Nb,1,Supercon,Nb1,MP-mp-1094120,Nb12,Nb,Nb100,P 1,triclinic,5.374343,6.938010689999999,7.17991642,data/final/MP/cifs/Nb1-MP-mp-1094120.cif,data/source/MP/raw/cifs/mp-1094120.cif,mp-1094120,0.0,,2018-05-03 15:25:37,8.161255619756384,,,{'GGA': {'task_id': 'mp-1731283'}},0.1897482850000003,4.79435383,520.0,-118.93868106,-9.911556755,{'tags': []},-118.93868106,-9.911556755,0.1897482850000003,[],False,[],True,2021-05-12 10:59:22.504000,NM,12,4,mp-1094120,,Nb,"{'functional': 'PBE', 'labels': ['Nb_pv'], 'pot_type': 'paw'}",{'Nb': 1.0},GGA,mp-1094120,"['mp-1094120', 'mp-1409835', 'mp-1731283', 'mp-1938953']",9.983333333333331e-06,{'Nb': 12.0},226.83961495276392,[],NM,False,1,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.281264475120301e-07,9.983333333333331e-06,0,0.0001198,MP,data/source/MP/cleaned/cifs/MP-mp-1094120.cif,False,,data/final/MP/graphs/Nb1-MP-mp-1094120.json,0,True,1,0,0,0,0,0,1,0,1,0,0,0,1.0,False
Sb0.25Ti0.75,1,0.0,8.0,False,Sb2Ti6,Sb2Ti6,5.9358333335,Other,True,Sb25Ti75,Sb-Ti,2,Supercon,Sb0.25Ti0.75,MP-mp-1412,Ti6Sb2,Sb-Ti,Sb25Ti75,P m -3 n,cubic,5.217462,5.217462,5.217462,data/final/MP/cifs/Sb0.25Ti0.75-MP-mp-1412.cif,data/source/MP/raw/cifs/mp-1412.cif,mp-1412,0.0,,2011-05-13 14:53:14,6.204950256483492,10.17188/1190175,"@misc{osti_1190175,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ti3Sb (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1190175"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702648'}},0.0,7.83263403,520.0,-58.66916782,-7.3336459775,"{'tags': ['Titanium antimonide (3/1)', 'Titanium antimonide (3/1) - alpha', 'Antimony titanium (1/3)']}",-58.66916782,-7.3336459775,-0.4277766549999997,"['xas', 'elasticity', 'bandstructure']",True,"[651683, 96137, 651684, 106035, 651685, 43356, 657034]",True,2021-05-12 10:56:12.755000,NM,8,8,mp-1412,,Ti3Sb,"{'functional': 'PBE', 'labels': ['Ti_pv', 'Sb'], 'pot_type': 'paw'}","{'Ti': 3.0, 'Sb': 1.0}",GGA,mp-1412,"['mp-909983', 'mp-925532', 'mp-925952', 'mp-1412', 'mp-1438360', 'mp-1702648', 'mp-1785502', 'mp-1595812']",0.0722148,"{'Ti': 6.0, 'Sb': 2.0}",142.02927953906467,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.001016900180503,0.0722148,0,0.1444296,MP,data/source/MP/cleaned/cifs/MP-mp-1412.cif,False,,data/final/MP/graphs/Sb0.25Ti0.75-MP-mp-1412.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ag0.65Al0.35,2,0.0333333333333332,6.0,False,Ag3.9Al2.1,Ag4Al2,0.1,Other,True,Ag65Al35,Ag-Al,2,Supercon,Ag0.65Al0.35,MP-mp-985805,Al2Ag4,Ag-Al,Ag66.667Al33.333,C m c m,orthorhombic,4.569113,5.097394001168852,5.10979643,data/final/MP/cifs/Ag0.65Al0.35-MP-mp-985805-synth_doped.cif,data/source/MP/raw/cifs/mp-985805.cif,mp-985805,0.0,,2017-11-17 15:09:37,7.814765925012479,10.17188/1316751,"@misc{osti_1316751,
    author = ""Persson, Kristin"",
    title = ""Materials Data on AlAg2 (SG:63) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1316751"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1760271'}},0.0,5.04571075,520.0,-19.27423641,-3.212372735,{'tags': []},-19.27423641,-3.212372735,-0.0754767894444441,"['xas', 'elasticity', 'bandstructure']",True,[],True,2021-05-12 10:56:37.246000,NM,6,9,mp-985805,,AlAg2,"{'functional': 'PBE', 'labels': ['Al', 'Ag'], 'pot_type': 'paw'}","{'Al': 1.0, 'Ag': 2.0}",GGA,mp-985805,"['mp-1040769', 'mp-1040772', 'mp-985805', 'mp-1256890', 'mp-1398492', 'mp-1760271', 'mp-1928111', 'mp-1627544', 'mp-1040771']",1.33e-05,"{'Al': 2.0, 'Ag': 4.0}",103.14899334858234,[],NM,False,63,0,"[0, 0, 0, 0, 0, 0]",2.578793950039609e-07,1.33e-05,0,2.66e-05,MP,data/source/MP/cleaned/cifs/MP-mp-985805.cif,True,,data/final/MP/graphs/Ag0.65Al0.35-MP-mp-985805-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Pt1Sc1,1,0.0,1.0,True,Pt1Sc1,Pt1Sc1,0.0,Other,True,Pt50Sc50,Pt-Sc,2,Supercon,Pt1Sc1,MP-mp-892,Sc1Pt1,Pt-Sc,Pt50Sc50,P m -3 m,cubic,3.308547,3.308547,3.308547,data/final/MP/cifs/Pt1Sc1-MP-mp-892.cif,data/source/MP/raw/cifs/mp-892.cif,mp-892,0.0,,2011-05-12 18:49:47,11.005775026874286,10.17188/1312828,"@misc{osti_1312828,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ScPt (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1312828"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686367'}},0.0,6.24827201,520.0,-14.8583683,-7.42918415,{'tags': ['Platinum scandium (1/1)']},-14.8583683,-7.42918415,-1.2274957424999997,"['xas', 'elasticity', 'bandstructure']",True,"[105784, 649585]",True,2021-05-12 10:56:33.121000,NM,2,8,mp-892,,ScPt,"{'functional': 'PBE', 'labels': ['Sc_sv', 'Pt'], 'pot_type': 'paw'}","{'Sc': 1.0, 'Pt': 1.0}",GGA,mp-892,"['mp-991063', 'mp-993043', 'mp-892', 'mp-1439988', 'mp-1686367', 'mp-1793355', 'mp-994303', 'mp-1595372']",0.0001217,"{'Sc': 1.0, 'Pt': 1.0}",36.21695432133778,[],NM,False,221,0,"[0, 0]",3.3603046495905527e-06,0.0001217,0,0.0001217,MP,data/source/MP/cleaned/cifs/MP-mp-892.cif,False,,data/final/MP/graphs/Pt1Sc1-MP-mp-892.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Au0.427Ga0.573,3,0.1459999999999999,8.0,False,Au3.416Ga4.584,Au4Ga4,1.378,Other,True,Au42.7Ga57.3,Au-Ga,2,Supercon,Au0.427Ga0.573,MP-mp-30379,Ga4Au4,Au-Ga,Au50Ga50,P n m a,orthorhombic,3.592694,6.387953,6.453923,data/final/MP/cifs/Au0.427Ga0.573-MP-mp-30379-synth_doped.cif,data/source/MP/raw/cifs/mp-30379.cif,mp-30379,0.0,,2015-02-12 05:28:38,11.95940016805038,10.17188/1204793,"@misc{osti_1204793,
    author = ""Persson, Kristin"",
    title = ""Materials Data on GaAu (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1204793"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700771'}},0.0,4.5667665,520.0,-27.04365391,-3.38045673875,"{'tags': ['Gold gallium (1/1)', 'Gold(III) gallide']}",-27.04365391,-3.38045673875,-0.2294679574999998,"['xas', 'bandstructure']",True,"[611867, 58457]",True,2021-05-12 10:57:04.957000,NM,8,8,mp-30379,,GaAu,"{'functional': 'PBE', 'labels': ['Ga_d', 'Au'], 'pot_type': 'paw'}","{'Ga': 1.0, 'Au': 1.0}",GGA,mp-30379,"['mp-940857', 'mp-941001', 'mp-932752', 'mp-30379', 'mp-1414503', 'mp-1700771', 'mp-1788338', 'mp-1589572']",0.001013025,"{'Ga': 4.0, 'Au': 4.0}",148.11727737392346,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0]",2.735737566773143e-05,0.001013025,0,0.0040521,MP,data/source/MP/cleaned/cifs/MP-mp-30379.cif,True,,data/final/MP/graphs/Au0.427Ga0.573-MP-mp-30379-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
B2C1Ni1.9Ru0.1Y1,2,0.0333333333333333,1.0,True,B2C1Ni1.9Ru0.1Y1,B2C1Ni2Y1,7.0,Other,True,B33.333C16.667Ni31.667Ru1.667Y16.667,B-C-Ni-Ru-Y,5,Supercon,Y1Ni1.9Ru0.1B2C1,MP-mp-6576,Y1Ni2B2C1,B-C-Ni-Y,B33.333C16.667Ni33.333Y16.667,I 4/m m m,tetragonal,3.548790000501972,3.548790000501972,5.76144136,data/final/MP/cifs/B2C1Ni1.9Ru0.1Y1-MP-mp-6576-synth_doped.cif,data/source/MP/raw/cifs/mp-6576.cif,mp-6576,0.0,,2011-05-13 05:21:43,6.099730998852292,10.17188/1281366,"@misc{osti_1281366,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281366"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688230'}},0.0,6.81083016,520.0,-43.677878,-7.279646333333333,{'tags': []},-43.677878,-7.279646333333333,-0.5109282141666659,"['xas', 'bandstructure']",True,"[75816, 89142, 83231, 79574, 41549]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6576,,YNi2B2C,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6576,"['mp-6576', 'mp-1007054', 'mp-1000583', 'mp-1439516', 'mp-1688230', 'mp-1794280', 'mp-1011792', 'mp-1597064']",0.0006603,"{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.3152437079014,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",1.010943177297096e-05,0.0006603,0,0.0006603,MP,data/source/MP/cleaned/cifs/MP-mp-6576.cif,True,,data/final/MP/graphs/B2C1Ni1.9Ru0.1Y1-MP-mp-6576-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
F0.05Fe1La1P1O0.95,2,0.025,2.0,False,F0.1Fe2La2P2O1.9,Fe2La2P2O2,7.21,Ferrite,True,F1.25Fe25La25P25O23.75,F-Fe-La-P-O,5,Supercon,La1Fe1P1F0.05O0.95,MP-mp-510668,La2Fe2P2O2,Fe-La-P-O,Fe25La25P25O25,P 4/n m m,tetragonal,4.068879,4.068879,9.084981,data/final/MP/cifs/F0.05Fe1La1P1O0.95-MP-mp-510668-synth_doped.cif,data/source/MP/raw/cifs/mp-510668.cif,mp-510668,0.0,,2014-02-26 04:17:37,5.337337070142887,,,{'GGA+U': {'task_id': 'mp-1704083'}},0.3903949226041714,6.29241646,520.0,-55.52669053,-6.94083631625,{'tags': []},-55.52669053,-6.94083631625,-1.734766549583334,"['xas', 'bandstructure']",True,"[162724, 420381, 391428]",True,2021-05-12 10:57:15.388000,FM,8,7,mp-510668,oxide,LaFePO,"{'functional': 'PBE', 'labels': ['La', 'Fe_pv', 'P', 'O'], 'pot_type': 'paw'}","{'La': 1.0, 'Fe': 1.0, 'P': 1.0, 'O': 1.0}",GGA+U,mp-510668,"['mp-542977', 'mp-510668', 'mp-1422599', 'mp-1704083', 'mp-1768909', 'mp-1779846', 'mp-1595432']",3.95130975,"{'La': 2.0, 'Fe': 2.0, 'P': 2.0, 'O': 2.0}",150.40891327693348,[],FM,True,129,1,"[0.0, 0.0, 3.7, 3.7, 0.0, 0.0, 0.0, 0.0]",0.0525408988591631,3.95130975,2,7.9026195,MP,data/source/MP/cleaned/cifs/MP-mp-510668.cif,True,,data/final/MP/graphs/F0.05Fe1La1P1O0.95-MP-mp-510668-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
S1V3,1,0.0,8.0,False,S8V24,S8V24,0.0,Other,True,S25V75,S-V,2,Supercon,S1V3,MP-mp-555283,V24S8,S-V,S25V75,P 42/n b c,tetragonal,4.636272,9.333672,9.333672,data/final/MP/cifs/S1V3-MP-mp-555283.cif,data/source/MP/raw/cifs/mp-555283.cif,mp-555283,0.0,,2015-02-15 07:59:04,6.08103293044792,10.17188/1268729,"@misc{osti_1268729,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3S (SG:133) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1268729"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1759765'}},0.0,8.34250957,520.0,-268.57386219,-8.3929331934375,"{'tags': ['Vanadium sulfide (3/1)', 'Vanadium sulfide (3/1) - beta']}",-268.57386219,-8.3929331934375,-0.6716411742187498,"['xas', 'bandstructure']",True,"[651363, 26516]",True,2021-05-12 10:57:17.297000,NM,32,8,mp-555283,,V3S,"{'functional': 'PBE', 'labels': ['V_pv', 'S'], 'pot_type': 'paw'}","{'V': 3.0, 'S': 1.0}",GGA,mp-555283,"['mp-944052', 'mp-933976', 'mp-944687', 'mp-555283', 'mp-1406138', 'mp-1759765', 'mp-1817248', 'mp-1626505']",0.00012245,"{'V': 24.0, 'S': 8.0}",403.9001153463924,[],NM,False,133,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.425352117465667e-06,0.00012245,0,0.0009796,MP,data/source/MP/cleaned/cifs/MP-mp-555283.cif,False,,data/final/MP/graphs/S1V3-MP-mp-555283.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
La1Sn1.5Tl1.5,1,0.0,2.0,False,La2Sn3Tl3,La2Sn3Tl3,1.5,Other,True,La25Sn37.5Tl37.5,La-Sn-Tl,3,Supercon,La1Tl1.5Sn1.5,MP-mp-1223249,La2Tl3Sn3,La-Sn-Tl,La25Sn37.5Tl37.5,P m m m,orthorhombic,4.866551,4.881292,9.673425,data/final/MP/cifs/La1Sn1.5Tl1.5-MP-mp-1223249.cif,data/source/MP/raw/cifs/mp-1223249.cif,mp-1223249,0.0,,2019-01-12 23:40:12.401000,9.011785601014893,,,{'GGA': {'task_id': 'mp-1721298'}},0.0,7.900763,520.0,-32.8339066,-4.104238325,{'tags': []},-32.8339066,-4.104238325,-0.480655923125,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,8,5,mp-1223249,,La2(TlSn)3,"{'functional': 'PBE', 'labels': ['La', 'Tl_d', 'Sn_d'], 'pot_type': 'paw'}","{'La': 2.0, 'Tl': 3.0, 'Sn': 3.0}",GGA,mp-1223249,"['mp-1223249', 'mp-1444236', 'mp-1721298', 'mp-1776203', 'mp-1623288']",0.0003437,"{'La': 2.0, 'Tl': 3.0, 'Sn': 3.0}",229.7927570742245,[],NM,False,47,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.4956955318177533e-06,0.0003437,0,0.0003437,MP,data/source/MP/cleaned/cifs/MP-mp-1223249.cif,False,,data/final/MP/graphs/La1Sn1.5Tl1.5-MP-mp-1223249.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Nb3Pt0.98Rh0.02,2,0.01,2.0,False,Nb6Pt1.96Rh0.04,Nb6Pt2,9.6,Other,True,Nb75Pt24.5Rh0.5,Nb-Pt-Rh,3,Supercon,Nb3Rh0.02Pt0.98,MP-mp-2663,Nb6Pt2,Nb-Pt,Nb75Pt25,P m -3 n,cubic,5.206284,5.206284,5.206284,data/final/MP/cifs/Nb3Pt0.98Rh0.02-MP-mp-2663-synth_doped.cif,data/source/MP/raw/cifs/mp-2663.cif,mp-2663,0.0,,2011-05-14 02:42:41,11.150477426700435,10.17188/1201206,"@misc{osti_1201206,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Pt (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201206"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1667983'}},0.0,5.9039275,520.0,-75.80228808,-9.47528601,{'tags': ['Niobium platinum (3/1)']},-75.80228808,-9.47528601,-0.3815803024999997,"['xas', 'elasticity', 'bandstructure']",True,"[645231, 645226, 645216, 645227, 105203, 645228, 645218, 645236, 645224]",True,2021-05-12 10:56:18.721000,NM,8,8,mp-2663,,Nb3Pt,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Pt'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Pt': 1.0}",GGA,mp-2663,"['mp-929425', 'mp-912670', 'mp-929036', 'mp-2663', 'mp-1438686', 'mp-1667983', 'mp-1778280', 'mp-1593946']",0.0004491,"{'Nb': 6.0, 'Pt': 2.0}",141.11837435118034,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",6.364869239244375e-06,0.0004491,0,0.0008982,MP,data/source/MP/cleaned/cifs/MP-mp-2663.cif,True,,data/final/MP/graphs/Nb3Pt0.98Rh0.02-MP-mp-2663-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba0.1Sr0.9Ti1O3,2,0.0399999999999999,1.0,True,Ba0.1Sr0.9Ti1O3,Sr1Ti1O3,0.1,Oxide,True,Ba2Sr18Ti20O60,Ba-Sr-Ti-O,4,Supercon,Ba0.1Sr0.9Ti1O3,MP-mp-551830,Sr2Ti2O6,Sr-Ti-O,Sr20Ti20O60,P m -3 m,cubic,3.942851452350787,3.942851452692745,3.9464989993092807,data/final/MP/cifs/Ba0.1Sr0.9Ti1O3-MP-mp-551830-synth_doped.cif,data/source/MP/raw/cifs/mp-551830.cif,mp-551830,1.7869999999999997,,2014-02-21 05:23:00,4.966121139868444,,,{'GGA': {'task_id': 'mp-1759822'}},0.0005822479999988,3.22413565,520.0,-80.25240668,-8.025240668,{'tags': []},-80.25240668,-8.025240668,-3.551666971000001,"['bandstructure', 'elasticity']",True,[],True,2021-05-12 10:56:22.739000,NM,10,4,mp-551830,oxide,SrTiO3,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ti_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Ti': 1.0, 'O': 3.0}",GGA,mp-551830,"['mp-551830', 'mp-1406736', 'mp-1759822', 'mp-1627898']",0.00106425,"{'Sr': 2.0, 'Ti': 2.0, 'O': 6.0}",122.70515928291898,[],NM,False,221,0,"[0, 0, 0, 0, 0]",1.7346458881100164e-05,0.00106425,0,0.0021285,MP,data/source/MP/cleaned/cifs/MP-mp-551830.cif,True,,data/final/MP/graphs/Ba0.1Sr0.9Ti1O3-MP-mp-551830-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Cr3Ru1,1,0.0,2.0,False,Cr6Ru2,Cr6Ru2,3.3,Other,True,Cr75Ru25,Cr-Ru,2,Supercon,Cr3Ru1,MP-mp-1272,Cr6Ru2,Cr-Ru,Cr75Ru25,P m -3 n,cubic,4.632632,4.632632,4.632632,data/final/MP/cifs/Cr3Ru1-MP-mp-1272.cif,data/source/MP/raw/cifs/mp-1272.cif,mp-1272,0.0,,2011-05-14 14:28:27,8.586720287673844,10.17188/1189141,"@misc{osti_1189141,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Cr3Ru (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189141"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702571'}},0.0821159475000019,7.27903235,520.0,-75.81013655,-9.47626706875,{'tags': ['Chromium ruthenium (3/1)']},-75.81013655,-9.47626706875,0.0821159475000019,"['xas', 'elasticity', 'bandstructure']",True,"[102843, 659684]",True,2021-05-12 10:56:12.755000,NM,8,8,mp-1272,,Cr3Ru,"{'functional': 'PBE', 'labels': ['Cr_pv', 'Ru_pv'], 'pot_type': 'paw'}","{'Cr': 3.0, 'Ru': 1.0}",GGA,mp-1272,"['mp-930605', 'mp-913890', 'mp-1272', 'mp-1413111', 'mp-1702571', 'mp-1797412', 'mp-977663', 'mp-1589232']",0.1460382,"{'Cr': 6.0, 'Ru': 2.0}",99.42220900255236,[],NM,False,223,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0029377379856094,0.1460382,0,0.2920764,MP,data/source/MP/cleaned/cifs/MP-mp-1272.cif,False,,data/final/MP/graphs/Cr3Ru1-MP-mp-1272.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Mo0.6Ru0.4,1,0.0,30.0,False,Mo18Ru12,Mo18Ru12,7.85,Other,True,Mo60Ru40,Mo-Ru,2,Supercon,Mo0.6Ru0.4,MP-mp-1221651,Mo18Ru12,Mo-Ru,Mo60Ru40,C m m 2,orthorhombic,4.967305,9.61140189,9.61140189,data/final/MP/cifs/Mo0.6Ru0.4-MP-mp-1221651.cif,data/source/MP/raw/cifs/mp-1221651.cif,mp-1221651,0.0,,2019-01-12 22:18:34.106000,10.638344817976051,,,,0.0675305406666666,8.15478211,520.0,-305.46591878,-10.182197292666666,{'tags': []},-305.46591878,-10.182197292666666,0.0349443873333351,[],False,[],True,2021-05-12 11:00:47.244000,NM,30,2,mp-1221651,,Mo3Ru2,"{'functional': 'PBE', 'labels': ['Mo_pv', 'Ru_pv'], 'pot_type': 'paw'}","{'Mo': 3.0, 'Ru': 2.0}",GGA,mp-1221651,"['mp-1221651', 'mp-1820512']",0.0304549166666666,"{'Mo': 18.0, 'Ru': 12.0}",458.867089754357,[],NM,False,35,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0003982187959869,0.0304549166666666,0,0.1827295,MP,data/source/MP/cleaned/cifs/MP-mp-1221651.cif,False,,data/final/MP/graphs/Mo0.6Ru0.4-MP-mp-1221651.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Os0.8W0.2,3,0.1,8.0,False,Os6.4W1.6,Os6W2,0.0,Other,True,Os80W20,Os-W,2,Supercon,Os0.8W0.2,MP-mp-1186374,Os6W2,Os-W,Os75W25,P 63/m m c,hexagonal,4.407165,5.567025997829749,5.56702605,data/final/MP/cifs/Os0.8W0.2-MP-mp-1186374-synth_doped.cif,data/source/MP/raw/cifs/mp-1186374.cif,mp-1186374,0.0,,2019-01-11 14:16:35.182000,21.184545858792507,,,{'GGA': {'task_id': 'mp-1753019'}},0.0,7.9158138,520.0,-93.7481822,-11.718522775,{'tags': []},-93.7481822,-11.718522775,-0.0584664662499996,['bandstructure'],True,[],True,2021-05-12 10:58:29.672000,NM,8,5,mp-1186374,,Os3W,"{'functional': 'PBE', 'labels': ['Os_pv', 'W_pv'], 'pot_type': 'paw'}","{'Os': 3.0, 'W': 1.0}",GGA,mp-1186374,"['mp-1186374', 'mp-1446191', 'mp-1753019', 'mp-1802622', 'mp-1619113']",0.0026669,"{'Os': 6.0, 'W': 2.0}",118.28684459635738,[],NM,False,187,0,"[-0.0, -0.0, -0.0, 0.0, 0.0, 0.0, -0.0, 0.0]",4.5092081187904586e-05,0.0026669,0,0.0053338,MP,data/source/MP/cleaned/cifs/MP-mp-1186374.cif,True,,data/final/MP/graphs/Os0.8W0.2-MP-mp-1186374-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
B2C1Er1Fe0.1Ni1.9,2,0.0333333333333333,1.0,True,B2C1Er1Fe0.1Ni1.9,B2C1Er1Ni2,2.155,Other,True,B33.333C16.667Er16.667Fe1.667Ni31.667,B-C-Er-Fe-Ni,5,Supercon,Er1Ni1.9Fe0.1B2C1,MP-mp-6098,Er1Ni2B2C1,B-C-Er-Ni,B33.333C16.667Er16.667Ni33.333,I 4/m m m,tetragonal,3.5122880026935177,3.5122880026935173,5.77805085,data/final/MP/cifs/B2C1Er1Fe0.1Ni1.9-MP-mp-6098-synth_doped.cif,data/source/MP/raw/cifs/mp-6098.cif,mp-6098,0.0,,2011-05-13 04:24:02,8.212015229638553,10.17188/1277667,"@misc{osti_1277667,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ErNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277667"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700042'}},0.0,6.72687579,520.0,-41.84324782,-6.973874636666667,{'tags': []},-41.84324782,-6.973874636666667,-0.5216152347222227,"['xas', 'elasticity', 'bandstructure']",True,"[246431, 79576, 56651]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-6098,,ErNi2B2C,"{'functional': 'PBE', 'labels': ['Er_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Er': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6098,"['mp-1006980', 'mp-1000513', 'mp-6098', 'mp-1441533', 'mp-1700042', 'mp-1793903', 'mp-1011723', 'mp-1589040']",0.0020747,"{'Er': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",64.35860973581151,[],NM,False,139,0,"[0.0, -0.0, -0.0, 0.0, 0.0, 0.0]",3.2236557136900987e-05,0.0020747,0,0.0020747,MP,data/source/MP/cleaned/cifs/MP-mp-6098.cif,True,,data/final/MP/graphs/B2C1Er1Fe0.1Ni1.9-MP-mp-6098-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Nb0.22Ti0.8,3,0.0686274509803921,3.75,False,Nb0.825Ti3,Nb1Ti3,7.8,Other,True,Nb21.569Ti78.431,Nb-Ti,2,Supercon,Nb0.22Ti0.8,MP-mp-1217091,Ti3Nb1,Nb-Ti,Nb25Ti75,A m m 2,orthorhombic,2.89984245,2.89984245,9.06913,data/final/MP/cifs/Nb0.22Ti0.8-MP-mp-1217091-synth_doped.cif,data/source/MP/raw/cifs/mp-1217091.cif,mp-1217091,0.0,,2019-01-12 18:29:14.218000,5.555684700792092,,,{'GGA': {'task_id': 'mp-1764159'}},0.055423704999999,5.52521286,520.0,-33.56608627,-8.3915215675,{'tags': []},-33.56608627,-8.3915215675,0.055423704999999,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,4,5,mp-1217091,,Ti3Nb,"{'functional': 'PBE', 'labels': ['Ti_pv', 'Nb_pv'], 'pot_type': 'paw'}","{'Ti': 3.0, 'Nb': 1.0}",GGA,mp-1217091,"['mp-1217091', 'mp-1427440', 'mp-1764159', 'mp-1784097', 'mp-1617208']",0.0319281,"{'Ti': 3.0, 'Nb': 1.0}",70.68971066216531,[],NM,False,38,0,"[0, 0, 0, 0]",0.000451665450331,0.0319281,0,0.0319281,MP,data/source/MP/cleaned/cifs/MP-mp-1217091.cif,True,,data/final/MP/graphs/Nb0.22Ti0.8-MP-mp-1217091-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Pt3Y7,3,0.0666666666666666,1.1429285714285715,True,Pt3.429Y8,Pt4Y8,0.82,Other,True,Pt30Y70,Pt-Y,2,Supercon,Pt3Y7,MP-mp-1102657,Y8Pt4,Pt-Y,Pt33.333Y66.667,P n m a,orthorhombic,4.788387,7.197318,8.81486,data/final/MP/cifs/Pt3Y7-MP-mp-1102657-synth_doped.cif,data/source/MP/raw/cifs/mp-1102657.cif,mp-1102657,0.0,,2018-07-18 14:54:31,8.153068860981204,,,{'GGA': {'task_id': 'mp-1708101'}},0.0,4.33748445,520.0,-87.13693315,-7.261411095833334,"{'tags': ['Co2Si-b', 'Y2Pt', 'Platinum yttrium (1/2)']}",-87.13693315,-7.261411095833334,-0.9267944502777776,['bandstructure'],True,[649844],True,2021-05-12 10:58:20.361000,NM,12,5,mp-1102657,,Y2Pt,"{'functional': 'PBE', 'labels': ['Y_sv', 'Pt'], 'pot_type': 'paw'}","{'Y': 2.0, 'Pt': 1.0}",GGA,mp-1102657,"['mp-1102657', 'mp-1436897', 'mp-1708101', 'mp-1810729', 'mp-1597393']",0.001067925,"{'Y': 8.0, 'Pt': 4.0}",303.79131498841934,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.4061297309183572e-05,0.001067925,0,0.0042717,MP,data/source/MP/cleaned/cifs/MP-mp-1102657.cif,True,,data/final/MP/graphs/Pt3Y7-MP-mp-1102657-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Bi1Ce1F0.25S2O0.75,3,0.1,2.0,False,Bi2Ce2F0.5S4O1.5,Bi2Ce2S4O2,0.0,OxideHeavy_fermion,False,Bi20Ce20F5S40O15,Bi-Ce-F-S-O,5,Supercon,Ce1Bi1S2F0.25O0.75,MP-mp-610469,Ce2Bi2S4O2,Bi-Ce-S-O,Bi20Ce20S40O20,P 4/n m m,tetragonal,4.015541,4.015541,13.614615,data/final/MP/cifs/Bi1Ce1F0.25S2O0.75-MP-mp-610469-synth_doped.cif,data/source/MP/raw/cifs/mp-610469.cif,mp-610469,0.0,,2014-05-08 06:44:31,6.493388956885671,10.17188/1277674,"@misc{osti_1277674,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeBiS2O (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277674"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696129'}},0.0324931817500022,6.5998878,520.0,-63.11450623,-6.311450623000001,{'tags': ['Bismuth cerium oxide disulfide']},-63.11450623,-6.311450623000001,-2.04125378225,"['xas', 'bandstructure']",True,[80],True,2021-05-12 10:57:28.836000,FM,10,8,mp-610469,oxide,CeBiS2O,"{'functional': 'PBE', 'labels': ['Ce', 'Bi', 'S', 'O'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Bi': 1.0, 'S': 2.0, 'O': 1.0}",GGA,mp-610469,"['mp-909953', 'mp-925481', 'mp-925925', 'mp-610469', 'mp-1424098', 'mp-1696129', 'mp-1830050', 'mp-1599903']",0.8634528,"{'Ce': 2.0, 'Bi': 2.0, 'S': 4.0, 'O': 2.0}",219.5298060920356,[],FM,True,129,1,"[0.7, 0.7, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0078663832977468,0.8634528,2,1.7269056,MP,data/source/MP/cleaned/cifs/MP-mp-610469.cif,True,,data/final/MP/graphs/Bi1Ce1F0.25S2O0.75-MP-mp-610469-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ga0.9Nb3Zn0.1,2,0.0499999999999999,2.0,False,Ga1.8Nb6Zn0.2,Ga2Nb6,16.1,Other,True,Ga22.5Nb75Zn2.5,Ga-Nb-Zn,3,Supercon,Nb3Ga0.9Zn0.1,MP-mp-2670,Nb6Ga2,Ga-Nb,Ga25Nb75,P m -3 n,cubic,5.189021,5.189021,5.189021,data/final/MP/cifs/Ga0.9Nb3Zn0.1-MP-mp-2670-synth_doped.cif,data/source/MP/raw/cifs/mp-2670.cif,mp-2670,0.0,,2011-05-14 07:55:50,8.28234811962253,10.17188/1201220,"@misc{osti_1201220,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Ga (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201220"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686575'}},0.0550303606249986,4.96610647,520.0,-68.03986833,-8.50498354125,"{'tags': ['Gallium niobium (1/3)', 'Niobium gallide (3/1)']}",-68.03986833,-8.50498354125,-0.1719807556250003,"['xas', 'elasticity', 'bandstructure']",True,"[634772, 634745, 634746, 634774, 634731, 634748, 634762, 634767, 108484, 634734, 634761, 103831]",True,2021-05-12 10:56:18.721000,NM,8,9,mp-2670,,Nb3Ga,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Ga_d'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Ga': 1.0}",GGA,mp-2670,"['mp-928915', 'mp-912435', 'mp-929292', 'mp-2670', 'mp-1078851', 'mp-1440107', 'mp-1686575', 'mp-1781117', 'mp-1594502']",0.0001134,"{'Nb': 6.0, 'Ga': 2.0}",139.71926259628808,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.6232550600794926e-06,0.0001134,0,0.0002268,MP,data/source/MP/cleaned/cifs/MP-mp-2670.cif,True,,data/final/MP/graphs/Ga0.9Nb3Zn0.1-MP-mp-2670-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ce1Co1.85,2,0.0350877192982456,2.0,False,Ce2Co3.7,Ce2Co4,0.86,Heavy_fermion,True,Ce35.088Co64.912,Ce-Co,2,Supercon,Ce1Co1.85,MP-mp-1112,Ce2Co4,Ce-Co,Ce33.333Co66.667,F d -3 m,cubic,4.99867784,4.99867784,4.99867784,data/final/MP/cifs/Ce1Co1.85-MP-mp-1112-synth_doped.cif,data/source/MP/raw/cifs/mp-1112.cif,mp-1112,0.0,,2011-05-13 09:02:17,9.701049230746174,10.17188/1187580,"@misc{osti_1187580,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeCo2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187580"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686856'}},0.0,8.26937171,520.0,-41.81273492,-6.968789153333333,{'tags': ['Cerium cobalt (1/2)']},-41.81273492,-6.968789153333333,-0.2522142383333327,"['xas', 'bandstructure']",True,"[102094, 620652, 620671, 657905, 108239, 620681, 620677, 620694, 620679, 620691, 620644, 656107, 620672, 620661, 620654]",True,2021-05-12 10:56:51.169000,NM,6,9,mp-1112,,CeCo2,"{'functional': 'PBE', 'labels': ['Ce', 'Co'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Co': 2.0}",GGA,mp-1112,"['mp-930540', 'mp-929975', 'mp-913634', 'mp-1112', 'mp-1440572', 'mp-1686856', 'mp-1801907', 'mp-1593275', 'mp-1596792']",0.0056005,"{'Ce': 2.0, 'Co': 4.0}",88.31824824311025,[],NM,False,227,0,"[0.0, 0.0, -0.0, -0.0, -0.0, -0.0]",0.0001268254321481,0.0056005,0,0.011201,MP,data/source/MP/cleaned/cifs/MP-mp-1112.cif,True,,data/final/MP/graphs/Ce1Co1.85-MP-mp-1112-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Al0.085B2Mg0.915,3,0.0566666666666666,1.0,True,Al0.085B2Mg0.915,B2Mg1,32.4,Other,True,Al2.833B66.667Mg30.5,Al-B-Mg,3,Supercon,Mg0.915Al0.085B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/Al0.085B2Mg0.915-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/Al0.085B2Mg0.915-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ca2.8Co0.2Rh4Sn13,3,0.02,2.0,False,Ca5.6Co0.4Rh8Sn26,Ca6Rh8Sn26,7.73,Other,True,Ca14Co1Rh20Sn65,Ca-Co-Rh-Sn,4,Supercon,Ca2.8Co0.2Rh4Sn13,MP-mp-4363,Ca6Sn26Rh8,Ca-Rh-Sn,Ca15Rh20Sn65,P m -3 n,cubic,9.84313,9.84313,9.84313,data/final/MP/cifs/Ca2.8Co0.2Rh4Sn13-MP-mp-4363-synth_doped.cif,data/source/MP/raw/cifs/mp-4363.cif,mp-4363,0.0,,2014-02-15 18:49:13,7.226292400553128,10.17188/1208100,"@misc{osti_1208100,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ca3Sn13Rh4 (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208100"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-941135'}},0.0,7.48134851,520.0,-195.3182753,-4.8829568825,"{'tags': ['Calcium rhodium stannide (3/4/13)', 'Calcium rhodium tin (3/4/13)']}",-195.3182753,-4.8829568825,-0.5030336207499999,"['xas', 'bandstructure']",True,"[619526, 58930, 58931, 58932]",True,2021-05-12 10:57:08.928000,NM,40,5,mp-4363,,Ca3Sn13Rh4,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Sn_d', 'Rh_pv'], 'pot_type': 'paw'}","{'Ca': 3.0, 'Sn': 13.0, 'Rh': 4.0}",GGA,mp-4363,"['mp-934615', 'mp-941514', 'mp-941135', 'mp-4363', 'mp-1345428']",0.0015042,"{'Ca': 6.0, 'Sn': 26.0, 'Rh': 8.0}",953.6733856191524,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.15453911723337e-06,0.0015042,0,0.0030084,MP,data/source/MP/cleaned/cifs/MP-mp-4363.cif,True,,data/final/MP/graphs/Ca2.8Co0.2Rh4Sn13-MP-mp-4363-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
B2Dy1Ru1,1,0.0,4.0,False,B8Dy4Ru4,B8Dy4Ru4,0.0,Other,True,B50Dy25Ru25,B-Dy-Ru,3,Supercon,Dy1Ru1B2,MP-mp-1189977,Dy4B8Ru4,B-Dy-Ru,B50Dy25Ru25,P n m a,orthorhombic,5.335744,5.917991,6.366081,data/final/MP/cifs/B2Dy1Ru1-MP-mp-1189977.cif,data/source/MP/raw/cifs/mp-1189977.cif,mp-1189977,0.0,,2019-01-11 20:36:06.193000,9.423342634531126,,,,0.0,6.07877904,520.0,-118.66013802,-7.41625862625,"{'tags': ['DyRuB2', 'LuRuB2', 'Dysprosium ruthenium boride (1/1/2)']}",-118.66013802,-7.41625862625,-0.6062686170833338,[],False,[613687],True,2021-05-12 10:59:54.607000,NM,16,3,mp-1189977,,DyB2Ru,"{'functional': 'PBE', 'labels': ['Dy_3', 'B', 'Ru_pv'], 'pot_type': 'paw'}","{'Dy': 1.0, 'B': 2.0, 'Ru': 1.0}",GGA,mp-1189977,"['mp-1189977', 'mp-1833855', 'mp-1986041']",0.007721,"{'Dy': 4.0, 'B': 8.0, 'Ru': 4.0}",201.02100744863787,[],NM,False,62,0,"[-0.0, -0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001536356841107,0.007721,0,0.030884,MP,data/source/MP/cleaned/cifs/MP-mp-1189977.cif,False,,data/final/MP/graphs/B2Dy1Ru1-MP-mp-1189977.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
H2Ti1,1,0.0,1.0,True,H2Ti1,H2Ti1,0.0,Other,True,H66.667Ti33.333,H-Ti,2,Supercon,H2Ti1,MP-mp-24161,Ti1H2,H-Ti,H66.667Ti33.333,F m -3 m,cubic,3.12848082,3.12848082,3.12848082,data/final/MP/cifs/H2Ti1-MP-mp-24161.cif,data/source/MP/raw/cifs/mp-24161.cif,mp-24161,0.0,,2015-03-06 16:25:57,3.825737132252341,10.17188/1199952,"@misc{osti_1199952,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TiH2 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199952"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686754'}},0.0,5.74583783,520.0,-16.13176027,-5.377253423333333,"{'tags': ['Titanium hydride (1/2)', 'Titanium deuteride (1/2)', 'Titanium hydride (1/2) - f', 'High pressure experimental phase', 'Titanium hydride (1/2) - HT']}",-16.13176027,-5.377253423333333,-0.6029387211111121,"['xas', 'elasticity', 'bandstructure']",True,"[638505, 169601, 168833, 56183, 166235, 658062, 638499, 96297, 168329, 169602, 57146, 160925, 164602, 56182]",True,2021-05-12 10:56:16.728000,NM,3,10,mp-24161,,TiH2,"{'functional': 'PBE', 'labels': ['Ti_pv', 'H'], 'pot_type': 'paw'}","{'Ti': 1.0, 'H': 2.0}",GGA,mp-24161,"['mp-950595', 'mp-949793', 'mp-939308', 'mp-24161', 'mp-1440647', 'mp-1686754', 'mp-1793948', 'mp-1932168', 'mp-1591727', 'mp-1594219']",0.0016973,"{'Ti': 1.0, 'H': 2.0}",21.651375442450625,[],NM,False,225,0,"[0, 0, 0]",7.839224831288085e-05,0.0016973,0,0.0016973,MP,data/source/MP/cleaned/cifs/MP-mp-24161.cif,False,,data/final/MP/graphs/H2Ti1-MP-mp-24161.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Nd1P2Pd2,1,0.0,1.0,True,Nd1P2Pd2,Nd1P2Pd2,0.0,Other,True,Nd20P40Pd40,Nd-P-Pd,3,Supercon,Nd1Pd2P2,MP-mp-1206126,Nd1P2Pd2,Nd-P-Pd,Nd20P40Pd40,I 4/m m m,tetragonal,4.1649640014138765,4.1649640014138765,5.80294775,data/final/MP/cifs/Nd1P2Pd2-MP-mp-1206126.cif,data/source/MP/raw/cifs/mp-1206126.cif,mp-1206126,0.0,,2019-01-12 09:30:00.663000,8.022224018233223,,,{'GGA': {'task_id': 'mp-1760621'}},0.0,6.80791644,520.0,-30.76409428,-6.152818856,"{'tags': ['NdPd2P2', 'CeAl2Ga2']}",-30.76409428,-6.152818856,-0.9619164873333326,['bandstructure'],True,[],True,2021-05-12 10:58:37.524000,NM,5,5,mp-1206126,,Nd(PPd)2,"{'functional': 'PBE', 'labels': ['Nd_3', 'P', 'Pd'], 'pot_type': 'paw'}","{'Nd': 1.0, 'P': 2.0, 'Pd': 2.0}",GGA,mp-1206126,"['mp-1206126', 'mp-1393262', 'mp-1760621', 'mp-1782707', 'mp-1584666']",0.0005292,"{'Nd': 1.0, 'P': 2.0, 'Pd': 2.0}",86.73590927893899,[],NM,False,139,0,"[0, 0, 0, 0, 0]",6.101279209492291e-06,0.0005292,0,0.0005292,MP,data/source/MP/cleaned/cifs/MP-mp-1206126.cif,False,,data/final/MP/graphs/Nd1P2Pd2-MP-mp-1206126.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B0.8C1.2Lu1Ni1,3,0.0999999999999999,2.0,False,B1.6C2.4Lu2Ni2,B2C2Lu2Ni2,3.2,Other,True,B20C30Lu25Ni25,B-C-Lu-Ni,4,Supercon,Lu1Ni1B0.8C1.2,MP-mp-6188,Lu2Ni2B2C2,B-C-Lu-Ni,B25C25Lu25Ni25,P 4/n m m,tetragonal,3.499459,3.499459,7.54108,data/final/MP/cifs/B0.8C1.2Lu1Ni1-MP-mp-6188-synth_doped.cif,data/source/MP/raw/cifs/mp-6188.cif,mp-6188,0.0,,2011-05-13 11:39:58,9.22360692471969,10.17188/1277950,"@misc{osti_1277950,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LuNiBC (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277950"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701902'}},0.0,5.56637243,520.0,-56.94584528,-7.11823066,{'tags': []},-56.94584528,-7.11823066,-0.5664157422916656,"['xas', 'bandstructure']",True,"[54041, 75610]",True,2021-05-12 10:57:28.836000,NM,8,8,mp-6188,,LuNiBC,"{'functional': 'PBE', 'labels': ['Lu_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Lu': 1.0, 'Ni': 1.0, 'B': 1.0, 'C': 1.0}",GGA,mp-6188,"['mp-6188', 'mp-1007095', 'mp-1000629', 'mp-1426768', 'mp-1701902', 'mp-1796435', 'mp-1011840', 'mp-1591367']",0.0004347,"{'Lu': 2.0, 'Ni': 2.0, 'B': 2.0, 'C': 2.0}",92.34967413717082,[],NM,False,129,0,"[0, 0, 0, 0, 0, 0, 0, 0]",9.414218383798992e-06,0.0004347,0,0.0008694,MP,data/source/MP/cleaned/cifs/MP-mp-6188.cif,True,,data/final/MP/graphs/B0.8C1.2Lu1Ni1-MP-mp-6188-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ge0.4Si0.6V3,2,0.0499999999999999,2.0,False,Ge0.8Si1.2V6,Ge1Si1V6,8.7,Other,True,Ge10Si15V75,Ge-Si-V,3,Supercon,V3Si0.6Ge0.4,MP-mp-1216453,V6Si1Ge1,Ge-Si-V,Ge12.5Si12.5V75,P m -3,cubic,4.734388,4.734388,4.734388,data/final/MP/cifs/Ge0.4Si0.6V3-MP-mp-1216453-synth_doped.cif,data/source/MP/raw/cifs/mp-1216453.cif,mp-1216453,0.0,,2019-01-12 17:57:35.454000,6.358929418376749,,,{'GGA': {'task_id': 'mp-1754998'}},0.0,7.11494476,520.0,-67.7541736,-8.4692717,{'tags': []},-67.7541736,-8.4692717,-0.4002994131249995,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,FM,8,5,mp-1216453,,V6SiGe,"{'functional': 'PBE', 'labels': ['V_pv', 'Si', 'Ge_d'], 'pot_type': 'paw'}","{'V': 6.0, 'Si': 1.0, 'Ge': 1.0}",GGA,mp-1216453,"['mp-1216453', 'mp-1400373', 'mp-1754998', 'mp-1939394', 'mp-1621955']",1.2825662,"{'V': 6.0, 'Si': 1.0, 'Ge': 1.0}",106.1186071620683,[],FM,True,47,1,"[0.1, 0.2, 0.2, 0.1, 0.2, 0.2, 0.0, 0.0]",0.0120861575014946,1.2825662,6,1.2825662,MP,data/source/MP/cleaned/cifs/MP-mp-1216453.cif,True,,data/final/MP/graphs/Ge0.4Si0.6V3-MP-mp-1216453-synth_doped.json,0,True,m-3,2,0,0,0,0,0,0,1,0,0,0,1.0,False
Rh3Si5Y2,1,0.0,2.0,False,Rh6Si10Y4,Rh6Si10Y4,2.7,Other,True,Rh30Si50Y20,Rh-Si-Y,3,Supercon,Y2Rh3Si5,MP-mp-9882,Y4Si10Rh6,Rh-Si-Y,Rh30Si50Y20,C 1 2/c 1,monoclinic,5.70973366,8.11473464,8.11473464,data/final/MP/cifs/Rh3Si5Y2-MP-mp-9882.cif,data/source/MP/raw/cifs/mp-9882.cif,mp-9882,0.0,,2011-06-08 14:52:48,6.297658921001547,10.17188/1316768,"@misc{osti_1316768,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Y2Si5Rh3 (SG:15) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1316768"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1673679'}},0.0,7.53432154,520.0,-143.79477495,-7.1897387475,{'tags': ['Yttrium rhodium silicide (2/3/5)']},-143.79477495,-7.1897387475,-0.9744951538333332,"['xas', 'bandstructure']",True,[40760],True,2021-05-12 10:57:57.486000,NM,20,9,mp-9882,,Y2Si5Rh3,"{'functional': 'PBE', 'labels': ['Y_sv', 'Si', 'Rh_pv'], 'pot_type': 'paw'}","{'Y': 2.0, 'Si': 5.0, 'Rh': 3.0}",GGA,mp-9882,"['mp-942409', 'mp-9882', 'mp-942800', 'mp-920945', 'mp-1124904', 'mp-1424403', 'mp-1673679', 'mp-1811508', 'mp-1606238']",0.00293315,"{'Y': 4.0, 'Si': 10.0, 'Rh': 6.0}",330.62585507948745,[],NM,False,15,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.7743016493944952e-05,0.00293315,0,0.0058663,MP,data/source/MP/cleaned/cifs/MP-mp-9882.cif,False,,data/final/MP/graphs/Rh3Si5Y2-MP-mp-9882.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
In1S8V6,1,0.0,1.0,True,In1S8V6,In1S8V6,3.9,Chevrel,True,In6.667S53.333V40,In-S-V,3,Supercon,In1V6S8,MP-mp-1216503,V6In1S8,In-S-V,In6.667S53.333V40,P 3,trigonal,3.2365,9.186306003803171,9.18630569,data/final/MP/cifs/In1S8V6-MP-mp-1216503.cif,data/source/MP/raw/cifs/mp-1216503.cif,mp-1216503,0.0,,2019-01-12 18:00:05.688000,4.752710790288184,,,{'GGA': {'task_id': 'mp-1736725'}},0.0170584926666679,7.38092148,520.0,-104.27579269,-6.951719512666667,{'tags': []},-104.27579269,-6.951719512666667,-1.1968715736666675,[],False,[],True,2021-05-12 11:00:40.103000,NM,15,4,mp-1216503,,V6InS8,"{'functional': 'PBE', 'labels': ['V_pv', 'In_d', 'S'], 'pot_type': 'paw'}","{'V': 6.0, 'In': 1.0, 'S': 8.0}",GGA,mp-1216503,"['mp-1216503', 'mp-1403855', 'mp-1736725', 'mp-1928581']",0.1772555,"{'V': 6.0, 'In': 1.0, 'S': 8.0}",236.53098424955283,[],NM,False,143,0,"[-0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0007493965349291,0.1772555,0,0.1772555,MP,data/source/MP/cleaned/cifs/MP-mp-1216503.cif,False,,data/final/MP/graphs/In1S8V6-MP-mp-1216503.json,0,True,3,0,0,0,0,0,0,1,1,0,0,0,1.0,False
Pb1Se2Ta1,1,0.0,1.0,True,Pb1Se2Ta1,Pb1Se2Ta1,3.695,Other,True,Pb25Se50Ta25,Pb-Se-Ta,3,Supercon,Pb1Ta1Se2,MP-mp-567736,Ta1Pb1Se2,Pb-Se-Ta,Pb25Se50Ta25,P -6 m 2,hexagonal,3.483472002716736,3.48347179,9.475531,data/final/MP/cifs/Pb1Se2Ta1-MP-mp-567736.cif,data/source/MP/raw/cifs/mp-567736.cif,mp-567736,0.0,,2014-02-16 14:28:51,9.106194623148289,10.17188/1274020,"@misc{osti_1274020,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TaPbSe2 (SG:187) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1274020"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1767849'}},0.0,5.09273793,520.0,-25.14736257,-6.2868406425,{'tags': ['Lead tantalum selenide (1/1/2)']},-25.14736257,-6.2868406425,-0.8822787286718743,"['xas', 'bandstructure']",True,[648539],True,2021-05-12 10:57:23.123000,NM,4,8,mp-567736,,TaPbSe2,"{'functional': 'PBE', 'labels': ['Ta_pv', 'Pb_d', 'Se'], 'pot_type': 'paw'}","{'Ta': 1.0, 'Pb': 1.0, 'Se': 2.0}",GGA,mp-567736,"['mp-1007513', 'mp-1001147', 'mp-567736', 'mp-1387667', 'mp-1767849', 'mp-1797716', 'mp-1012276', 'mp-1614591']",0.0105849,"{'Ta': 1.0, 'Pb': 1.0, 'Se': 2.0}",99.57694572553991,[],NM,False,187,0,"[0, 0, 0, 0]",0.0001062987011991,0.0105849,0,0.0105849,MP,data/source/MP/cleaned/cifs/MP-mp-567736.cif,False,,data/final/MP/graphs/Pb1Se2Ta1-MP-mp-567736.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Cu1Hg1O4.032,2,0.0039840637450199,0.992015873015873,True,Ba1.984Cu0.992Hg0.992O4,Ba2Cu1Hg1O4,36.0,Cuprate,True,Ba24.9Cu12.45Hg12.45O50.199203187251,Ba-Cu-Hg-O,4,Supercon,Hg1Ba2Cu1O4.032,MP-mp-6562,Ba2Cu1Hg1O4,Ba-Cu-Hg-O,Ba25Cu12.5Hg12.5O50,P 4/m m m,tetragonal,3.933714,3.933714,9.827602,data/final/MP/cifs/Ba2Cu1Hg1O4.032-MP-mp-6562-synth_doped.cif,data/source/MP/raw/cifs/mp-6562.cif,mp-6562,0.0,,2011-05-13 18:18:06,6.582036471328142,10.17188/1281336,"@misc{osti_1281336,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2CuHgO4 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281336"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697135'}},0.0234340381250053,2.58068675,520.0,-40.91481298,-5.1143516225,"{'tags': ['Mercury dibarium copper oxide', 'High pressure experimental phase']}",-40.91481298,-5.1143516225,-1.953767533125,"['xas', 'bandstructure']",True,"[75722, 75720, 75724, 75721, 75723]",True,2021-05-12 10:57:32.679000,NM,8,8,mp-6562,oxide,Ba2CuHgO4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Cu_pv', 'Hg', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",GGA,mp-6562,"['mp-6562', 'mp-990899', 'mp-992892', 'mp-1435690', 'mp-1697135', 'mp-1878488', 'mp-994198', 'mp-1592659']",0.0003984,"{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",152.07335344042525,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0, 0, 0]",2.619788352047311e-06,0.0003984,0,0.0003984,MP,data/source/MP/cleaned/cifs/MP-mp-6562.cif,True,,data/final/MP/graphs/Ba2Cu1Hg1O4.032-MP-mp-6562-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
In0.051Sn0.949Te1,3,0.051,1.0,True,In0.051Sn0.949Te1,Sn1Te1,1.653,Other,True,In2.55Sn47.45Te50,In-Sn-Te,3,Supercon,Sn0.949In0.051Te1,MP-mp-1883,Sn1Te1,Sn-Te,Sn50Te50,F m -3 m,cubic,4.53766968,4.53766968,4.53766968,data/final/MP/cifs/In0.051Sn0.949Te1-MP-mp-1883-synth_doped.cif,data/source/MP/raw/cifs/mp-1883.cif,mp-1883,0.6623999999999999,,2011-05-12 18:43:07,6.19081042904143,10.17188/1193534,"@misc{osti_1193534,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SnTe (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1193534"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686906'}},0.0,6.06645058,520.0,-7.72519638,-3.86259819,"{'tags': ['Tin telluride (1/1)', 'Tin telluride']}",-7.72519638,-3.86259819,-0.4971617975000004,"['eos', 'elasticity', 'bandstructure', 'xas']",True,"[52489, 652760, 652744, 652756, 652761, 600865, 652763, 652745, 652742, 604177, 600813, 652741, 601065, 652750, 652755, 652753, 652751, 652749, 652752, 600136, 652754, 652746, 652759]",True,2021-05-12 10:56:14.760000,NM,2,9,mp-1883,,SnTe,"{'functional': 'PBE', 'labels': ['Sn_d', 'Te'], 'pot_type': 'paw'}","{'Sn': 1.0, 'Te': 1.0}",GGA,mp-1883,"['mp-663289', 'mp-655511', 'mp-657302', 'mp-1883', 'mp-1440781', 'mp-1686906', 'mp-1784332', 'mp-1596407', 'mp-1596974']",0.0,"{'Sn': 1.0, 'Te': 1.0}",66.06685541129963,[],NM,False,225,0,"[0, 0]",0.0,0.0,0,0.0,MP,data/source/MP/cleaned/cifs/MP-mp-1883.cif,True,,data/final/MP/graphs/In0.051Sn0.949Te1-MP-mp-1883-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Cu1La1.943Sr0.057O4,2,0.0162857142857142,1.0,True,Cu1La1.943Sr0.057O4,Cu1La2O4,4.51,Cuprate,True,Cu14.286La27.757Sr0.814O57.142857142857146,Cu-La-Sr-O,4,Supercon,La1.943Sr0.057Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La1.943Sr0.057O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La1.943Sr0.057O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B1Li2Ni0.15Pd2.85,2,0.0499999999999999,4.0,False,B4Li8Ni0.6Pd11.4,B4Li8Pd12,7.663333333,Other,True,B16.667Li33.333Ni2.5Pd47.5,B-Li-Ni-Pd,4,Supercon,Li2Pd2.85Ni0.15B1,MP-mp-20657,Li8B4Pd12,B-Li-Pd,B16.667Li33.333Pd50,P 43 3 2,cubic,6.834153,6.834153,6.834153,data/final/MP/cifs/B1Li2Ni0.15Pd2.85-MP-mp-20657-synth_doped.cif,data/source/MP/raw/cifs/mp-20657.cif,mp-20657,0.0,,2014-02-22 22:20:25,7.157380380013985,10.17188/1195787,"@misc{osti_1195787,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Li2BPd3 (SG:212) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195787"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672514'}},0.0,3.54739631,520.0,-115.20693246,-4.8002888525000005,{'tags': ['Lithium palladium boride (2/3/1)']},-115.20693246,-4.8002888525000005,-0.4608083634722219,"['xas', 'bandstructure']",True,"[156465, 246447, 84931]",True,2021-05-12 10:56:57.051000,NM,24,9,mp-20657,,Li2BPd3,"{'functional': 'PBE', 'labels': ['Li_sv', 'B', 'Pd'], 'pot_type': 'paw'}","{'Li': 2.0, 'B': 1.0, 'Pd': 3.0}",GGA,mp-20657,"['mp-921382', 'mp-906713', 'mp-920352', 'mp-20657', 'mp-1116014', 'mp-1415525', 'mp-1672514', 'mp-1806936', 'mp-1654311']",4.895e-05,"{'Li': 8.0, 'B': 4.0, 'Pd': 12.0}",319.1935391161389,[],NM,False,212,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.134209374731673e-07,4.895e-05,0,0.0001958,MP,data/source/MP/cleaned/cifs/MP-mp-20657.cif,True,,data/final/MP/graphs/B1Li2Ni0.15Pd2.85-MP-mp-20657-synth_doped.json,0,True,432,4,0,0,0,0,0,0,1,0,0,0,1.0,False
Rh3Y1,1,0.0,6.0,False,Rh18Y6,Rh18Y6,1.07,Other,True,Rh75Y25,Rh-Y,2,Supercon,Rh3Y1,MP-mp-1191413,Y6Rh18,Rh-Y,Rh75Y25,P 63/m m c,hexagonal,5.265283998027329,5.26528339,17.594962,data/final/MP/cifs/Rh3Y1-MP-mp-1191413.cif,data/source/MP/raw/cifs/mp-1191413.cif,mp-1191413,0.0,,2019-01-11 21:41:32.063000,9.37796559445738,,,{'GGA': {'task_id': 'mp-1734604'}},0.0,5.41206383,520.0,-184.86951944,-7.702896643333333,"{'tags': ['YRh3 rt', 'CeNi3', 'Laves-CaCu5 intergrowth', 'Rhodium yttrium (3/1)']}",-184.86951944,-7.702896643333333,-0.5630479625000007,['bandstructure'],True,[650532],True,2021-05-12 10:58:35.561000,NM,24,5,mp-1191413,,YRh3,"{'functional': 'PBE', 'labels': ['Y_sv', 'Rh_pv'], 'pot_type': 'paw'}","{'Y': 1.0, 'Rh': 3.0}",GGA,mp-1191413,"['mp-1191413', 'mp-1423189', 'mp-1734604', 'mp-1822568', 'mp-1609819']",0.0093577333333333,"{'Y': 6.0, 'Rh': 18.0}",422.4375356965697,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0001329105376666,0.0093577333333333,0,0.0561464,MP,data/source/MP/cleaned/cifs/MP-mp-1191413.cif,False,,data/final/MP/graphs/Rh3Y1-MP-mp-1191413.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
La0.85Pb3Pr0.15,3,0.075,1.0,True,La0.85Pb3Pr0.15,La1Pb3,1.88,Other,True,La21.25Pb75Pr3.75,La-Pb-Pr,3,Supercon,La0.85Pr0.15Pb3,MP-mp-21432,La1Pb3,La-Pb,La25Pb75,P m -3 m,cubic,4.968277,4.968277,4.968277,data/final/MP/cifs/La0.85Pb3Pr0.15-MP-mp-21432-synth_doped.cif,data/source/MP/raw/cifs/mp-21432.cif,mp-21432,0.0,,2014-02-21 08:53:02,10.297552988886016,10.17188/1196890,"@misc{osti_1196890,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaPb3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196890"",
    place = ""United States"",
    year = ""2016"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687535'}},0.0,7.94036935,520.0,-17.86283558,-4.465708895,{'tags': ['Lanthanum lead (1/3)']},-17.86283558,-4.465708895,-0.447221816249999,"['xas', 'elasticity', 'bandstructure']",True,"[641644, 104691, 641647, 641640, 104692, 151360]",True,2021-05-12 10:56:16.728000,NM,4,8,mp-21432,,LaPb3,"{'functional': 'PBE', 'labels': ['La', 'Pb_d'], 'pot_type': 'paw'}","{'La': 1.0, 'Pb': 3.0}",GGA,mp-21432,"['mp-993074', 'mp-991107', 'mp-21432', 'mp-1439281', 'mp-1687535', 'mp-1784789', 'mp-994394', 'mp-1589043']",0.0017048,"{'La': 1.0, 'Pb': 3.0}",122.63583830653424,[],NM,False,221,0,"[0, 0, 0, 0]",1.3901319740961604e-05,0.0017048,0,0.0017048,MP,data/source/MP/cleaned/cifs/MP-mp-21432.cif,True,,data/final/MP/graphs/La0.85Pb3Pr0.15-MP-mp-21432-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
B4Ho1Rh3.72Ru0.28,3,0.0622222222222222,2.0,False,B8Ho2Rh7.44Ru0.56,B8Ho2Rh8,6.42,Other,True,B44.444Ho11.111Rh41.333Ru3.111,B-Ho-Rh-Ru,4,Supercon,Ho1Rh3.72Ru0.28B4,MP-mp-1189784,Ho2B8Rh8,B-Ho-Rh,B44.444Ho11.111Rh44.444,P 42/n m c,tetragonal,5.334437,5.334437,7.442515,data/final/MP/cifs/B4Ho1Rh3.72Ru0.28-MP-mp-1189784-synth_doped.cif,data/source/MP/raw/cifs/mp-1189784.cif,mp-1189784,0.0,,2019-01-11 20:27:24.618000,9.719214946416653,,,{'GGA': {'task_id': 'mp-1671459'}},0.0130335600000011,6.87149626,520.0,-131.93964083,-7.329980046111111,{'tags': ['Holmium rhodium boride (1/4/4)']},-131.93964083,-7.329980046111111,-0.5791792201851851,['bandstructure'],True,[601533],True,2021-05-12 10:58:33.577000,NM,18,5,mp-1189784,,Ho(BRh)4,"{'functional': 'PBE', 'labels': ['Ho_3', 'B', 'Rh_pv'], 'pot_type': 'paw'}","{'Ho': 1.0, 'B': 4.0, 'Rh': 4.0}",GGA,mp-1189784,"['mp-1189784', 'mp-1430146', 'mp-1671459', 'mp-1786743', 'mp-1604112']",0.00025395,"{'Ho': 2.0, 'B': 8.0, 'Rh': 8.0}",211.7858301043884,[],NM,False,137,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.39817744062319e-06,0.00025395,0,0.0005079,MP,data/source/MP/cleaned/cifs/MP-mp-1189784.cif,True,,data/final/MP/graphs/B4Ho1Rh3.72Ru0.28-MP-mp-1189784-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
As1Fe1Pr1O0.7,3,0.1216216216216216,2.0,False,As2Fe2Pr2O1.4,As2Fe2Pr2O2,46.25,Ferrite,True,As27.027Fe27.027Pr27.027O18.918918918918916,As-Fe-Pr-O,4,Supercon,Pr1Fe1As1O0.7,MP-mp-22491,Pr2Fe2As2O2,As-Fe-Pr-O,As25Fe25Pr25O25,P 4/n m m,tetragonal,4.094889,4.094889,9.258722,data/final/MP/cifs/As1Fe1Pr1O0.7-MP-mp-22491-synth_doped.cif,data/source/MP/raw/cifs/mp-22491.cif,mp-22491,0.0,,2014-02-25 19:17:30,6.153806906111091,,,{'GGA+U': {'task_id': 'mp-1695715'}},0.3808778432291664,4.12348168,520.0,-51.7633941,-6.4704242625,{'tags': ['Praseodymium iron arsenic oxide (1/1/1/1)']},-51.7633941,-6.4704242625,-1.491677511249999,"['xas', 'bandstructure']",True,"[162830, 162833, 246832, 90316, 422000, 236649, 236648, 602491]",True,2021-05-12 10:57:10.838000,FM,8,8,mp-22491,oxide,PrFeAsO,"{'functional': 'PBE', 'labels': ['Pr_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Pr': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-22491,"['mp-510622', 'mp-1079608', 'mp-1079857', 'mp-22491', 'mp-1476145', 'mp-1695715', 'mp-1778524', 'mp-1596397']",3.7947681,"{'Pr': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",155.25132378854377,[],FM,True,129,1,"[0.0, 0.0, 3.5, 3.5, 0.0, 0.0, 0.0, 0.0]",0.0488854846116297,3.7947681,2,7.5895362,MP,data/source/MP/cleaned/cifs/MP-mp-22491.cif,True,,data/final/MP/graphs/As1Fe1Pr1O0.7-MP-mp-22491-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Fe1Se0.45Te0.55,2,0.05,2.0,False,Fe2Se0.9Te1.1,Fe2Se1Te1,12.6,Ferrite,True,Fe50Se22.5Te27.5,Fe-Se-Te,3,Supercon,Fe1Se0.45Te0.55,MP-mp-1225136,Fe2Te1Se1,Fe-Se-Te,Fe50Se25Te25,P 4 m m,tetragonal,3.755398,3.755398,5.937717,data/final/MP/cifs/Fe1Se0.45Te0.55-MP-mp-1225136-synth_doped.cif,data/source/MP/raw/cifs/mp-1225136.cif,mp-1225136,0.0,,2019-01-13 01:17:25.998000,6.310824077785493,,,{'GGA': {'task_id': 'mp-1764167'}},0.0802741556250001,4.86336573,520.0,-24.0729629,-6.018240725,{'tags': []},-24.0729629,-6.018240725,-0.3469333980859375,['bandstructure'],True,[],True,2021-05-12 10:58:45.495000,FM,4,5,mp-1225136,,Fe2TeSe,"{'functional': 'PBE', 'labels': ['Fe_pv', 'Te', 'Se'], 'pot_type': 'paw'}","{'Fe': 2.0, 'Te': 1.0, 'Se': 1.0}",GGA,mp-1225136,"['mp-1225136', 'mp-1425562', 'mp-1764167', 'mp-1784460', 'mp-1615275']",0.1061773,"{'Fe': 2.0, 'Te': 1.0, 'Se': 1.0}",83.73970680084179,[],FM,True,99,1,"[0.1, 0.1, -0.0, -0.0]",0.0012679444920021,0.1061773,2,0.1061773,MP,data/source/MP/cleaned/cifs/MP-mp-1225136.cif,True,,data/final/MP/graphs/Fe1Se0.45Te0.55-MP-mp-1225136-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
Cu1Ti1,1,0.0,2.0,False,Cu2Ti2,Cu2Ti2,0.0,Other,True,Cu50Ti50,Cu-Ti,2,Supercon,Cu1Ti1,MP-mp-2078,Ti2Cu2,Cu-Ti,Cu50Ti50,P 4/n m m,tetragonal,3.117007,3.117007,5.912762,data/final/MP/cifs/Cu1Ti1-MP-mp-2078.cif,data/source/MP/raw/cifs/mp-2078.cif,mp-2078,0.0,,2011-05-13 05:03:58,6.440936363493999,10.17188/1195970,"@misc{osti_1195970,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TiCu (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195970"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687828'}},0.0,6.43505275,520.0,-24.53261894,-6.133154735,{'tags': ['Copper titanium (1/1)']},-24.53261894,-6.133154735,-0.1358053916666666,"['xas', 'elasticity', 'bandstructure']",True,"[600100, 629389, 103128, 629381]",True,2021-05-12 10:56:14.760000,NM,4,8,mp-2078,,TiCu,"{'functional': 'PBE', 'labels': ['Ti_pv', 'Cu_pv'], 'pot_type': 'paw'}","{'Ti': 1.0, 'Cu': 1.0}",GGA,mp-2078,"['mp-928887', 'mp-912384', 'mp-928368', 'mp-2078', 'mp-1439203', 'mp-1687828', 'mp-1795287', 'mp-1594119']",0.00105815,"{'Ti': 2.0, 'Cu': 2.0}",57.44681474441589,[],NM,False,129,0,"[0, 0, 0, 0]",3.683929229872079e-05,0.00105815,0,0.0021163,MP,data/source/MP/cleaned/cifs/MP-mp-2078.cif,False,,data/final/MP/graphs/Cu1Ti1-MP-mp-2078.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Al0.85B2Mg0.15,3,0.1,1.0,True,Al0.85B2Mg0.15,Al1B2,0.0,Other,True,Al28.333B66.667Mg5,Al-B-Mg,3,Supercon,Mg0.15Al0.85B2,MP-mp-944,Al1B2,Al-B,Al33.333B66.667,P 6/m m m,hexagonal,3.006985999525396,3.00698577,3.274424,data/final/MP/cifs/Al0.85B2Mg0.15-MP-mp-944-synth_doped.cif,data/source/MP/raw/cifs/mp-944.cif,mp-944,0.0,,2011-05-12 17:07:42,3.14766621242468,10.17188/1272697,"@misc{osti_1272697,
    author = ""Persson, Kristin"",
    title = ""Materials Data on AlB2 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1272697"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686833'}},0.0101373945333325,10.17253385,520.0,-17.23332169,-5.744440563333334,"{'tags': ['Aluminum boride (1/2)', 'Aluminium boride (1/2)']}",-17.23332169,-5.744440563333334,-0.0429874394444442,"['xas', 'elasticity', 'bandstructure']",True,"[43851, 606058, 52282, 606057, 160898, 654653, 159334]",True,2021-05-12 10:56:35.166000,NM,3,10,mp-944,,AlB2,"{'functional': 'PBE', 'labels': ['Al', 'B'], 'pot_type': 'paw'}","{'Al': 1.0, 'B': 2.0}",GGA,mp-944,"['mp-1006922', 'mp-1000450', 'mp-944', 'mp-1263816', 'mp-1476220', 'mp-1686833', 'mp-1793262', 'mp-1011636', 'mp-1594295', 'mp-1587660']",1.7e-05,"{'Al': 1.0, 'B': 2.0}",25.640607730808537,[],NM,False,191,0,"[0, 0, 0]",6.630108060806066e-07,1.7e-05,0,1.7e-05,MP,data/source/MP/cleaned/cifs/MP-mp-944.cif,True,,data/final/MP/graphs/Al0.85B2Mg0.15-MP-mp-944-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
B2Er1Ru1,1,0.0,4.0,False,B8Er4Ru4,B8Er4Ru4,0.0,Other,True,B50Er25Ru25,B-Er-Ru,3,Supercon,Er1Ru1B2,MP-mp-1181423,Er4B8Ru4,B-Er-Ru,B50Er25Ru25,P n m a,orthorhombic,5.301262,5.892065,6.328586,data/final/MP/cifs/B2Er1Ru1-MP-mp-1181423.cif,data/source/MP/raw/cifs/mp-1181423.cif,mp-1181423,0.0,,2019-01-11 10:26:04.205000,9.742719874138306,,,{'GGA': {'task_id': 'mp-1672528'}},0.0,6.03250715,520.0,-118.99708611,-7.437317881875,"{'tags': ['Erbium ruthenium boride (1/1/2)', 'LuRuB2', 'ErRuB2']}",-118.99708611,-7.437317881875,-0.6370948802083332,['bandstructure'],True,[613819],True,2021-05-12 10:58:25.879000,NM,16,5,mp-1181423,,ErB2Ru,"{'functional': 'PBE', 'labels': ['Er_3', 'B', 'Ru_pv'], 'pot_type': 'paw'}","{'Er': 1.0, 'B': 2.0, 'Ru': 1.0}",GGA,mp-1181423,"['mp-1181423', 'mp-1429665', 'mp-1672528', 'mp-1789467', 'mp-1599012']",4.625e-05,"{'Er': 4.0, 'B': 8.0, 'Ru': 4.0}",197.67579038284543,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",9.358758583522252e-07,4.625e-05,0,0.000185,MP,data/source/MP/cleaned/cifs/MP-mp-1181423.cif,False,,data/final/MP/graphs/B2Er1Ru1-MP-mp-1181423.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Mo6Pb1Se8,1,0.0,1.0,True,Mo6Pb1Se8,Mo6Pb1Se8,3.77,Chevrel,True,Mo40Pb6.667Se53.333,Mo-Pb-Se,3,Supercon,Pb1Mo6Se8,MP-mp-22721,Mo6Pb1Se8,Mo-Pb-Se,Mo40Pb6.667Se53.333,R -3,trigonal,6.899290530000001,6.899290530000001,6.89929066,data/final/MP/cifs/Mo6Pb1Se8-MP-mp-22721.cif,data/source/MP/raw/cifs/mp-22721.cif,mp-22721,0.0,,2014-02-22 15:21:31,7.154597309388712,10.17188/1198925,"@misc{osti_1198925,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Mo6PbSe8 (SG:148) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198925"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699368'}},0.0408857626666643,4.99431959,520.0,-104.32887755,-6.955258503333334,"{'tags': ['Molydenum lead selenide (6/1/8)', 'Lead molybdenum(II/III) selenide (1/6/8)', 'Lead molybdenum selenide (1/6/8)', 'Lead molybdenum selenide (0.5/3/4)']}",-104.32887755,-6.955258503333334,-0.7567386985833328,"['xas', 'bandstructure']",True,"[644124, 603578, 644120, 644122, 644118, 68]",True,2021-05-12 10:56:59.077000,NM,15,12,mp-22721,,Mo6PbSe8,"{'functional': 'PBE', 'labels': ['Mo_pv', 'Pb_d', 'Se'], 'pot_type': 'paw'}","{'Mo': 6.0, 'Pb': 1.0, 'Se': 8.0}",GGA,mp-22721,"['mp-909170', 'mp-925012', 'mp-924202', 'mp-22721', 'mp-1103563', 'mp-1103882', 'mp-1104035', 'mp-1237387', 'mp-1422308', 'mp-1699368', 'mp-1808985', 'mp-1603460']",0.0003647,"{'Mo': 6.0, 'Pb': 1.0, 'Se': 8.0}",328.30159670967123,[],NM,False,148,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.1108687976394985e-06,0.0003647,0,0.0003647,MP,data/source/MP/cleaned/cifs/MP-mp-22721.cif,False,,data/final/MP/graphs/Mo6Pb1Se8-MP-mp-22721.json,0,True,-3,0,0,0,0,0,0,2,1,0,0,0,1.0,False
Au0.05Nb3Rh0.95,2,0.025,2.0,False,Au0.1Nb6Rh1.9,Nb6Rh2,2.52,Other,True,Au1.25Nb75Rh23.75,Au-Nb-Rh,3,Supercon,Nb3Rh0.95Au0.05,MP-mp-1545,Nb6Rh2,Nb-Rh,Nb75Rh25,P m -3 n,cubic,5.186072,5.186072,5.186072,data/final/MP/cifs/Au0.05Nb3Rh0.95-MP-mp-1545-synth_doped.cif,data/source/MP/raw/cifs/mp-1545.cif,mp-1545,0.0,,2011-05-14 11:20:25,9.086567873234834,10.17188/1191190,"@misc{osti_1191190,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Rh (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191190"",
    place = ""United States"",
    year = ""2015"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700041'}},0.0,5.48706495,520.0,-77.37430008,-9.67178751,{'tags': ['Niobium rhodium (3/1)']},-77.37430008,-9.67178751,-0.2547317625000005,"['xas', 'elasticity', 'bandstructure']",True,"[105216, 645269]",True,2021-05-12 10:56:12.755000,NM,8,8,mp-1545,,Nb3Rh,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Rh_pv'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Rh': 1.0}",GGA,mp-1545,"['mp-942004', 'mp-943019', 'mp-935201', 'mp-1545', 'mp-1433570', 'mp-1700041', 'mp-1786474', 'mp-1591392']",0.00021655,"{'Nb': 6.0, 'Rh': 2.0}",139.48118416938905,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",3.1050783127424102e-06,0.00021655,0,0.0004331,MP,data/source/MP/cleaned/cifs/MP-mp-1545.cif,True,,data/final/MP/graphs/Au0.05Nb3Rh0.95-MP-mp-1545-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Al3Pd2Th0.02U0.98,2,0.0066666666666666,1.0,True,Al3Pd2Th0.02U0.98,Al3Pd2U1,1.97,Heavy_fermion,True,Al50Pd33.333Th0.333U16.333,Al-Pd-Th-U,4,Supercon,U0.98Th0.02Pd2Al3,MP-mp-4561,U1Al3Pd2,Al-Pd-U,Al50Pd33.333U16.667,P 6/m m m,hexagonal,4.239652,5.384229999094356,5.3842309,data/final/MP/cifs/Al3Pd2Th0.02U0.98-MP-mp-4561-synth_doped.cif,data/source/MP/raw/cifs/mp-4561.cif,mp-4561,0.0,,2011-05-12 23:59:10,8.296603403902926,10.17188/1208253,"@misc{osti_1208253,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UAl3Pd2 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208253"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700804'}},0.0796314472916668,8.0468212,520.0,-36.36476907,-6.060794845,"{'tags': ['Aluminium palladium uranium (3/2/1)', 'Aluminum palladium uranium (3/2/1)']}",-36.36476907,-6.060794845,-0.5794779916666665,"['xas', 'elasticity', 'bandstructure']",True,"[657574, 106242, 659234]",True,2021-05-12 10:56:20.740000,FM,6,9,mp-4561,,UAl3Pd2,"{'functional': 'PBE', 'labels': ['U', 'Al', 'Pd'], 'pot_type': 'paw'}","{'U': 1.0, 'Al': 3.0, 'Pd': 2.0}",GGA,mp-4561,"['mp-4561', 'mp-991619', 'mp-993538', 'mp-1251974', 'mp-1441898', 'mp-1700804', 'mp-1933710', 'mp-994863', 'mp-1593816']",2.2050571,"{'U': 1.0, 'Al': 3.0, 'Pd': 2.0}",106.4408038742404,[],FM,True,191,1,"[2.2, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0207162762750765,2.2050571,1,2.2050571,MP,data/source/MP/cleaned/cifs/MP-mp-4561.cif,True,,data/final/MP/graphs/Al3Pd2Th0.02U0.98-MP-mp-4561-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Al1C1La3,1,0.0,1.0,True,Al1C1La3,Al1C1La3,0.0,Other,True,Al20C20La60,Al-C-La,3,Supercon,Al1C1La3,MP-mp-10600,La3Al1C1,Al-C-La,Al20C20La60,P m -3 m,cubic,5.205131,5.205131,5.205131,data/final/MP/cifs/Al1C1La3-MP-mp-10600.cif,data/source/MP/raw/cifs/mp-10600.cif,mp-10600,0.0,,2011-05-27 23:49:23,5.365885189191126,10.17188/1187218,"@misc{osti_1187218,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La3AlC (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187218"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695609'}},0.0345301714999992,6.89224957,520.0,-28.70870962,-5.741741924,{'tags': ['Lanthanum aluminium carbide (3/1/1)']},-28.70870962,-5.741741924,-0.1856663550000007,"['xas', 'elasticity', 'bandstructure']",True,"[56395, 185958]",True,2021-05-12 10:56:10.715000,NM,5,14,mp-10600,,La3AlC,"{'functional': 'PBE', 'labels': ['La', 'Al', 'C'], 'pot_type': 'paw'}","{'La': 3.0, 'Al': 1.0, 'C': 1.0}",GGA,mp-10600,"['mp-927111', 'mp-10600', 'mp-1070241', 'mp-1070266', 'mp-1070222', 'mp-910976', 'mp-926591', 'mp-1253021', 'mp-1254973', 'mp-1433237', 'mp-1695609', 'mp-1934791', 'mp-1587486', 'mp-1070274']",0.0001904,"{'La': 3.0, 'Al': 1.0, 'C': 1.0}",141.02463755879623,[],NM,False,221,0,"[0, 0, 0, 0, 0]",1.3501186976681156e-06,0.0001904,0,0.0001904,MP,data/source/MP/cleaned/cifs/MP-mp-10600.cif,False,,data/final/MP/graphs/Al1C1La3-MP-mp-10600.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
B4Gd0.3Rh4Y0.7,3,0.0666666666666666,2.0,False,B8Gd0.6Rh8Y1.4,B8Rh8Y2,3.54,Other,True,B44.444Gd3.333Rh44.444Y7.778,B-Gd-Rh-Y,4,Supercon,Y0.7Gd0.3Rh4B4,MP-mp-5984,Y2B8Rh8,B-Rh-Y,B44.444Rh44.444Y11.111,P 42/n m c,tetragonal,5.347098,5.347098,7.470892,data/final/MP/cifs/B4Gd0.3Rh4Y0.7-MP-mp-5984-synth_doped.cif,data/source/MP/raw/cifs/mp-5984.cif,mp-5984,0.0,,2011-05-17 01:51:06,8.454483259902709,10.17188/1277215,"@misc{osti_1277215,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Y(BRh)4 (SG:137) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277215"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1705290'}},0.0126497084259256,6.88552514,520.0,-135.64692549,-7.535940305,"{'tags': ['Yttrium rhodium boride (1/4/4)', 'Rhodium yttrium boride (4/1/4)']}",-135.64692549,-7.535940305,-0.5757992298148148,"['xas', 'bandstructure']",True,"[44569, 615346, 602655, 87283]",True,2021-05-12 10:57:26.891000,NM,18,8,mp-5984,,Y(BRh)4,"{'functional': 'PBE', 'labels': ['Y_sv', 'B', 'Rh_pv'], 'pot_type': 'paw'}","{'Y': 1.0, 'B': 4.0, 'Rh': 4.0}",GGA,mp-5984,"['mp-910312', 'mp-5984', 'mp-926161', 'mp-925748', 'mp-1430442', 'mp-1705290', 'mp-1828135', 'mp-1604702']",0.00010715,"{'Y': 2.0, 'B': 8.0, 'Rh': 8.0}",213.60368753104515,[],NM,False,137,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.0032598335590702e-06,0.00010715,0,0.0002143,MP,data/source/MP/cleaned/cifs/MP-mp-5984.cif,True,,data/final/MP/graphs/B4Gd0.3Rh4Y0.7-MP-mp-5984-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Nb1Se3,1,0.0,6.0,False,Nb6Se18,Nb6Se18,3.736666667,Other,True,Nb25Se75,Nb-Se,2,Supercon,Nb1Se3,MP-mp-525,Nb6Se18,Nb-Se,Nb25Se75,P 1 21/m 1,monoclinic,3.515248,10.749463,15.84325968,data/final/MP/cifs/Nb1Se3-MP-mp-525.cif,data/source/MP/raw/cifs/mp-525.cif,mp-525,0.0,,2011-05-18 02:02:39,5.792603652034711,10.17188/1263164,"@misc{osti_1263164,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbSe3 (SG:11) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1263164"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1733872'}},0.0008183070416674,4.05733088,520.0,-139.35595604,-5.806498168333333,{'tags': ['Niobium selenide (1/3)']},-139.35595604,-5.806498168333333,-1.013238300091146,"['xas', 'bandstructure']",True,"[645384, 76579, 600618, 30002]",True,2021-05-12 10:57:10.838000,NM,24,11,mp-525,,NbSe3,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Se'], 'pot_type': 'paw'}","{'Nb': 1.0, 'Se': 3.0}",GGA,mp-525,"['mp-920694', 'mp-921672', 'mp-907172', 'mp-525', 'mp-567635', 'mp-1190665', 'mp-1192014', 'mp-1413575', 'mp-1733872', 'mp-1937022', 'mp-1611953']",0.0003749833333333,"{'Nb': 6.0, 'Se': 18.0}",567.2300753015284,[],NM,False,11,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.966468101685189e-06,0.0003749833333333,0,0.0022499,MP,data/source/MP/cleaned/cifs/MP-mp-525.cif,False,,data/final/MP/graphs/Nb1Se3-MP-mp-525.json,0,True,2/m,0,0,3,0,0,0,0,1,0,0,0,1.0,False
As1Fe1Gd1O1,1,0.0,2.0,False,As2Fe2Gd2O2,As2Fe2Gd2O2,0.0,Ferrite,True,As25Fe25Gd25O25,As-Fe-Gd-O,4,Supercon,Gd1Fe1As1O1,MP-mp-1078679,Gd2Fe2As2O2,As-Fe-Gd-O,As25Fe25Gd25O25,P 4/n m m,tetragonal,3.996524,3.996524,9.110606,data/final/MP/cifs/As1Fe1Gd1O1-MP-mp-1078679.cif,data/source/MP/raw/cifs/mp-1078679.cif,mp-1078679,0.0,,2018-04-12 14:54:44,6.938465251324023,,,{'GGA+U': {'task_id': 'mp-1704492'}},0.2756975050000001,4.06882668,520.0,-71.78498399,-8.97312299875,{'tags': ['Gadolinium iron arsenic oxide (1/1/1/1)']},-71.78498399,-8.97312299875,-1.670570473750001,['bandstructure'],True,"[425013, 422003, 425006, 425015, 425010, 236655, 425016]",True,2021-05-12 10:58:16.596000,FM,8,10,mp-1078679,oxide,GdFeAsO,"{'functional': 'PBE', 'labels': ['Gd', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Gd': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-1078679,"['mp-1078679', 'mp-1079389', 'mp-1079927', 'mp-1080502', 'mp-1080613', 'mp-1095209', 'mp-1438268', 'mp-1704492', 'mp-1864230', 'mp-1589235']",10.7990939,"{'Gd': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",145.5164583479414,[],FM,True,129,2,"[6.9, 6.9, 3.6, 3.6, 0.0, 0.0, 0.0, 0.0]",0.1484243641248952,10.7990939,4,21.5981878,MP,data/source/MP/cleaned/cifs/MP-mp-1078679.cif,False,,data/final/MP/graphs/As1Fe1Gd1O1-MP-mp-1078679.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Co21Zr79,3,0.08,0.0759508740204942,False,Co1.595Zr6,Co2Zr6,3.78,Other,True,Co21Zr79,Co-Zr,2,Supercon,Co21Zr79,MP-mp-30619,Zr6Co2,Co-Zr,Co25Zr75,C m c m,orthorhombic,3.2678779986361945,5.64053185,9.054345,data/final/MP/cifs/Co21Zr79-MP-mp-30619-synth_doped.cif,data/source/MP/raw/cifs/mp-30619.cif,mp-30619,0.0,,2014-02-24 05:11:15,6.915075692701918,10.17188/1205004,"@misc{osti_1205004,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Zr3Co (SG:63) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1205004"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671884'}},0.0,4.34528317,520.0,-67.1885383,-8.3985672875,"{'tags': ['Zirconium cobalt (3/1)', 'Cobalt zirconium (1/3)']}",-67.1885383,-8.3985672875,-0.2107123662500019,"['xas', 'elasticity', 'bandstructure']",True,"[625702, 625685, 102741]",True,2021-05-12 10:56:18.721000,NM,8,8,mp-30619,,Zr3Co,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Co'], 'pot_type': 'paw'}","{'Zr': 3.0, 'Co': 1.0}",GGA,mp-30619,"['mp-941299', 'mp-941614', 'mp-934852', 'mp-30619', 'mp-1300083', 'mp-1671884', 'mp-1787222', 'mp-1592089']",8.395e-05,"{'Zr': 6.0, 'Co': 2.0}",159.73908156479197,[],NM,False,63,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.0510890531938977e-06,8.395e-05,0,0.0001679,MP,data/source/MP/cleaned/cifs/MP-mp-30619.cif,True,,data/final/MP/graphs/Co21Zr79-MP-mp-30619-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
La1Zn1,1,0.0,1.0,True,La1Zn1,La1Zn1,1.04,Other,True,La50Zn50,La-Zn,2,Supercon,La1Zn1,MP-mp-2615,La1Zn1,La-Zn,La50Zn50,P m -3 m,cubic,3.76,3.76,3.76,data/final/MP/cifs/La1Zn1-MP-mp-2615.cif,data/source/MP/raw/cifs/mp-2615.cif,mp-2615,0.0,,2011-05-12 19:20:21,6.382409833522892,10.17188/1201112,"@misc{osti_1201112,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaZn (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201112"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668119'}},0.0,6.19070235,520.0,-6.82731556,-3.41365778,{'tags': ['Lanthanum zinc (1/1)']},-6.82731556,-3.41365778,-0.3157824224999999,"['xas', 'bandstructure']",True,"[190978, 642084, 104735, 642094]",True,2021-05-12 10:57:01.079000,NM,2,10,mp-2615,,LaZn,"{'functional': 'PBE', 'labels': ['La', 'Zn'], 'pot_type': 'paw'}","{'La': 1.0, 'Zn': 1.0}",GGA,mp-2615,"['mp-991588', 'mp-2615', 'mp-1058550', 'mp-1058561', 'mp-1058591', 'mp-1440133', 'mp-1668119', 'mp-1791138', 'mp-1593290', 'mp-1058585']",0.0283017,"{'La': 1.0, 'Zn': 1.0}",53.15737599999999,[],NM,False,221,0,"[0, 0]",0.0005324134133332,0.0283017,0,0.0283017,MP,data/source/MP/cleaned/cifs/MP-mp-2615.cif,False,,data/final/MP/graphs/La1Zn1-MP-mp-2615.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
C1Hf0.1Mo0.9,3,0.0999999999999999,1.0,True,C1Hf0.1Mo0.9,C1Mo1,11.9,Other,True,C50Hf5Mo45,C-Hf-Mo,3,Supercon,Mo0.9Hf0.1C1,MP-mp-2305,Mo1C1,C-Mo,C50Mo50,P -6 m 2,hexagonal,2.835086,2.92410600478411,2.92410507,data/final/MP/cifs/C1Hf0.1Mo0.9-MP-mp-2305-synth_doped.cif,data/source/MP/raw/cifs/mp-2305.cif,mp-2305,0.0,,2011-05-12 17:49:42,8.538697979393088,10.17188/1199194,"@misc{osti_1199194,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MoC (SG:187) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199194"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668222'}},0.0010243049999996,8.62658168,520.0,-20.24014809,-10.120074045,{'tags': ['Molybdenum carbide (1/1)']},-20.24014809,-10.120074045,-0.0838621800000005,"['xas', 'elasticity', 'bandstructure']",True,"[77156, 618300]",True,2021-05-12 10:56:16.728000,NM,2,9,mp-2305,,MoC,"{'functional': 'PBE', 'labels': ['Mo_pv', 'C'], 'pot_type': 'paw'}","{'Mo': 1.0, 'C': 1.0}",GGA,mp-2305,"['mp-927633', 'mp-927239', 'mp-911174', 'mp-2305', 'mp-1116092', 'mp-1440368', 'mp-1668222', 'mp-1791400', 'mp-1638434']",0.0001977,"{'Mo': 1.0, 'C': 1.0}",20.99340614335182,[],NM,False,187,0,"[0, 0]",9.417242664197564e-06,0.0001977,0,0.0001977,MP,data/source/MP/cleaned/cifs/MP-mp-2305.cif,True,,data/final/MP/graphs/C1Hf0.1Mo0.9-MP-mp-2305-synth_doped.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Cu1La1.763Sr0.237O4,3,0.0677142857142857,1.0,True,Cu1La1.763Sr0.237O4,Cu1La2O4,13.0,Cuprate,True,Cu14.286La25.186Sr3.386O57.142857142857146,Cu-La-Sr-O,4,Supercon,La1.763Sr0.237Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La1.763Sr0.237O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La1.763Sr0.237O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ru0.9Sr2Ti0.1O4,2,0.0285714285714285,1.0,True,Ru0.9Sr2Ti0.1O4,Ru1Sr2O4,0.0,Oxide,True,Ru12.857Sr28.571Ti1.429O57.142857142857146,Ru-Sr-Ti-O,4,Supercon,Sr2Ru0.9Ti0.1O4,MP-mp-4596,Sr2Ru1O4,Ru-Sr-O,Ru14.286Sr28.571O57.142857142857146,I 4/m m m,tetragonal,3.90349200031108,3.90349200031108,7.01667232,data/final/MP/cifs/Ru0.9Sr2Ti0.1O4-MP-mp-4596-synth_doped.cif,data/source/MP/raw/cifs/mp-4596.cif,mp-4596,0.0,,2011-05-13 08:08:22,5.748954439320184,10.17188/1208277,"@misc{osti_1208277,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr2RuO4 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208277"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668168'}},0.0,4.0615071,520.0,-47.01379905,-6.716257007142858,"{'tags': ['Distrontium ruthenium(IV) oxide', 'Distrontium ruthenate(IV)']}",-47.01379905,-6.716257007142858,-2.473796924047619,"['xas', 'bandstructure']",True,"[84484, 94191, 41609, 41610, 78630, 78285, 94194, 78631, 94193, 41607, 33802, 78629, 94184, 75151, 82898, 41604, 94200, 78286, 157401, 94189, 83110, 75152, 94188, 94197, 94199, 94185, 188554, 83109, 94198, 90737, 94192, 94195, 83111, 41606, 94186, 41608, 41605, 73395, 94187, 94196, 73394, 94190]",True,2021-05-12 10:57:08.928000,FM,7,10,mp-4596,oxide,Sr2RuO4,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ru_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ru': 1.0, 'O': 4.0}",GGA,mp-4596,"['mp-921970', 'mp-922219', 'mp-907609', 'mp-4596', 'mp-1078075', 'mp-1440912', 'mp-1668168', 'mp-1797475', 'mp-1594347', 'mp-1595037']",1.6420578,"{'Sr': 2.0, 'Ru': 1.0, 'O': 4.0}",98.29510225301225,[],FM,True,139,1,"[0.0, 0.0, 1.1, 0.0, 0.0, 0.0, 0.0]",0.0167053877798848,1.6420578,1,1.6420578,MP,data/source/MP/cleaned/cifs/MP-mp-4596.cif,True,,data/final/MP/graphs/Ru0.9Sr2Ti0.1O4-MP-mp-4596-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Hf0.87V2Zr0.13,3,0.0866666666666666,2.0,False,Hf1.74V4Zr0.26,Hf2V4,9.76,Other,True,Hf29V66.667Zr4.333,Hf-V-Zr,3,Supercon,Zr0.13Hf0.87V2,MP-mp-1077017,Hf2V4,Hf-V,Hf33.333V66.667,I 41/a m d,tetragonal,5.147745850539648,5.14774585,5.14774585,data/final/MP/cifs/Hf0.87V2Zr0.13-MP-mp-1077017-synth_doped.cif,data/source/MP/raw/cifs/mp-1077017.cif,mp-1077017,0.0,,2018-04-07 18:44:03,9.47163160017764,,,{'GGA': {'task_id': 'mp-1759109'}},0.0337706083333326,5.06389256,520.0,-56.04737833,-9.341229721666666,{'tags': ['Hafnium vanadium (1/2)']},-56.04737833,-9.341229721666666,0.033770608333332,['bandstructure'],True,[187951],True,2021-05-12 10:58:14.654000,NM,6,5,mp-1077017,,HfV2,"{'functional': 'PBE', 'labels': ['Hf_pv', 'V_pv'], 'pot_type': 'paw'}","{'Hf': 1.0, 'V': 2.0}",GGA,mp-1077017,"['mp-1077017', 'mp-1391381', 'mp-1759109', 'mp-1796366', 'mp-1627385']",0.03458425,"{'Hf': 2.0, 'V': 4.0}",98.30836742237948,[],NM,False,141,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0007035871087434,0.03458425,0,0.0691685,MP,data/source/MP/cleaned/cifs/MP-mp-1077017.cif,True,,data/final/MP/graphs/Hf0.87V2Zr0.13-MP-mp-1077017-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As3Sn4,1,0.0,1.0,True,As3Sn4,As3Sn4,1.195,Other,True,As42.857Sn57.143,As-Sn,2,Supercon,As3Sn4,MP-mp-12531,Sn4As3,As-Sn,As42.857Sn57.143,R -3 m,trigonal,4.15803582909218,4.15803582909218,12.44076874,data/final/MP/cifs/As3Sn4-MP-mp-12531.cif,data/source/MP/raw/cifs/mp-12531.cif,mp-12531,0.0,,2011-05-29 06:16:31,6.356054250269224,10.17188/1188962,"@misc{osti_1188962,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sn4As3 (SG:166) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188962"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702600'}},0.0,6.10936649,520.0,-30.64919183,-4.378455975714286,"{'tags': ['Arsenic tin (3/4)', 'Tin arsenide (4/3)']}",-30.64919183,-4.378455975714286,-0.0905070278571429,"['xas', 'bandstructure']",True,"[419884, 15735, 611426]",True,2021-05-12 10:56:53.126000,NM,7,8,mp-12531,,Sn4As3,"{'functional': 'PBE', 'labels': ['Sn_d', 'As'], 'pot_type': 'paw'}","{'Sn': 4.0, 'As': 3.0}",GGA,mp-12531,"['mp-1007153', 'mp-1000698', 'mp-12531', 'mp-1420996', 'mp-1702600', 'mp-1830707', 'mp-1011900', 'mp-1596102']",0.0008316,"{'Sn': 4.0, 'As': 3.0}",182.7739436823832,[],NM,False,166,0,"[0, 0, 0, 0, 0, 0, 0]",4.549882676083848e-06,0.0008316,0,0.0008316,MP,data/source/MP/cleaned/cifs/MP-mp-12531.cif,False,,data/final/MP/graphs/As3Sn4-MP-mp-12531.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Bi1Hf0.2La0.8S2O1,3,0.0799999999999999,2.0,False,Bi2Hf0.4La1.6S4O2,Bi2La2S4O2,2.36,Oxide,True,Bi20Hf4La16S40O20,Bi-Hf-La-S-O,5,Supercon,La0.8Hf0.2Bi1S2O1,MP-mp-1078397,La2Bi2S4O2,Bi-La-S-O,Bi20La20S40O20,P 4/n m m,tetragonal,4.055497,4.055497,14.173265,data/final/MP/cifs/Bi1Hf0.2La0.8S2O1-MP-mp-1078397-synth_doped.cif,data/source/MP/raw/cifs/mp-1078397.cif,mp-1078397,1.0743999999999998,,2018-04-11 10:57:38,6.097899749460756,,,{'GGA': {'task_id': 'mp-1676377'}},0.0053330699999989,4.69184382,520.0,-61.66700475,-6.166700475,{'tags': ['Lanthanum bismuth oxodisulphate']},-61.66700475,-6.166700475,-2.09592004425,['bandstructure'],True,[196231],True,2021-05-12 10:58:14.654000,NM,10,5,mp-1078397,oxide,LaBiS2O,"{'functional': 'PBE', 'labels': ['La', 'Bi', 'S', 'O'], 'pot_type': 'paw'}","{'La': 1.0, 'Bi': 1.0, 'S': 2.0, 'O': 1.0}",GGA,mp-1078397,"['mp-1078397', 'mp-1380859', 'mp-1676377', 'mp-1776923', 'mp-1600973']",6.57e-05,"{'La': 2.0, 'Bi': 2.0, 'S': 4.0, 'O': 2.0}",233.1084819815865,[],NM,False,129,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.636860524465146e-07,6.57e-05,0,0.0001314,MP,data/source/MP/cleaned/cifs/MP-mp-1078397.cif,True,,data/final/MP/graphs/Bi1Hf0.2La0.8S2O1-MP-mp-1078397-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
K1Nb0.21Ta0.79O3,3,0.0839999999999999,1.0,True,K1Nb0.21Ta0.79O3,K1Ta1O3,0.0,Oxide,True,K20Nb4.2Ta15.8O60,K-Nb-Ta-O,4,Supercon,K1Ta0.79Nb0.21O3,MP-mp-3614,K1Ta1O3,K-Ta-O,K20Ta20O60,P m -3 m,cubic,4.030839,4.030839,4.030839,data/final/MP/cifs/K1Nb0.21Ta0.79O3-MP-mp-3614-synth_doped.cif,data/source/MP/raw/cifs/mp-3614.cif,mp-3614,2.1532,,2011-05-12 22:13:37,6.796251592212529,10.17188/1207137,"@misc{osti_1207137,
    author = ""Persson, Kristin"",
    title = ""Materials Data on KTaO3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207137"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686512'}},0.0,1.55797225,520.0,-41.13911957,-8.227823914,{'tags': ['Potassium tantalate']},-41.13911957,-8.227823914,-3.0776119956000003,"['xas', 'bandstructure', 'diel', 'phonons', 'elasticity']",True,"[39673, 184922, 56439, 181838, 56440, 39905, 280424]",True,2021-05-12 10:56:20.740000,NM,5,17,mp-3614,oxide,KTaO3,"{'functional': 'PBE', 'labels': ['K_sv', 'Ta_pv', 'O'], 'pot_type': 'paw'}","{'K': 1.0, 'Ta': 1.0, 'O': 3.0}",GGA,mp-3614,"['mp-664976', 'mp-669248', 'mp-3614', 'mp-1068712', 'mp-1068716', 'mp-1068728', 'mp-1076849', 'mp-1076850', 'mp-1076851', 'mp-1140169', 'mp-1440109', 'mp-1686512', 'mp-1782459', 'mp-1597006', 'mp-1068733', 'mp-1076852', 'mp-691387']",8.85e-05,"{'K': 1.0, 'Ta': 1.0, 'O': 3.0}",65.49171385629549,[],NM,False,221,0,"[0, 0, 0, 0, 0]",1.351315987762821e-06,8.85e-05,0,8.85e-05,MP,data/source/MP/cleaned/cifs/MP-mp-3614.cif,True,,data/final/MP/graphs/K1Nb0.21Ta0.79O3-MP-mp-3614-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
C1Mo2,1,0.0,4.0,False,C4Mo8,C4Mo8,6.021666667,Other,True,C33.333Mo66.667,C-Mo,2,Supercon,C1Mo2,MP-mp-1552,Mo8C4,C-Mo,C33.333Mo66.667,P b c n,orthorhombic,4.754105,5.241481,6.076485,data/final/MP/cifs/C1Mo2-MP-mp-1552.cif,data/source/MP/raw/cifs/mp-1552.cif,mp-1552,0.0,,2011-05-14 21:55:32,8.943989697207083,10.17188/1191211,"@misc{osti_1191211,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Mo2C (SG:60) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191211"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702638'}},0.0,8.69218846,520.0,-125.0304508,-10.419204233333334,"{'tags': ['Molybdenum carbide (2/1) - zeta', 'Molybdenum carbide (2/1) - alpha', 'Molybdenum carbide (2/1)']}",-125.0304508,-10.419204233333334,-0.113181979999999,"['xas', 'elasticity', 'bandstructure']",True,"[43322, 600624, 246147, 65701, 246148, 246146]",True,2021-05-12 10:56:12.755000,NM,12,8,mp-1552,,Mo2C,"{'functional': 'PBE', 'labels': ['Mo_pv', 'C'], 'pot_type': 'paw'}","{'Mo': 2.0, 'C': 1.0}",GGA,mp-1552,"['mp-906641', 'mp-920312', 'mp-921336', 'mp-1552', 'mp-1504087', 'mp-1702638', 'mp-1779813', 'mp-1589885']",0.000982725,"{'Mo': 8.0, 'C': 4.0}",151.41720155252168,[],NM,False,60,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.596072282207976e-05,0.000982725,0,0.0039309,MP,data/source/MP/cleaned/cifs/MP-mp-1552.cif,False,,data/final/MP/graphs/C1Mo2-MP-mp-1552.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ba2Cu2La0.1Nb1Pr0.9O8,2,0.0142857142857142,2.0,False,Ba4Cu4La0.2Nb2Pr1.8O16,Ba4Cu4Nb2Pr2O16,0.0,Cuprate,True,Ba14.286Cu14.286La0.714Nb7.143Pr6.429O57.142857142857146,Ba-Cu-La-Nb-Pr-O,6,Supercon,La0.1Pr0.9Ba2Cu2Nb1O8,MP-mp-1228503,Ba4Pr2Nb2Cu4O16,Ba-Cu-Nb-Pr-O,Ba14.286Cu14.286Nb7.143Pr7.143O57.142857142857146,I 4/m c m,tetragonal,5.6523240008018885,5.6523240008018885,12.891359700000002,data/final/MP/cifs/Ba2Cu2La0.1Nb1Pr0.9O8-MP-mp-1228503-synth_doped.cif,data/source/MP/raw/cifs/mp-1228503.cif,mp-1228503,0.0,,2019-01-13 04:12:27.910000,6.476077285414362,,,{'GGA': {'task_id': 'mp-1681109'}},0.0,3.15488536,520.0,-197.21763621,-7.0434870075,{'tags': []},-197.21763621,-7.0434870075,-2.68589792,[],False,[],True,2021-05-12 11:00:59.151000,NM,28,4,mp-1228503,oxide,Ba2PrNb(CuO4)2,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Pr_3', 'Nb_pv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Pr': 1.0, 'Nb': 1.0, 'Cu': 2.0, 'O': 8.0}",GGA,mp-1228503,"['mp-1228503', 'mp-1347285', 'mp-1681109', 'mp-1839661']",0.4602329,"{'Ba': 4.0, 'Pr': 2.0, 'Nb': 2.0, 'Cu': 4.0, 'O': 16.0}",391.5683006987532,[],NM,False,140,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0023507158223927,0.4602329,0,0.9204658,MP,data/source/MP/cleaned/cifs/MP-mp-1228503.cif,True,,data/final/MP/graphs/Ba2Cu2La0.1Nb1Pr0.9O8-MP-mp-1228503-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ce0.916Co1In5Yb0.084,2,0.0239999999999999,1.0,True,Ce0.916Co1In5Yb0.084,Ce1Co1In5,1.84,Heavy_fermion,True,Ce13.086Co14.286In71.429Yb1.2,Ce-Co-In-Yb,4,Supercon,Ce0.916Yb0.084Co1In5,MP-mp-19961,Ce1In5Co1,Ce-Co-In,Ce14.286Co14.286In71.429,P 4/m m m,tetragonal,4.635989,4.635989,7.564124,data/final/MP/cifs/Ce0.916Co1In5Yb0.084-MP-mp-19961-synth_doped.cif,data/source/MP/raw/cifs/mp-19961.cif,mp-19961,0.0,,2014-02-21 14:08:25,7.897022127398995,10.17188/1195145,"@misc{osti_1195145,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeIn5Co (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195145"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701944'}},0.0,7.80626318,520.0,-28.52795357,-4.075421938571429,{'tags': ['Cerium cobalt indium (1/1/5)']},-28.52795357,-4.075421938571429,-0.2468754242857146,"['xas', 'bandstructure']",True,[102108],True,2021-05-12 10:56:57.051000,FM,7,8,mp-19961,,CeIn5Co,"{'functional': 'PBE', 'labels': ['Ce', 'In_d', 'Co'], 'pot_type': 'paw'}","{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",GGA,mp-19961,"['mp-928775', 'mp-912209', 'mp-928270', 'mp-19961', 'mp-1504062', 'mp-1701944', 'mp-1785253', 'mp-1593180']",0.9310323,"{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",162.57113333428427,[],FM,True,123,1,"[0.7, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0057269226147644,0.9310323,1,0.9310323,MP,data/source/MP/cleaned/cifs/MP-mp-19961.cif,True,,data/final/MP/graphs/Ce0.916Co1In5Yb0.084-MP-mp-19961-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ce0.54La0.46Ru2,2,0.0266666666666666,2.0,False,Ce1.08La0.92Ru4,Ce1La1Ru4,0.668,Heavy_fermion,True,Ce18La15.333Ru66.667,Ce-La-Ru,3,Supercon,La0.46Ce0.54Ru2,MP-mp-1222913,La1Ce1Ru4,Ce-La-Ru,Ce16.667La16.667Ru66.667,F -4 3 m,cubic,5.407204540000001,5.40720454,5.40720454,data/final/MP/cifs/Ce0.54La0.46Ru2-MP-mp-1222913-synth_doped.cif,data/source/MP/raw/cifs/mp-1222913.cif,mp-1222913,0.0,,2019-01-12 23:22:50.626000,10.149813335401207,,,{'GGA': {'task_id': 'mp-1717130'}},0.0,8.64426336,520.0,-49.23252279,-8.205420465,{'tags': []},-49.23252279,-8.205420465,-0.2109779849999995,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,6,5,mp-1222913,,LaCeRu4,"{'functional': 'PBE', 'labels': ['La', 'Ce', 'Ru_pv'], 'pot_type': 'paw'}","{'La': 1.0, 'Ce': 1.0, 'Ru': 4.0}",GGA,mp-1222913,"['mp-1222913', 'mp-1394759', 'mp-1717130', 'mp-1804881', 'mp-1626317']",0.0208777,"{'La': 1.0, 'Ce': 1.0, 'Ru': 4.0}",111.79011354255184,[],NM,False,216,0,"[0.0, -0.0, 0.0, 0.0, 0.0, 0.0]",0.0001867580176672,0.0208777,0,0.0208777,MP,data/source/MP/cleaned/cifs/MP-mp-1222913.cif,True,,data/final/MP/graphs/Ce0.54La0.46Ru2-MP-mp-1222913-synth_doped.json,0,True,-43m,5,0,0,0,0,0,0,0,0,0,1,1.0,False
Li7Mo15Se19,3,0.1254355400696864,0.2857281537176274,False,Li2Mo4.286Se5.429,Li2Mo6Se6,0.0,Chevrel,True,Li17.073Mo36.585Se46.341,Li-Mo-Se,3,Supercon,Li7Mo15Se19,MP-mp-1103933,Li2Mo6Se6,Li-Mo-Se,Li14.286Mo42.857Se42.857,P 63/m,hexagonal,4.526413,8.98532199778543,8.9853219,data/final/MP/cifs/Li7Mo15Se19-MP-mp-1103933-synth_doped.cif,data/source/MP/raw/cifs/mp-1103933.cif,mp-1103933,0.0,,2018-07-18 20:23:13,5.578860040030151,,,,0.0451131363265293,4.42336657,520.0,-98.0858302,-7.006130728571429,"{'tags': ['Lithium molybdenum selenide (1/3/3)', 'LiMo3Se3', 'TlFe3Te3', 'Chevrel phase']}",-98.0858302,-7.006130728571429,-0.7893326729092262,[],False,[604519],True,2021-05-12 10:59:31.014000,NM,14,3,mp-1103933,,Li(MoSe)3,"{'functional': 'PBE', 'labels': ['Li_sv', 'Mo_pv', 'Se'], 'pot_type': 'paw'}","{'Li': 1.0, 'Mo': 3.0, 'Se': 3.0}",GGA,mp-1103933,"['mp-1103933', 'mp-1393482', 'mp-1809271']",0.00022795,"{'Li': 2.0, 'Mo': 6.0, 'Se': 6.0}",316.4842435808873,[],NM,False,176,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.4405140516370783e-06,0.00022795,0,0.0004559,MP,data/source/MP/cleaned/cifs/MP-mp-1103933.cif,True,,data/final/MP/graphs/Li7Mo15Se19-MP-mp-1103933-synth_doped.json,0,True,6/m,0,3,0,0,0,0,0,1,0,0,0,1.0,False
Ce0.22Cu1Nd1.78O4,3,0.0628571428571428,1.0,True,Ce0.22Cu1Nd1.78O4,Cu1Nd2O4,0.0,Cuprate,True,Ce3.143Cu14.286Nd25.429O57.142857142857146,Ce-Cu-Nd-O,4,Supercon,Nd1.78Ce0.22Cu1O4,MP-mp-4158,Nd2Cu1O4,Cu-Nd-O,Cu14.286Nd28.571O57.142857142857146,I 4/m m m,tetragonal,3.973854000245551,3.973854000245551,6.78296857,data/final/MP/cifs/Ce0.22Cu1Nd1.78O4-MP-mp-4158-synth_doped.cif,data/source/MP/raw/cifs/mp-4158.cif,mp-4158,0.0,,2011-05-13 10:19:33,7.086167303782593,10.17188/1207899,"@misc{osti_1207899,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nd2CuO4 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207899"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-670050'}},0.0009497997619085,3.16510927,520.0,-51.48091453,-7.354416361428571,"{'tags': ['Dineodymium copper tetraoxide', 'Dineodymium copper oxide', 'Dineodymium cuprate', 'High pressure experimental phase']}",-51.48091453,-7.354416361428571,-2.971653917142857,"['xas', 'elasticity', 'bandstructure']",True,"[261376, 203228, 160629, 261375, 69479, 186590, 4203, 75830, 75825, 202885, 203229, 71181, 82067, 75828, 69886, 75826, 75829, 75824, 75827, 69482, 86752]",True,2021-05-12 10:56:20.740000,NM,7,11,mp-4158,oxide,Nd2CuO4,"{'functional': 'PBE', 'labels': ['Nd_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Nd': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-4158,"['mp-670050', 'mp-660368', 'mp-4158', 'mp-1078016', 'mp-1173374', 'mp-1440751', 'mp-1668619', 'mp-1797319', 'mp-1588086', 'mp-1590518', 'mp-688505']",0.0084899,"{'Nd': 2.0, 'Cu': 1.0, 'O': 4.0}",97.4899480873212,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",8.708487558528232e-05,0.0084899,0,0.0084899,MP,data/source/MP/cleaned/cifs/MP-mp-4158.cif,True,,data/final/MP/graphs/Ce0.22Cu1Nd1.78O4-MP-mp-4158-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ce1Co0.875In5Ni0.125,2,0.0357142857142857,1.0,True,Ce1Co0.875In5Ni0.125,Ce1Co1In5,1.41,Heavy_fermion,True,Ce14.286Co12.5In71.429Ni1.786,Ce-Co-In-Ni,4,Supercon,Ce1Co0.875Ni0.125In5,MP-mp-19961,Ce1In5Co1,Ce-Co-In,Ce14.286Co14.286In71.429,P 4/m m m,tetragonal,4.635989,4.635989,7.564124,data/final/MP/cifs/Ce1Co0.875In5Ni0.125-MP-mp-19961-synth_doped.cif,data/source/MP/raw/cifs/mp-19961.cif,mp-19961,0.0,,2014-02-21 14:08:25,7.897022127398995,10.17188/1195145,"@misc{osti_1195145,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeIn5Co (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195145"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701944'}},0.0,7.80626318,520.0,-28.52795357,-4.075421938571429,{'tags': ['Cerium cobalt indium (1/1/5)']},-28.52795357,-4.075421938571429,-0.2468754242857146,"['xas', 'bandstructure']",True,[102108],True,2021-05-12 10:56:57.051000,FM,7,8,mp-19961,,CeIn5Co,"{'functional': 'PBE', 'labels': ['Ce', 'In_d', 'Co'], 'pot_type': 'paw'}","{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",GGA,mp-19961,"['mp-928775', 'mp-912209', 'mp-928270', 'mp-19961', 'mp-1504062', 'mp-1701944', 'mp-1785253', 'mp-1593180']",0.9310323,"{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",162.57113333428427,[],FM,True,123,1,"[0.7, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0057269226147644,0.9310323,1,0.9310323,MP,data/source/MP/cleaned/cifs/MP-mp-19961.cif,True,,data/final/MP/graphs/Ce1Co0.875In5Ni0.125-MP-mp-19961-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ga1Y3,1,0.0,1.0,True,Ga1Y3,Ga1Y3,0.0,Other,True,Ga25Y75,Ga-Y,2,Supercon,Ga1Y3,MP-mp-1187766,Y3Ga1,Ga-Y,Ga25Y75,P m -3 m,cubic,4.757077,4.757077,4.757077,data/final/MP/cifs/Ga1Y3-MP-mp-1187766.cif,data/source/MP/raw/cifs/mp-1187766.cif,mp-1187766,0.0,,2019-01-11 15:20:08.362000,5.189635888978274,,,{'GGA': {'task_id': 'mp-1761706'}},0.1205782001562489,3.53063126,520.0,-23.37959018,-5.844897545,{'tags': []},-23.37959018,-5.844897545,-0.2380202043750001,['bandstructure'],True,[],True,2021-05-12 10:58:31.620000,FM,4,5,mp-1187766,,Y3Ga,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ga_d'], 'pot_type': 'paw'}","{'Y': 3.0, 'Ga': 1.0}",GGA,mp-1187766,"['mp-1187766', 'mp-1417487', 'mp-1761706', 'mp-1796218', 'mp-1616998']",1.1126713,"{'Y': 3.0, 'Ga': 1.0}",107.6516134879322,[],FM,True,123,1,"[0.2, 0.3, 0.2, -0.0]",0.0103358534438012,1.1126713,3,1.1126713,MP,data/source/MP/cleaned/cifs/MP-mp-1187766.cif,False,,data/final/MP/graphs/Ga1Y3-MP-mp-1187766.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
N0.98Nb1O0.02,2,0.02,1.0,True,N0.98Nb1O0.02,N1Nb1,17.7,Oxide,True,N49Nb50O1,N-Nb-O,3,Supercon,Nb1N0.98O0.02,MP-mp-2634,Nb1N1,N-Nb,N50Nb50,P -6 m 2,hexagonal,2.898656,2.9761920047347994,2.97619211,data/final/MP/cifs/N0.98Nb1O0.02-MP-mp-2634-synth_doped.cif,data/source/MP/raw/cifs/mp-2634.cif,mp-2634,0.0,,2011-05-12 17:49:04,7.984187332554685,10.17188/1201157,"@misc{osti_1201157,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbN (SG:187) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201157"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671304'}},0.0,7.12357548,520.0,-20.57319827,-10.286599135,"{'tags': ['Niobium nitride (1/1)', 'Niobium nitride', 'Niobium nitride (1/1) - gamma']}",-20.57319827,-10.286599135,-1.2481991524999998,"['xas', 'elasticity', 'bandstructure']",True,"[185569, 644536, 76385, 191062]",True,2021-05-12 10:56:18.721000,NM,2,17,mp-2634,,NbN,"{'functional': 'PBE', 'labels': ['Nb_pv', 'N'], 'pot_type': 'paw'}","{'Nb': 1.0, 'N': 1.0}",GGA,mp-2634,"['mp-926732', 'mp-910421', 'mp-926222', 'mp-2634', 'mp-1058402', 'mp-1058440', 'mp-1058487', 'mp-1061535', 'mp-1061589', 'mp-1061648', 'mp-1116126', 'mp-1442283', 'mp-1671304', 'mp-1924826', 'mp-1594881', 'mp-1061618', 'mp-1058457']",0.0002504,"{'Nb': 1.0, 'N': 1.0}",22.23561881453577,[],NM,False,187,0,"[0, 0]",1.1261211216496917e-05,0.0002504,0,0.0002504,MP,data/source/MP/cleaned/cifs/MP-mp-2634.cif,True,,data/final/MP/graphs/N0.98Nb1O0.02-MP-mp-2634-synth_doped.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Be12Mn1,1,0.0,1.0,True,Be12Mn1,Be12Mn1,0.0,Other,True,Be92.308Mn7.692,Be-Mn,2,Supercon,Be12Mn1,MP-mp-1104792,Mn1Be12,Be-Mn,Be92.308Mn7.692,I 4/m m m,tetragonal,4.098421996481663,5.458895580696035,5.45889558,data/final/MP/cifs/Be12Mn1-MP-mp-1104792.cif,data/source/MP/raw/cifs/mp-1104792.cif,mp-1104792,0.0,,2018-07-18 23:35:04,2.5810698201417828,,,{'GGA': {'task_id': 'mp-1696836'}},0.0,4.75113141,520.0,-54.85336789,-4.219489837692308,"{'tags': ['ThMn12', 'CaCu5-Zr4Al3 intergrowth', 'Beryllium manganese (12/1)', 'Be12Mn']}",-54.85336789,-4.219489837692308,-0.0629537090716185,['bandstructure'],True,[616329],True,2021-05-12 10:58:20.361000,FM,13,5,mp-1104792,,MnBe12,"{'functional': 'PBE', 'labels': ['Mn_pv', 'Be_sv'], 'pot_type': 'paw'}","{'Mn': 1.0, 'Be': 12.0}",GGA,mp-1104792,"['mp-1104792', 'mp-1436918', 'mp-1696836', 'mp-1798069', 'mp-1602200']",1.1614586,"{'Mn': 1.0, 'Be': 12.0}",104.9207314298707,[],FM,True,139,1,"[1.6, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0110698675483054,1.1614586,1,1.1614586,MP,data/source/MP/cleaned/cifs/MP-mp-1104792.cif,False,,data/final/MP/graphs/Be12Mn1-MP-mp-1104792.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ba2Ca1Cu2Hg1O6.16,2,0.0131578947368421,0.9740051948051948,True,Ba1.948Ca0.974Cu1.948Hg0.974O6,Ba2Ca1Cu2Hg1O6,121.0,Cuprate,True,Ba16.447Ca8.224Cu16.447Hg8.224O50.6578947368421,Ba-Ca-Cu-Hg-O,5,Supercon,Hg1Ba2Ca1Cu2O6.16,MP-mp-6879,Ba2Ca1Cu2Hg1O6,Ba-Ca-Cu-Hg-O,Ba16.667Ca8.333Cu16.667Hg8.333O50,P 4/m m m,tetragonal,3.904834,3.904834,13.058604,data/final/MP/cifs/Ba2Ca1Cu2Hg1O6.16-MP-mp-6879-synth_doped.cif,data/source/MP/raw/cifs/mp-6879.cif,mp-6879,0.0,,2011-05-14 23:17:39,6.158075338837193,10.17188/1284432,"@misc{osti_1284432,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2CaCu2HgO6 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1284432"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698891'}},0.017586347638888,3.04291167,520.0,-64.08791228,-5.3406593566666665,"{'tags': ['High pressure experimental phase', 'Mercury dibarium calcium dicopper oxide', 'Mercury barium calcium copper oxide (1/2/1/2/6)']}",-64.08791228,-5.3406593566666665,-2.0147092504166664,"['bandstructure', 'elasticity']",True,"[83087, 75729, 75727, 75726, 75725, 75728]",True,2021-05-12 10:56:27.046000,NM,12,12,mp-6879,oxide,Ba2CaCu2HgO6,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ca_sv', 'Cu_pv', 'Hg', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Hg': 1.0, 'O': 6.0}",GGA,mp-6879,"['mp-917434', 'mp-924375', 'mp-6879', 'mp-923788', 'mvc-16307', 'mp-1045026', 'mp-1045039', 'mp-1422313', 'mp-1698891', 'mp-1833979', 'mp-1592102', 'mp-1045044']",0.0305618,"{'Ba': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Hg': 1.0, 'O': 6.0}",199.11404926320108,[],NM,False,123,0,"[0.0, 0.0, 0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001534889181004,0.0305618,0,0.0305618,MP,data/source/MP/cleaned/cifs/MP-mp-6879.cif,True,,data/final/MP/graphs/Ba2Ca1Cu2Hg1O6.16-MP-mp-6879-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ga1Ta0.198V2.802,3,0.0989999999999999,2.0,False,Ga2Ta0.396V5.604,Ga2V6,12.3,Other,True,Ga25Ta4.95V70.05,Ga-Ta-V,3,Supercon,V2.802Ta0.198Ga1,MP-mp-22568,V6Ga2,Ga-V,Ga25V75,P m -3 n,cubic,4.789645,4.789645,4.789645,data/final/MP/cifs/Ga1Ta0.198V2.802-MP-mp-22568-synth_doped.cif,data/source/MP/raw/cifs/mp-22568.cif,mp-22568,0.0,,2014-02-22 11:36:40,6.726541666276222,10.17188/1198793,"@misc{osti_1198793,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Ga (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198793"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686867'}},0.0,5.67452231,520.0,-61.95244347,-7.74405543375,{'tags': ['Gallium vanadium (1/3)']},-61.95244347,-7.74405543375,-0.1741018756249994,"['xas', 'elasticity', 'bandstructure']",True,"[635643, 635628, 635619, 635634, 104021, 635646, 635604, 635610, 635617, 635624, 635626, 635605, 635631, 635625, 635636, 635603, 104020, 635616, 635607]",True,2021-05-12 10:56:16.728000,FM,8,9,mp-22568,,V3Ga,"{'functional': 'PBE', 'labels': ['V_pv', 'Ga_d'], 'pot_type': 'paw'}","{'V': 3.0, 'Ga': 1.0}",GGA,mp-22568,"['mp-941343', 'mp-941663', 'mp-934924', 'mp-22568', 'mp-1440749', 'mp-1686867', 'mp-1804076', 'mp-1593784', 'mp-1595713']",0.09063635,"{'V': 6.0, 'Ga': 2.0}",109.87780534443452,[],FM,True,131,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.0, -0.0, -0.0]",0.0016497662965852,0.09063635,2,0.1812727,MP,data/source/MP/cleaned/cifs/MP-mp-22568.cif,True,,data/final/MP/graphs/Ga1Ta0.198V2.802-MP-mp-22568-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ce1In5Ir0.8Rh0.2,3,0.0571428571428571,1.0,True,Ce1In5Ir0.8Rh0.2,Ce1In5Ir1,0.67,Heavy_fermion,True,Ce14.286In71.429Ir11.429Rh2.857,Ce-In-Ir-Rh,4,Supercon,Ce1Rh0.2Ir0.8In5,MP-mp-20975,Ce1In5Ir1,Ce-In-Ir,Ce14.286In71.429Ir14.286,P 4/m m m,tetragonal,4.724199,4.724199,7.575801,data/final/MP/cifs/Ce1In5Ir0.8Rh0.2-MP-mp-20975-synth_doped.cif,data/source/MP/raw/cifs/mp-20975.cif,mp-20975,0.0,,2014-02-21 16:15:16,8.902153726103897,10.17188/1196209,"@misc{osti_1196209,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeIn5Ir (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196209"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688300'}},0.0,8.1498488,520.0,-31.20695684,-4.458136691428572,{'tags': ['Cerium iridium indide (1/1/5)']},-31.20695684,-4.458136691428572,-0.3824312307142854,"['xas', 'bandstructure']",True,[150225],True,2021-05-12 10:56:57.051000,FM,7,8,mp-20975,,CeIn5Ir,"{'functional': 'PBE', 'labels': ['Ce', 'In_d', 'Ir'], 'pot_type': 'paw'}","{'Ce': 1.0, 'In': 5.0, 'Ir': 1.0}",GGA,mp-20975,"['mp-919528', 'mp-918523', 'mp-905302', 'mp-20975', 'mp-1300982', 'mp-1688300', 'mp-1832383', 'mp-1591628']",0.1040192,"{'Ce': 1.0, 'In': 5.0, 'Ir': 1.0}",169.077152414387,[],FM,True,123,1,"[0.1, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0006152173638757,0.1040192,1,0.1040192,MP,data/source/MP/cleaned/cifs/MP-mp-20975.cif,True,,data/final/MP/graphs/Ce1In5Ir0.8Rh0.2-MP-mp-20975-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ge2Rh2Th1,1,0.0,1.0,True,Ge2Rh2Th1,Ge2Rh2Th1,1.1,Other,True,Ge40Rh40Th20,Ge-Rh-Th,3,Supercon,Th1Rh2Ge2,MP-mp-3011,Th1Ge2Rh2,Ge-Rh-Th,Ge40Rh40Th20,I 4/m m m,tetragonal,4.208037996920766,4.208037996920766,6.01184024,data/final/MP/cifs/Ge2Rh2Th1-MP-mp-3011.cif,data/source/MP/raw/cifs/mp-3011.cif,mp-3011,0.0,,2011-05-13 16:40:55,10.468035619688903,10.17188/1204535,"@misc{osti_1204535,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Th(GeRh)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1204535"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699366'}},0.0,6.77994775,520.0,-35.7482147,-7.14964294,{'tags': ['Rhodium thorium germanide (2/1/2)']},-35.7482147,-7.14964294,-0.8719369999999997,"['xas', 'elasticity', 'bandstructure']",True,"[637707, 53895]",True,2021-05-12 10:56:18.721000,NM,5,6,mp-3011,,Th(GeRh)2,"{'functional': 'PBE', 'labels': ['Th', 'Ge_d', 'Rh_pv'], 'pot_type': 'paw'}","{'Th': 1.0, 'Ge': 2.0, 'Rh': 2.0}",GGA,mp-3011,"['mp-3011', 'mp-996577', 'mp-1438198', 'mp-1699366', 'mp-1863500', 'mp-1595738']",0.000162,"{'Th': 1.0, 'Ge': 2.0, 'Rh': 2.0}",92.50146065403928,[],NM,False,139,0,"[0, 0, 0, 0, 0]",1.7513236964537154e-06,0.000162,0,0.000162,MP,data/source/MP/cleaned/cifs/MP-mp-3011.cif,False,,data/final/MP/graphs/Ge2Rh2Th1-MP-mp-3011.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Tl0.3W1O3,2,0.0143112701252235,3.0,False,Tl0.9W3O9,Tl1W3O9,2.0,Oxide,True,Tl6.977W23.256O69.76744186046513,Tl-W-O,3,Supercon,Tl0.3W1O3,MP-mp-766046,Tl1W3O9,Tl-W-O,Tl7.692W23.077O69.23076923076923,P 6 m m,hexagonal,3.873976,7.528308004324179,7.52830716,data/final/MP/cifs/Tl0.3W1O3-MP-mp-766046-synth_doped.cif,data/source/MP/raw/cifs/mp-766046.cif,mp-766046,0.0,,2014-02-16 11:19:48,7.858869655056549,,,{'GGA+U': {'task_id': 'mp-1733645'}},0.0,3.87134241,520.0,-93.25921877,-7.173786059230769,{'tags': []},-93.25921877,-7.173786059230769,-2.075965166794872,['bandstructure'],True,[],True,2021-05-12 10:59:03.700000,FM,13,10,mp-766046,oxide,Tl(WO3)3,"{'functional': 'PBE', 'labels': ['Tl_d', 'W_pv', 'O'], 'pot_type': 'paw'}","{'Tl': 1.0, 'W': 3.0, 'O': 9.0}",GGA+U,mp-766046,"['mp-883644', 'mp-899054', 'mp-767458', 'mp-1101270', 'mp-766046', 'mp-883632', 'mp-1397471', 'mp-1733645', 'mp-1835586', 'mp-899826']",0.8702426,"{'Tl': 1.0, 'W': 3.0, 'O': 9.0}",190.1438354992729,[],FM,True,35,1,"[0.0, 0.3, 0.4, 0.4, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.004576759471139,0.8702426,3,0.8702426,MP,data/source/MP/cleaned/cifs/MP-mp-766046.cif,True,,data/final/MP/graphs/Tl0.3W1O3-MP-mp-766046-synth_doped.json,0,True,6mm,0,5,0,0,0,0,0,1,0,0,0,1.0,False
Ba1C6,1,0.0,2.0,False,Ba2C12,Ba2C12,0.0,Carbon,True,Ba14.286C85.714,Ba-C,2,Supercon,Ba1C6,MP-mp-1214417,Ba2C12,Ba-C,Ba14.286C85.714,P 63/m m c,hexagonal,4.339427997407888,4.33942723,10.762996,data/final/MP/cifs/Ba1C6-MP-mp-1214417.cif,data/source/MP/raw/cifs/mp-1214417.cif,mp-1214417,0.0,,2019-01-12 16:15:54.069000,3.96194859936106,,,{'GGA': {'task_id': 'mp-1733360'}},0.0,5.58967106,520.0,-115.7544283,-8.26817345,{'tags': []},-115.7544283,-8.26817345,-0.0853655885714275,[],False,[],True,2021-05-12 11:00:35.508000,NM,14,4,mp-1214417,,BaC6,"{'functional': 'PBE', 'labels': ['Ba_sv', 'C'], 'pot_type': 'paw'}","{'Ba': 1.0, 'C': 6.0}",GGA,mp-1214417,"['mp-1214417', 'mp-1403951', 'mp-1733360', 'mp-1829063']",0.0009736,"{'Ba': 2.0, 'C': 12.0}",175.52083732652542,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.109383951022054e-05,0.0009736,0,0.0019472,MP,data/source/MP/cleaned/cifs/MP-mp-1214417.cif,False,,data/final/MP/graphs/Ba1C6-MP-mp-1214417.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Au0.9In2Pd0.1,3,0.0666666666666666,1.0,True,Au0.9In2Pd0.1,Au1In2,0.0,Other,True,Au30In66.667Pd3.333,Au-In-Pd,3,Supercon,Au0.9In2Pd0.1,MP-mp-22154,In2Au1,Au-In,Au33.333In66.667,F m -3 m,cubic,4.73270953,4.73270953,4.732709529999999,data/final/MP/cifs/Au0.9In2Pd0.1-MP-mp-22154-synth_doped.cif,data/source/MP/raw/cifs/mp-22154.cif,mp-22154,0.0,,2014-02-21 07:40:59,9.450570171425827,10.17188/1197382,"@misc{osti_1197382,
    author = ""Persson, Kristin"",
    title = ""Materials Data on In2Au (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197382"",
    place = ""United States"",
    year = ""2016"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671074'}},0.0,6.28583915,520.0,-9.46337685,-3.15445895,{'tags': ['Gold indium (1/2)']},-9.46337685,-3.15445895,-0.2287092833333333,"['xas', 'elasticity', 'bandstructure']",True,"[58489, 612012, 58490, 612029, 612033, 612023]",True,2021-05-12 10:56:16.728000,NM,3,8,mp-22154,,In2Au,"{'functional': 'PBE', 'labels': ['In_d', 'Au'], 'pot_type': 'paw'}","{'In': 2.0, 'Au': 1.0}",GGA,mp-22154,"['mp-991990', 'mp-992168', 'mp-22154', 'mp-1439999', 'mp-1671074', 'mp-1799139', 'mp-993798', 'mp-1588536']",0.0002478,"{'In': 2.0, 'Au': 1.0}",74.95740668412449,[],NM,False,225,0,"[0, 0, 0]",3.305877443762772e-06,0.0002478,0,0.0002478,MP,data/source/MP/cleaned/cifs/MP-mp-22154.cif,True,,data/final/MP/graphs/Au0.9In2Pd0.1-MP-mp-22154-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
B2C1Ni2Tb0.3Y0.7,3,0.1,1.0,True,B2C1Ni2Tb0.3Y0.7,B2C1Ni2Y1,5.71,Other,True,B33.333C16.667Ni33.333Tb5Y11.667,B-C-Ni-Tb-Y,5,Supercon,Y0.7Tb0.3Ni2B2C1,MP-mp-6576,Y1Ni2B2C1,B-C-Ni-Y,B33.333C16.667Ni33.333Y16.667,I 4/m m m,tetragonal,3.548790000501972,3.548790000501972,5.76144136,data/final/MP/cifs/B2C1Ni2Tb0.3Y0.7-MP-mp-6576-synth_doped.cif,data/source/MP/raw/cifs/mp-6576.cif,mp-6576,0.0,,2011-05-13 05:21:43,6.099730998852292,10.17188/1281366,"@misc{osti_1281366,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281366"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688230'}},0.0,6.81083016,520.0,-43.677878,-7.279646333333333,{'tags': []},-43.677878,-7.279646333333333,-0.5109282141666659,"['xas', 'bandstructure']",True,"[75816, 89142, 83231, 79574, 41549]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6576,,YNi2B2C,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6576,"['mp-6576', 'mp-1007054', 'mp-1000583', 'mp-1439516', 'mp-1688230', 'mp-1794280', 'mp-1011792', 'mp-1597064']",0.0006603,"{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.3152437079014,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",1.010943177297096e-05,0.0006603,0,0.0006603,MP,data/source/MP/cleaned/cifs/MP-mp-6576.cif,True,,data/final/MP/graphs/B2C1Ni2Tb0.3Y0.7-MP-mp-6576-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ge0.5Ru0.5,1,0.0,8.0,False,Ge4Ru4,Ge4Ru4,0.0,Other,True,Ge50Ru50,Ge-Ru,2,Supercon,Ge0.5Ru0.5,MP-mp-1025397,Ge4Ru4,Ge-Ru,Ge50Ru50,P 21 3,cubic,4.896783,4.896783,4.896783,data/final/MP/cifs/Ge0.5Ru0.5-MP-mp-1025397.cif,data/source/MP/raw/cifs/mp-1025397.cif,mp-1025397,0.1660000000000003,,2016-10-08 12:45:47,9.826555984308929,10.17188/1355284,"@article{osti_1355284,
    author = ""Persson, Kristin"",
    title = ""Materials Data on GeRu (SG:198) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1355284"",
    place = ""United States"",
    year = ""2017"",
    month = ""5""
}
",{'GGA': {'task_id': 'mp-1695978'}},0.0111861133333324,6.85600468,520.0,-57.85191777,-7.23148972125,"{'tags': ['Ruthenium germanide (1/1)', 'RuGe rt', 'FeSi']}",-57.85191777,-7.23148972125,-0.2827809662499998,"['bandstructure', 'elasticity']",True,[637744],True,2021-05-12 10:56:10.715000,NM,8,6,mp-1025397,,GeRu,"{'functional': 'PBE', 'labels': ['Ge_d', 'Ru_pv'], 'pot_type': 'paw'}","{'Ge': 1.0, 'Ru': 1.0}",GGA,mp-1025397,"['mp-1025397', 'mp-1095037', 'mp-1429739', 'mp-1695978', 'mp-1805146', 'mp-1591855']",2.5e-08,"{'Ge': 4.0, 'Ru': 4.0}",117.4174315883153,[],NM,False,198,0,"[0, 0, 0, 0, 0, 0, 0, 0]",8.51662301306473e-10,2.5e-08,0,1e-07,MP,data/source/MP/cleaned/cifs/MP-mp-1025397.cif,False,,data/final/MP/graphs/Ge0.5Ru0.5-MP-mp-1025397.json,0,True,23,1,0,0,0,0,0,0,1,0,0,0,1.0,False
Ca0.11Cu1La1.89O4,2,0.0314285714285714,1.0,True,Ca0.11Cu1La1.89O4,Cu1La2O4,23.0,Cuprate,True,Ca1.571Cu14.286La27O57.142857142857146,Ca-Cu-La-O,4,Supercon,La1.89Ca0.11Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ca0.11Cu1La1.89O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ca0.11Cu1La1.89O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Fe4P12Tb1,1,0.0,1.0,True,Fe4P12Tb1,Fe4P12Tb1,0.0,Ferrite,True,Fe23.529P70.588Tb5.882,Fe-P-Tb,3,Supercon,Tb1Fe4P12,MP-mp-21041,Tb1Fe4P12,Fe-P-Tb,Fe23.529P70.588Tb5.882,I m -3,cubic,6.738405101493799,6.7384051,6.7384051,data/final/MP/cifs/Fe4P12Tb1-MP-mp-21041.cif,data/source/MP/raw/cifs/mp-21041.cif,mp-21041,0.0,,2014-02-22 14:42:14,5.315761764742555,10.17188/1196302,"@misc{osti_1196302,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Tb(FeP3)4 (SG:204) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196302"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1669465'}},0.0,8.0515014,520.0,-113.54001682,-6.67882451882353,{'tags': ['Terbium tetrairon dodecaphosphide']},-113.54001682,-6.67882451882353,-0.592116872941177,"['xas', 'bandstructure']",True,[245293],True,2021-05-12 10:56:57.051000,NM,17,8,mp-21041,,Tb(FeP3)4,"{'functional': 'PBE', 'labels': ['Tb_3', 'Fe_pv', 'P'], 'pot_type': 'paw'}","{'Tb': 1.0, 'Fe': 4.0, 'P': 12.0}",GGA,mp-21041,"['mp-992558', 'mp-991869', 'mp-21041', 'mp-1421103', 'mp-1669465', 'mp-1776787', 'mp-994067', 'mp-1603311']",0.0363096,"{'Tb': 1.0, 'Fe': 4.0, 'P': 12.0}",235.5317500186484,[],NM,False,204,0,"[-0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001541601079137,0.0363096,0,0.0363096,MP,data/source/MP/cleaned/cifs/MP-mp-21041.cif,False,,data/final/MP/graphs/Fe4P12Tb1-MP-mp-21041.json,0,True,m-3,2,0,0,0,0,0,0,0,0,1,0,1.0,False
B2Ir2Sr1,1,0.0,2.0,False,B4Ir4Sr2,B4Ir4Sr2,0.0,Other,True,B40Ir40Sr20,B-Ir-Sr,3,Supercon,Sr1Ir2B2,MP-mp-6939,Sr2B4Ir4,B-Ir-Sr,B40Ir40Sr20,F d d d,orthorhombic,5.632539058877364,5.63253906,6.19785663,data/final/MP/cifs/B2Ir2Sr1-MP-mp-6939.cif,data/source/MP/raw/cifs/mp-6939.cif,mp-6939,0.0,,2011-05-28 17:45:55,10.518610192941283,10.17188/1284664,"@misc{osti_1284664,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr(BIr)2 (SG:70) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1284664"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703450'}},0.0,5.91180908,520.0,-71.7199425,-7.17199425,{'tags': ['Strontium iridium boride (1/2/2)']},-71.7199425,-7.17199425,-0.6269666830000006,"['bandstructure', 'elasticity']",True,[8154],True,2021-05-12 10:56:27.046000,NM,10,8,mp-6939,,Sr(BIr)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'B', 'Ir'], 'pot_type': 'paw'}","{'Sr': 1.0, 'B': 2.0, 'Ir': 2.0}",GGA,mp-6939,"['mp-921813', 'mp-907368', 'mp-920796', 'mp-6939', 'mp-1436646', 'mp-1703450', 'mp-1778268', 'mp-1601604']",2.375e-05,"{'Sr': 2.0, 'B': 4.0, 'Ir': 4.0}",155.870075838145,[],NM,False,70,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.047409821582679e-07,2.375e-05,0,4.75e-05,MP,data/source/MP/cleaned/cifs/MP-mp-6939.cif,False,,data/final/MP/graphs/B2Ir2Sr1-MP-mp-6939.json,0,True,mmm,0,0,0,7,0,0,0,0,0,0,1,1.0,False
Pd1Sc2,1,0.0,8.0,False,Pd8Sc16,Pd8Sc16,0.0,Other,True,Pd33.333Sc66.667,Pd-Sc,2,Supercon,Pd1Sc2,MP-mp-1190862,Sc16Pd8,Pd-Sc,Pd33.333Sc66.667,F d -3 m,cubic,8.84260082,8.842600819999998,8.842600819999998,data/final/MP/cifs/Pd1Sc2-MP-mp-1190862.cif,data/source/MP/raw/cifs/mp-1190862.cif,mp-1190862,0.0148999999999999,,2019-01-11 21:16:14.404000,5.33463516930146,,,{'GGA': {'task_id': 'mp-1731905'}},0.0,4.52785126,520.0,-158.62528896,-6.6093870400000005,{'tags': ['Scandium palladium (2/1)']},-158.62528896,-6.6093870400000005,-0.6611137000000001,['bandstructure'],True,"[648809, 648813]",True,2021-05-12 10:58:33.577000,NM,24,6,mp-1190862,,Sc2Pd,"{'functional': 'PBE', 'labels': ['Sc_sv', 'Pd'], 'pot_type': 'paw'}","{'Sc': 2.0, 'Pd': 1.0}",GGA,mp-1190862,"['mp-1190862', 'mp-1191724', 'mp-1402539', 'mp-1731905', 'mp-1823567', 'mp-1610612']",0.0005596625,"{'Sc': 16.0, 'Pd': 8.0}",488.9056565966072,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",9.157799545964737e-06,0.0005596625,0,0.0044773,MP,data/source/MP/cleaned/cifs/MP-mp-1190862.cif,False,,data/final/MP/graphs/Pd1Sc2-MP-mp-1190862.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ge1Ta3,1,0.0,8.0,False,Ge8Ta24,Ge8Ta24,8.0,Other,True,Ge25Ta75,Ge-Ta,2,Supercon,Ge1Ta3,MP-mp-639805,Ta24Ge8,Ge-Ta,Ge25Ta75,P 42/n,tetragonal,5.248006,10.340209,10.340209,data/final/MP/cifs/Ge1Ta3-MP-mp-639805.cif,data/source/MP/raw/cifs/mp-639805.cif,mp-639805,0.0,,2013-06-24 19:00:37,14.571445664540043,10.17188/1279868,"@misc{osti_1279868,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ta3Ge (SG:86) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1279868"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1741146'}},0.0,6.39719594,520.0,-330.37369885,-10.3241780890625,"{'tags': ['Tantalum germanide (3/1) - LT', 'Tantalum germanide (3/1)']}",-330.37369885,-10.3241780890625,-0.2750879028125013,['xas'],False,"[108870, 637966]",True,2021-05-12 10:57:30.779000,NM,32,5,mp-639805,,Ta3Ge,"{'functional': 'PBE', 'labels': ['Ta_pv', 'Ge_d'], 'pot_type': 'paw'}","{'Ta': 3.0, 'Ge': 1.0}",GGA,mp-639805,"['mp-639805', 'mp-1204437', 'mp-1402043', 'mp-1741146', 'mp-1881645']",5.1875e-06,"{'Ta': 24.0, 'Ge': 8.0}",561.1163930345308,[],NM,False,86,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",7.395969983262656e-08,5.1875e-06,0,4.15e-05,MP,data/source/MP/cleaned/cifs/MP-mp-639805.cif,False,,data/final/MP/graphs/Ge1Ta3-MP-mp-639805.json,0,True,4/m,0,0,0,0,3,0,0,1,0,0,0,1.0,False
Cu1La1Sr1Tl1O5,1,0.0,1.0,True,Cu1La1Sr1Tl1O5,Cu1La1Sr1Tl1O5,33.0,Cuprate,True,Cu11.111La11.111Sr11.111Tl11.111O55.55555555555556,Cu-La-Sr-Tl-O,5,Supercon,Tl1Sr1La1Cu1O5,MP-mp-1218170,Sr1La1Tl1Cu1O5,Cu-La-Sr-Tl-O,Cu11.111La11.111Sr11.111Tl11.111O55.55555555555556,P 4 m m,tetragonal,3.808314,3.808314,8.940218,data/final/MP/cifs/Cu1La1Sr1Tl1O5-MP-mp-1218170.cif,data/source/MP/raw/cifs/mp-1218170.cif,mp-1218170,0.0,,2019-01-12 19:23:00.047000,7.356801903811997,,,{'GGA': {'task_id': 'mp-1751231'}},0.0235770105555133,5.93274247,520.0,-55.01092809,-6.1123253433333335,{'tags': []},-55.01092809,-6.1123253433333335,-2.2909747433333343,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,9,5,mp-1218170,oxide,SrLaTlCuO5,"{'functional': 'PBE', 'labels': ['Sr_sv', 'La', 'Tl_d', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 1.0, 'La': 1.0, 'Tl': 1.0, 'Cu': 1.0, 'O': 5.0}",GGA,mp-1218170,"['mp-1218170', 'mp-1444406', 'mp-1751231', 'mp-1787322', 'mp-1618863']",0.0033628,"{'Sr': 1.0, 'La': 1.0, 'Tl': 1.0, 'Cu': 1.0, 'O': 5.0}",129.66226608171218,[],NM,False,99,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",2.593507040730561e-05,0.0033628,0,0.0033628,MP,data/source/MP/cleaned/cifs/MP-mp-1218170.cif,False,,data/final/MP/graphs/Cu1La1Sr1Tl1O5-MP-mp-1218170.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
La1Pt2Si2,1,0.0,2.0,False,La2Pt4Si4,La2Pt4Si4,1.4325,Other,True,La20Pt40Si40,La-Pt-Si,3,Supercon,La1Pt2Si2,MP-mp-1080606,La2Si4Pt4,La-Pt-Si,La20Pt40Si40,P 4/n m m,tetragonal,4.330983,4.330983,9.884295,data/final/MP/cifs/La1Pt2Si2-MP-mp-1080606.cif,data/source/MP/raw/cifs/mp-1080606.cif,mp-1080606,0.0,,2018-04-24 03:40:37,10.483293748935928,,,{'GGA': {'task_id': 'mp-1702431'}},0.0,8.78119933,520.0,-67.08831695,-6.708831695000001,{'tags': ['Lanthanum platinum silicide (1/2/2)']},-67.08831695,-6.708831695000001,-1.0947415820000004,['bandstructure'],True,[641715],True,2021-05-12 10:58:18.470000,NM,10,6,mp-1080606,,La(SiPt)2,"{'functional': 'PBE', 'labels': ['La', 'Si', 'Pt'], 'pot_type': 'paw'}","{'La': 1.0, 'Si': 2.0, 'Pt': 2.0}",GGA,mp-1080606,"['mp-1080606', 'mp-1266219', 'mp-1422118', 'mp-1702431', 'mp-1834946', 'mp-1601821']",0.0030189,"{'La': 2.0, 'Si': 4.0, 'Pt': 4.0}",185.4038109053756,[],NM,False,129,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.256567365317807e-05,0.0030189,0,0.0060378,MP,data/source/MP/cleaned/cifs/MP-mp-1080606.cif,False,,data/final/MP/graphs/La1Pt2Si2-MP-mp-1080606.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ba0.105Cu1La1.895O4,2,0.0299999999999999,1.0,True,Ba0.105Cu1La1.895O4,Cu1La2O4,33.1,Cuprate,True,Ba1.5Cu14.286La27.071O57.142857142857146,Ba-Cu-La-O,4,Supercon,La1.895Ba0.105Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ba0.105Cu1La1.895O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ba0.105Cu1La1.895O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Nb1P1Rh1,1,0.0,4.0,False,Nb4P4Rh4,Nb4P4Rh4,4.25,Other,True,Nb33.333P33.333Rh33.333,Nb-P-Rh,3,Supercon,Nb1Rh1P1,MP-mp-1101948,Nb4P4Rh4,Nb-P-Rh,Nb33.333P33.333Rh33.333,P n m a,orthorhombic,3.792606,6.368709,7.22189,data/final/MP/cifs/Nb1P1Rh1-MP-mp-1101948.cif,data/source/MP/raw/cifs/mp-1101948.cif,mp-1101948,0.0,,2018-07-18 13:05:24,8.635443397251434,,,{'GGA': {'task_id': 'mp-1699024'}},0.0,8.49383871,520.0,-102.03466965,-8.5028891375,"{'tags': ['Niobium rhodium phosphide (1/1/1)', 'AlB2 family', 'TiNiSi', 'NbRhP']}",-102.03466965,-8.5028891375,-0.8765839986111104,['bandstructure'],True,[645173],True,2021-05-12 10:58:18.470000,NM,12,5,mp-1101948,,NbPRh,"{'functional': 'PBE', 'labels': ['Nb_pv', 'P', 'Rh_pv'], 'pot_type': 'paw'}","{'Nb': 1.0, 'P': 1.0, 'Rh': 1.0}",GGA,mp-1101948,"['mp-1101948', 'mp-1414756', 'mp-1699024', 'mp-1779792', 'mp-1598644']",6.225e-06,"{'Nb': 4.0, 'P': 4.0, 'Rh': 4.0}",174.43755969951698,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.427444871557037e-07,6.225e-06,0,2.49e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1101948.cif,False,,data/final/MP/graphs/Nb1P1Rh1-MP-mp-1101948.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Al1Nb2.706V0.294,3,0.147,2.0,False,Al2Nb5.412V0.588,Al2Nb6,15.6,Other,True,Al25Nb67.65V7.35,Al-Nb-V,3,Supercon,Nb2.706V0.294Al1,MP-mp-796,Nb6Al2,Al-Nb,Al25Nb75,P m -3 n,cubic,5.215254,5.215254,5.215254,data/final/MP/cifs/Al1Nb2.706V0.294-MP-mp-796-synth_doped.cif,data/source/MP/raw/cifs/mp-796.cif,mp-796,0.0,,2011-05-13 16:07:37,7.157298025966356,,,{'GGA': {'task_id': 'mp-1686893'}},0.0460773865000003,5.52947534,520.0,-69.48918494,-8.6861481175,"{'tags': ['Aluminium niobium (1/3)', 'Niobium aluminide (3/1)', 'Aluminum niobium (1/3)']}",-69.48918494,-8.6861481175,-0.1737753800000003,"['bandstructure', 'elasticity']",True,"[608675, 608654, 608688, 608668, 608669, 608685, 608676, 608683, 58014, 608657, 107856, 608655, 608666, 608691, 608656, 608665, 608673, 608653, 608661]",True,2021-05-12 10:56:31.128000,NM,8,10,mp-796,,Nb3Al,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Al': 1.0}",GGA,mp-796,"['mp-911586', 'mp-927906', 'mp-796', 'mp-927472', 'mp-1260512', 'mp-1440919', 'mp-1686893', 'mp-1927652', 'mp-1591599', 'mp-1587739']",0.16323955,"{'Nb': 6.0, 'Al': 2.0}",141.8490379078192,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0023015954483396,0.16323955,0,0.3264791,MP,data/source/MP/cleaned/cifs/MP-mp-796.cif,True,,data/final/MP/graphs/Al1Nb2.706V0.294-MP-mp-796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Cu4Ga0.2Y0.8O8,3,0.0266666666666666,1.0,True,Ba2Cu4Ga0.2Y0.8O8,Ba2Cu4Y1O8,69.0,Cuprate,True,Ba13.333Cu26.667Ga1.333Y5.333O53.333333333333336,Ba-Cu-Ga-Y-O,5,Supercon,Y0.8Ga0.2Ba2Cu4O8,MP-mp-6790,Ba2Y1Cu4O8,Ba-Cu-Y-O,Ba13.333Cu26.667Y6.667O53.333333333333336,C m m m,orthorhombic,3.889922,3.899603999537882,13.88942687,data/final/MP/cifs/Ba2Cu4Ga0.2Y0.8O8-MP-mp-6790-synth_doped.cif,data/source/MP/raw/cifs/mp-6790.cif,mp-6790,0.0,,2011-05-16 03:21:24,5.936250568336678,10.17188/1283441,"@misc{osti_1283441,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Y(CuO2)4 (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1283441"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686864'}},0.0,3.31391536,520.0,-91.58381472,-6.105587648,"{'tags': ['Yttrium barium copper oxide (1/2/4/8)', 'High pressure experimental phase']}",-91.58381472,-6.105587648,-2.0529924817777783,"['xas', 'bandstructure']",True,"[72261, 85273, 74251, 400273, 85277, 85275, 400280, 67632, 85272, 67631, 83920, 66613, 85279, 400277, 75689, 74259, 85278, 85280, 66603, 94265, 400276, 88873, 71417, 75712, 97052, 66605, 72258, 85281, 85274, 400279, 66604, 69698]",True,2021-05-12 10:57:34.594000,NM,15,10,mp-6790,oxide,Ba2Y(CuO2)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-6790,"['mp-1000664', 'mp-6790', 'mp-1007136', 'mp-1237713', 'mp-1440937', 'mp-1686864', 'mp-1834179', 'mp-1011883', 'mp-1590064', 'mp-1590433']",0.0004643,"{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",208.60454115924333,[],NM,False,65,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.225742533790601e-06,0.0004643,0,0.0004643,MP,data/source/MP/cleaned/cifs/MP-mp-6790.cif,True,,data/final/MP/graphs/Ba2Cu4Ga0.2Y0.8O8-MP-mp-6790-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
B6La3Ru8,1,0.0,1.0,True,B6La3Ru8,B6La3Ru8,3.15,Other,True,B35.294La17.647Ru47.059,B-La-Ru,3,Supercon,La3Ru8B6,MP-mp-4676,La3B6Ru8,B-La-Ru,B35.294La17.647Ru47.059,F m m m,orthorhombic,5.587734000025254,5.659584852160177,9.241479802652188,data/final/MP/cifs/B6La3Ru8-MP-mp-4676.cif,data/source/MP/raw/cifs/mp-4676.cif,mp-4676,0.0,,2011-05-17 15:09:25,8.8427732736621,10.17188/1208333,"@misc{osti_1208333,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La3(B3Ru4)2 (SG:69) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208333"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1676070'}},0.0,8.17614556,520.0,-136.65934011,-8.03878471235294,{'tags': ['Lanthanum ruthenium boride (3/8/6)']},-136.65934011,-8.03878471235294,-0.4458735841176466,"['xas', 'bandstructure']",True,"[159927, 417472]",True,2021-05-12 10:57:08.928000,NM,17,8,mp-4676,,La3(B3Ru4)2,"{'functional': 'PBE', 'labels': ['La', 'B', 'Ru_pv'], 'pot_type': 'paw'}","{'La': 3.0, 'B': 6.0, 'Ru': 8.0}",GGA,mp-4676,"['mp-1001332', 'mp-1000392', 'mp-4676', 'mp-1380877', 'mp-1676070', 'mp-1777774', 'mp-1007715', 'mp-1603997']",0.0137165,"{'La': 3.0, 'B': 6.0, 'Ru': 8.0}",242.2692301365836,[],NM,False,69,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",5.661676471364968e-05,0.0137165,0,0.0137165,MP,data/source/MP/cleaned/cifs/MP-mp-4676.cif,False,,data/final/MP/graphs/B6La3Ru8-MP-mp-4676.json,0,True,mmm,0,0,0,7,0,0,0,0,0,0,1,1.0,False
Co0.97Rh0.03U1,2,0.03,4.0,False,Co3.88Rh0.12U4,Co4U4,0.0,Heavy_fermion,True,Co48.5Rh1.5U50,Co-Rh-U,3,Supercon,Co0.97Rh0.03U1,MP-mp-1080107,U4Co4,Co-U,Co50U50,I 21 3,cubic,5.46651343121184,5.466513429999999,5.466513429999999,data/final/MP/cifs/Co0.97Rh0.03U1-MP-mp-1080107-synth_doped.cif,data/source/MP/raw/cifs/mp-1080107.cif,mp-1080107,0.0,,2018-04-17 12:54:58,15.685586226920387,,,{'GGA': {'task_id': 'mp-1702457'}},0.0,11.55343047,520.0,-75.74461929,-9.46807741125,"{'tags': ['Uranium cobalt (1/1)', 'Cobalt uranium (1/1)', 'UCo', 'b.c.c. atom arrangement']}",-75.74461929,-9.46807741125,-0.2682135087500015,['bandstructure'],True,"[625521, 102712]",True,2021-05-12 10:58:16.596000,NM,8,6,mp-1080107,,UCo,"{'functional': 'PBE', 'labels': ['U', 'Co'], 'pot_type': 'paw'}","{'U': 1.0, 'Co': 1.0}",GGA,mp-1080107,"['mp-1080107', 'mp-1084836', 'mp-1432219', 'mp-1702457', 'mp-1785261', 'mp-1596640']",4.08e-05,"{'U': 4.0, 'Co': 4.0}",125.75039772653412,[],NM,False,199,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.297809016516246e-06,4.08e-05,0,0.0001632,MP,data/source/MP/cleaned/cifs/MP-mp-1080107.cif,True,,data/final/MP/graphs/Co0.97Rh0.03U1-MP-mp-1080107-synth_doped.json,0,True,23,1,0,0,0,0,0,0,0,0,1,0,1.0,False
As2Zr1,1,0.0,4.0,False,As8Zr4,As8Zr4,0.0,Other,True,As66.667Zr33.333,As-Zr,2,Supercon,As2Zr1,MP-mp-27606,Zr4As8,As-Zr,As66.667Zr33.333,P n m a,orthorhombic,3.726723,6.862008,9.144174,data/final/MP/cifs/As2Zr1-MP-mp-27606.cif,data/source/MP/raw/cifs/mp-27606.cif,mp-27606,0.0,,2014-02-25 23:48:10,6.847379482639791,10.17188/1201812,"@misc{osti_1201812,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrAs2 (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201812"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701295'}},0.0,6.22533654,520.0,-81.52223053,-6.793519210833334,{'tags': ['Zirconium arsenide (1/2)']},-81.52223053,-6.793519210833334,-0.8382067308333335,"['xas', 'elasticity', 'bandstructure']",True,"[168665, 20292]",True,2021-05-12 10:56:18.721000,NM,12,9,mp-27606,,ZrAs2,"{'functional': 'PBE', 'labels': ['Zr_sv', 'As'], 'pot_type': 'paw'}","{'Zr': 1.0, 'As': 2.0}",GGA,mp-27606,"['mp-927825', 'mp-911436', 'mp-927407', 'mp-504622', 'mp-27606', 'mp-1429283', 'mp-1701295', 'mp-1926129', 'mp-1597956']",7.68e-05,"{'Zr': 4.0, 'As': 8.0}",233.8421606635138,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.313706643525434e-06,7.68e-05,0,0.0003072,MP,data/source/MP/cleaned/cifs/MP-mp-27606.cif,False,,data/final/MP/graphs/As2Zr1-MP-mp-27606.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ce1Ir3,1,0.0,6.0,False,Ce6Ir18,Ce6Ir18,3.34,Heavy_fermion,True,Ce25Ir75,Ce-Ir,2,Supercon,Ce1Ir3,MP-mp-1191930,Ce6Ir18,Ce-Ir,Ce25Ir75,P 63/m m c,hexagonal,5.335040001505495,5.33504072,17.686686,data/final/MP/cifs/Ce1Ir3-MP-mp-1191930.cif,data/source/MP/raw/cifs/mp-1191930.cif,mp-1191930,0.0,,2019-01-11 22:05:11.639000,16.380449485570303,,,{'GGA': {'task_id': 'mp-1764319'}},0.0,8.84076183,520.0,-209.91387587,-8.746411494583333,{'tags': ['Cerium iridium (1/3)']},-209.91387587,-8.746411494583333,-0.6343163908333338,['bandstructure'],True,[621405],True,2021-05-12 10:58:35.561000,NM,24,4,mp-1191930,,CeIr3,"{'functional': 'PBE', 'labels': ['Ce', 'Ir'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Ir': 3.0}",GGA,mp-1191930,"['mp-1191930', 'mp-1426404', 'mp-1764319', 'mp-1630212']",0.0014385,"{'Ce': 6.0, 'Ir': 18.0}",435.9659139505879,[],NM,False,194,0,"[0.0, 0.0, 0.0, 0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",1.979741930232241e-05,0.0014385,0,0.008631,MP,data/source/MP/cleaned/cifs/MP-mp-1191930.cif,False,,data/final/MP/graphs/Ce1Ir3-MP-mp-1191930.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ge1.8La1,2,0.0476190476190475,2.0,False,Ge3.6La2,Ge4La2,1.87,Other,True,Ge64.286La35.714,Ge-La,2,Supercon,Ge1.8La1,MP-mp-19761,La2Ge4,Ge-La,Ge66.667La33.333,I 41/a m d,tetragonal,4.320984000934922,4.320984000934921,8.41484573,data/final/MP/cifs/Ge1.8La1-MP-mp-19761-synth_doped.cif,data/source/MP/raw/cifs/mp-19761.cif,mp-19761,0.0,,2014-02-21 13:34:05,6.447172399329149,10.17188/1194966,"@misc{osti_1194966,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaGe2 (SG:141) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1194966"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703381'}},0.0059020154166642,6.2456377,520.0,-32.49839164,-5.416398606666667,"{'tags': ['Lanthanum germanide (1/2)', 'Germanium lanthanum (2/1)']}",-32.49839164,-5.416398606666667,-0.6890443350000002,"['xas', 'elasticity', 'bandstructure']",True,"[636796, 636784, 57072]",True,2021-05-12 10:56:14.760000,NM,6,6,mp-19761,,LaGe2,"{'functional': 'PBE', 'labels': ['La', 'Ge_d'], 'pot_type': 'paw'}","{'La': 1.0, 'Ge': 2.0}",GGA,mp-19761,"['mp-19761', 'mp-20013', 'mp-1438339', 'mp-1703381', 'mp-1780058', 'mp-1596448']",0.0002277,"{'La': 2.0, 'Ge': 4.0}",146.3900903733194,[],NM,False,141,0,"[0, 0, 0, 0, 0, 0]",3.110866308222457e-06,0.0002277,0,0.0004554,MP,data/source/MP/cleaned/cifs/MP-mp-19761.cif,True,,data/final/MP/graphs/Ge1.8La1-MP-mp-19761-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B2Co0.1Mg0.9,3,0.0666666666666666,1.0,True,B2Co0.1Mg0.9,B2Mg1,34.5,Other,True,B66.667Co3.333Mg30,B-Co-Mg,3,Supercon,Mg0.9Co0.1B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B2Co0.1Mg0.9-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B2Co0.1Mg0.9-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Ca0.05Cu4Tm0.95O8,2,0.0066666666666666,1.0,True,Ba2Ca0.05Cu4Tm0.95O8,Ba2Cu4Tm1O8,84.8,Cuprate,True,Ba13.333Ca0.333Cu26.667Tm6.333O53.333333333333336,Ba-Ca-Cu-Tm-O,5,Supercon,Tm0.95Ca0.05Ba2Cu4O8,MP-mp-6710,Ba2Tm1Cu4O8,Ba-Cu-Tm-O,Ba13.333Cu26.667Tm6.667O53.333333333333336,C m m m,orthorhombic,3.865297,3.8869580003373287,13.86982093,data/final/MP/cifs/Ba2Ca0.05Cu4Tm0.95O8-MP-mp-6710-synth_doped.cif,data/source/MP/raw/cifs/mp-6710.cif,mp-6710,0.0,,2011-05-16 03:10:26,6.645830128925235,10.17188/1281743,"@misc{osti_1281743,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Tm(CuO2)4 (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281743"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677992'}},0.0,3.30740365,520.0,-89.79535451,-5.986356967333333,"{'tags': ['Thulium dibarium tetracopper octaoxide', 'Thulium dibarium tricopper copper(III) oxide']}",-89.79535451,-5.986356967333333,-2.066470847111112,"['xas', 'bandstructure']",True,"[78622, 75686]",True,2021-05-12 10:57:32.679000,NM,15,7,mp-6710,oxide,Ba2Tm(CuO2)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Tm_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Tm': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-6710,"['mp-1007646', 'mp-1001301', 'mp-6710', 'mp-1420256', 'mp-1677992', 'mp-1831034', 'mp-1603852']",0.0025713,"{'Ba': 2.0, 'Tm': 1.0, 'Cu': 4.0, 'O': 8.0}",206.32772996439093,[],NM,False,65,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.2462212425076202e-05,0.0025713,0,0.0025713,MP,data/source/MP/cleaned/cifs/MP-mp-6710.cif,True,,data/final/MP/graphs/Ba2Ca0.05Cu4Tm0.95O8-MP-mp-6710-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Cl0.7Hf1N1,3,0.1481481481481481,2.0,False,Cl1.4Hf2N2,Cl2Hf2N2,24.0,Other,True,Cl25.926Hf37.037N37.037,Cl-Hf-N,3,Supercon,Hf1N1Cl0.7,MP-mp-541911,Hf2N2Cl2,Cl-Hf-N,Cl33.333Hf33.333N33.333,R -3 m,trigonal,3.5823326060483773,3.5823326060483773,10.0877281,data/final/MP/cifs/Cl0.7Hf1N1-MP-mp-541911-synth_doped.cif,data/source/MP/raw/cifs/mp-541911.cif,mp-541911,2.2366,,2013-10-02 02:22:37,6.899026436060236,10.17188/1266311,"@misc{osti_1266311,
    author = ""Persson, Kristin"",
    title = ""Materials Data on HfNCl (SG:166) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1266311"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695248'}},0.0,2.49738387,520.0,-51.49727133,-8.582878554999999,{'tags': []},-51.49727133,-8.582878554999999,-2.193805076666667,"['diel', 'xas', 'bandstructure']",True,"[261541, 87795, 261539, 190382, 93741]",True,2021-05-12 10:56:47.291000,NM,6,10,mp-541911,,HfNCl,"{'functional': 'PBE', 'labels': ['Hf_pv', 'N', 'Cl'], 'pot_type': 'paw'}","{'Hf': 1.0, 'N': 1.0, 'Cl': 1.0}",GGA,mp-541911,"['mp-661970', 'mp-671324', 'mp-541911', 'mp-1077376', 'mp-1141080', 'mp-1438507', 'mp-1695248', 'mp-1802730', 'mp-1591203', 'mp-687457']",3.735e-05,"{'Hf': 2.0, 'N': 2.0, 'Cl': 2.0}",109.7312455830819,[],NM,False,166,0,"[0, 0, 0, 0, 0, 0]",6.807541425695533e-07,3.735e-05,0,7.47e-05,MP,data/source/MP/cleaned/cifs/MP-mp-541911.cif,True,,data/final/MP/graphs/Cl0.7Hf1N1-MP-mp-541911-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
C2Cl0.25I1.75Y2,3,0.0833333333333333,1.0,True,C2Cl0.25I1.75Y2,C2I2Y2,10.7,Other,True,C33.333Cl4.167I29.167Y33.333,C-Cl-I-Y,4,Supercon,Y2I1.75Cl0.25C2,MP-mp-23062,Y2C2I2,C-I-Y,C33.333I33.333Y33.333,C 1 2/m 1,monoclinic,3.914206004628932,4.15558825,10.78092902,data/final/MP/cifs/C2Cl0.25I1.75Y2-MP-mp-23062-synth_doped.cif,data/source/MP/raw/cifs/mp-23062.cif,mp-23062,0.0,,2014-02-21 06:41:11,4.900237993988967,10.17188/1199207,"@misc{osti_1199207,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YCI (SG:12) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199207"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698423'}},0.0,4.3403649,520.0,-39.59005325,-6.5983422083333325,"{'tags': ['Yttrium iodide carbide (2/2/2)', 'Yttrium carbide iodide (2/2/2)', 'High pressure experimental phase']}",-39.59005325,-6.5983422083333325,-0.9855873988888888,"['xas', 'elasticity', 'bandstructure']",True,"[400298, 153860, 153861, 153862]",True,2021-05-12 10:56:16.728000,NM,6,8,mp-23062,,YCI,"{'functional': 'PBE', 'labels': ['Y_sv', 'C', 'I'], 'pot_type': 'paw'}","{'Y': 1.0, 'C': 1.0, 'I': 1.0}",GGA,mp-23062,"['mp-918746', 'mp-919706', 'mp-905745', 'mp-23062', 'mp-1435572', 'mp-1698423', 'mp-1781217', 'mp-1592690']",0.0001098,"{'Y': 2.0, 'C': 2.0, 'I': 2.0}",154.40299200435598,[],NM,False,12,0,"[0, 0, 0, 0, 0, 0]",1.4222522319632556e-06,0.0001098,0,0.0002196,MP,data/source/MP/cleaned/cifs/MP-mp-23062.cif,True,,data/final/MP/graphs/C2Cl0.25I1.75Y2-MP-mp-23062-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
C1Mo0.9Ti0.1,3,0.0999999999999999,1.0,True,C1Mo0.9Ti0.1,C1Mo1,13.1,Other,True,C50Mo45Ti5,C-Mo-Ti,3,Supercon,Mo0.9Ti0.1C1,MP-mp-2305,Mo1C1,C-Mo,C50Mo50,P -6 m 2,hexagonal,2.835086,2.92410600478411,2.92410507,data/final/MP/cifs/C1Mo0.9Ti0.1-MP-mp-2305-synth_doped.cif,data/source/MP/raw/cifs/mp-2305.cif,mp-2305,0.0,,2011-05-12 17:49:42,8.538697979393088,10.17188/1199194,"@misc{osti_1199194,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MoC (SG:187) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199194"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668222'}},0.0010243049999996,8.62658168,520.0,-20.24014809,-10.120074045,{'tags': ['Molybdenum carbide (1/1)']},-20.24014809,-10.120074045,-0.0838621800000005,"['xas', 'elasticity', 'bandstructure']",True,"[77156, 618300]",True,2021-05-12 10:56:16.728000,NM,2,9,mp-2305,,MoC,"{'functional': 'PBE', 'labels': ['Mo_pv', 'C'], 'pot_type': 'paw'}","{'Mo': 1.0, 'C': 1.0}",GGA,mp-2305,"['mp-927633', 'mp-927239', 'mp-911174', 'mp-2305', 'mp-1116092', 'mp-1440368', 'mp-1668222', 'mp-1791400', 'mp-1638434']",0.0001977,"{'Mo': 1.0, 'C': 1.0}",20.99340614335182,[],NM,False,187,0,"[0, 0]",9.417242664197564e-06,0.0001977,0,0.0001977,MP,data/source/MP/cleaned/cifs/MP-mp-2305.cif,True,,data/final/MP/graphs/C1Mo0.9Ti0.1-MP-mp-2305-synth_doped.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Ca0.01Cu1Y0.99O2.65,3,0.0602150537634408,1.0,True,Ca0.01Cu1Y0.99O2.65,Cu1Y1O3,0.0,Cuprate,True,Ca0.215Cu21.505Y21.29O56.98924731182795,Ca-Cu-Y-O,4,Supercon,Y0.99Ca0.01Cu1O2.65,MP-mvc-11697,Y1Cu1O3,Cu-Y-O,Cu20Y20O60,P m -3 m,cubic,3.782154,3.782154,3.782154,data/final/MP/cifs/Ca0.01Cu1Y0.99O2.65-MP-mvc-11697-synth_doped.cif,data/source/MP/raw/cifs/mvc-11697.cif,mvc-11697,0.0,,2014-02-03 16:44:08,6.15230194191815,10.17188/1318302,"@misc{osti_1318302,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YCuO3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1318302"",
    place = ""United States"",
    year = ""2014"",
    month = ""9"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1767057'}},0.2224574458068184,5.28242166,520.0,-34.43613767,-6.887227534,{'tags': []},-34.43613767,-6.887227534,-2.217515374333334,"['bandstructure', 'elasticity']",True,[],True,2021-05-12 10:56:37.246000,NM,5,5,mvc-11697,oxide,YCuO3,"{'functional': 'PBE', 'labels': ['Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Y': 1.0, 'Cu': 1.0, 'O': 3.0}",GGA,mvc-11697,"['mvc-11697', 'mp-1432347', 'mp-1767057', 'mp-1792243', 'mp-1615717']",0.0007474,"{'Y': 1.0, 'Cu': 1.0, 'O': 3.0}",54.10253626517338,[],NM,False,221,0,"[0, 0, 0, 0, 0]",1.3814509477647404e-05,0.0007474,0,0.0007474,MP,data/source/MP/cleaned/cifs/MP-mvc-11697.cif,True,,data/final/MP/graphs/Ca0.01Cu1Y0.99O2.65-MP-mvc-11697-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Be13Th0.019U0.981,2,0.0027142857142857,2.0,False,Be26Th0.038U1.962,Be26U2,0.48,Heavy_fermion,True,Be92.857Th0.136U7.007,Be-Th-U,3,Supercon,Be13U0.9807Th0.0193,MP-mp-1163,U2Be26,Be-U,Be92.857U7.143,F m -3 c,cubic,7.174675929999999,7.174675929999999,7.174675929999999,data/final/MP/cifs/Be13Th0.019U0.981-MP-mp-1163-synth_doped.cif,data/source/MP/raw/cifs/mp-1163.cif,mp-1163,0.0,,2011-05-15 13:39:09,4.516943134220159,10.17188/1188115,"@misc{osti_1188115,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UBe13 (SG:226) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188115"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1676276'}},0.0,5.60901004,520.0,-121.44122023,-4.337186436785714,"{'tags': ['Uranium beryllium (1/13)', 'Beryllium uranium (13/1)']}",-121.44122023,-4.337186436785714,-0.0583452042857146,"['xas', 'bandstructure']",True,"[616470, 58748, 616481, 58747, 58749, 659562, 107528, 600563, 58750, 616488, 58751]",True,2021-05-12 10:56:51.169000,NM,28,8,mp-1163,,UBe13,"{'functional': 'PBE', 'labels': ['U', 'Be_sv'], 'pot_type': 'paw'}","{'U': 1.0, 'Be': 13.0}",GGA,mp-1163,"['mp-1163', 'mp-906858', 'mp-920459', 'mp-921486', 'mp-1381018', 'mp-1676276', 'mp-1775695', 'mp-1603627']",0.0460573,"{'U': 2.0, 'Be': 26.0}",261.15110606061,[],NM,False,226,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0003527252914587,0.0460573,0,0.0921146,MP,data/source/MP/cleaned/cifs/MP-mp-1163.cif,True,,data/final/MP/graphs/Be13Th0.019U0.981-MP-mp-1163-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Fe2Hf1,1,0.0,2.0,False,Fe4Hf2,Fe4Hf2,0.0,Other,True,Fe66.667Hf33.333,Fe-Hf,2,Supercon,Fe2Hf1,MP-mp-333,Hf2Fe4,Fe-Hf,Fe66.667Hf33.333,F d -3 m,cubic,4.945777770000001,4.94577777,4.94577777,data/final/MP/cifs/Fe2Hf1-MP-mp-333.cif,data/source/MP/raw/cifs/mp-333.cif,mp-333,0.0,,2011-05-13 19:14:49,11.265689378343376,10.17188/1206534,"@misc{osti_1206534,
    author = ""Persson, Kristin"",
    title = ""Materials Data on HfFe2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1206534"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703861'}},0.0,5.26482827,520.0,-55.86844178,-9.311406963333331,"{'tags': ['Iron hafnium (2/1)', 'Hafnium iron (1/2)']}",-55.86844178,-9.311406963333331,-0.3456717133333337,"['xas', 'elasticity', 'bandstructure']",True,"[632252, 290387, 103498]",True,2021-05-12 10:56:20.740000,FiM,6,9,mp-333,,HfFe2,"{'functional': 'PBE', 'labels': ['Hf_pv', 'Fe_pv'], 'pot_type': 'paw'}","{'Hf': 1.0, 'Fe': 2.0}",GGA,mp-333,"['mp-912406', 'mp-928387', 'mp-928905', 'mp-333', 'mp-1077143', 'mp-1438099', 'mp-1703861', 'mp-1801899', 'mp-1590890']",3.1935853,"{'Hf': 2.0, 'Fe': 4.0}",85.54385091999491,[],FiM,True,227,2,"[-0.4, -0.4, 1.9, 1.9, 1.9, 1.9]",0.0746654555682046,3.1935853,6,6.3871706,MP,data/source/MP/cleaned/cifs/MP-mp-333.cif,False,,data/final/MP/graphs/Fe2Hf1-MP-mp-333.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
C1Nb0.5Ta0.5,1,0.0,2.0,False,C2Nb1Ta1,C2Nb1Ta1,11.1,Other,True,C50Nb25Ta25,C-Nb-Ta,3,Supercon,Ta0.5Nb0.5C1,MP-mp-1217924,Ta1Nb1C2,C-Nb-Ta,C50Nb25Ta25,R -3 m,trigonal,3.1781941739093966,3.1781941739093966,5.51224639,data/final/MP/cifs/C1Nb0.5Ta0.5-MP-mp-1217924.cif,data/source/MP/raw/cifs/mp-1217924.cif,mp-1217924,0.0,,2019-01-12 19:10:46.083000,10.87844869753823,,,{'GGA': {'task_id': 'mp-1766608'}},0.0169729379166678,7.79207434,520.0,-42.4972947,-10.624323675,{'tags': []},-42.4972947,-10.624323675,-0.5211626574999997,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,4,5,mp-1217924,,TaNbC2,"{'functional': 'PBE', 'labels': ['Ta_pv', 'Nb_pv', 'C'], 'pot_type': 'paw'}","{'Ta': 1.0, 'Nb': 1.0, 'C': 2.0}",GGA,mp-1217924,"['mp-1217924', 'mp-1435854', 'mp-1766608', 'mp-1791050', 'mp-1611354']",7.94e-05,"{'Ta': 1.0, 'Nb': 1.0, 'C': 2.0}",45.46918261711284,[],NM,False,166,0,"[0, 0, 0, 0]",1.746237680774075e-06,7.94e-05,0,7.94e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1217924.cif,False,,data/final/MP/graphs/C1Nb0.5Ta0.5-MP-mp-1217924.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ag0.15Sn0.85Te1,3,0.15,1.0,True,Ag0.15Sn0.85Te1,Sn1Te1,2.15,Other,True,Ag7.5Sn42.5Te50,Ag-Sn-Te,3,Supercon,Sn0.85Ag0.15Te1,MP-mp-1883,Sn1Te1,Sn-Te,Sn50Te50,F m -3 m,cubic,4.53766968,4.53766968,4.53766968,data/final/MP/cifs/Ag0.15Sn0.85Te1-MP-mp-1883-synth_doped.cif,data/source/MP/raw/cifs/mp-1883.cif,mp-1883,0.6623999999999999,,2011-05-12 18:43:07,6.19081042904143,10.17188/1193534,"@misc{osti_1193534,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SnTe (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1193534"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686906'}},0.0,6.06645058,520.0,-7.72519638,-3.86259819,"{'tags': ['Tin telluride (1/1)', 'Tin telluride']}",-7.72519638,-3.86259819,-0.4971617975000004,"['eos', 'elasticity', 'bandstructure', 'xas']",True,"[52489, 652760, 652744, 652756, 652761, 600865, 652763, 652745, 652742, 604177, 600813, 652741, 601065, 652750, 652755, 652753, 652751, 652749, 652752, 600136, 652754, 652746, 652759]",True,2021-05-12 10:56:14.760000,NM,2,9,mp-1883,,SnTe,"{'functional': 'PBE', 'labels': ['Sn_d', 'Te'], 'pot_type': 'paw'}","{'Sn': 1.0, 'Te': 1.0}",GGA,mp-1883,"['mp-663289', 'mp-655511', 'mp-657302', 'mp-1883', 'mp-1440781', 'mp-1686906', 'mp-1784332', 'mp-1596407', 'mp-1596974']",0.0,"{'Sn': 1.0, 'Te': 1.0}",66.06685541129963,[],NM,False,225,0,"[0, 0]",0.0,0.0,0,0.0,MP,data/source/MP/cleaned/cifs/MP-mp-1883.cif,True,,data/final/MP/graphs/Ag0.15Sn0.85Te1-MP-mp-1883-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
B0.1C2.9Y2,2,0.04,4.0,False,B0.4C11.6Y8,C12Y8,16.4,Other,True,B2C58Y40,B-C-Y,3,Supercon,Y2C2.9B0.1,MP-mp-1695,Y8C12,C-Y,C60Y40,I -4 3 d,cubic,7.157130121586623,7.15713012,7.157130119999999,data/final/MP/cifs/B0.1C2.9Y2-MP-mp-1695-synth_doped.cif,data/source/MP/raw/cifs/mp-1695.cif,mp-1695,0.0,,2011-05-15 19:04:09,5.032814278610675,10.17188/1192250,"@misc{osti_1192250,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Y2C3 (SG:220) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1192250"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1669276'}},0.0442951846600028,5.37066524,520.0,-167.58612106,-8.379306053,{'tags': ['Yttrium carbide (2/3)']},-167.58612106,-8.379306053,-0.256649187666666,"['xas', 'elasticity', 'bandstructure']",True,"[155382, 77572, 619114, 601153, 155383]",True,2021-05-12 10:56:14.760000,NM,20,8,mp-1695,,Y2C3,"{'functional': 'PBE', 'labels': ['Y_sv', 'C'], 'pot_type': 'paw'}","{'Y': 2.0, 'C': 3.0}",GGA,mp-1695,"['mp-927691', 'mp-927238', 'mp-911194', 'mp-1695', 'mp-1425550', 'mp-1669276', 'mp-1872240', 'mp-1598231']",0.0001762,"{'Y': 8.0, 'C': 12.0}",282.22458798795367,[],NM,False,220,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.497301900676646e-06,0.0001762,0,0.0007048,MP,data/source/MP/cleaned/cifs/MP-mp-1695.cif,True,,data/final/MP/graphs/B0.1C2.9Y2-MP-mp-1695-synth_doped.json,0,True,-43m,5,0,0,0,0,0,0,0,0,1,0,1.0,False
Ge12Pt4Th1,1,0.0,1.0,True,Ge12Pt4Th1,Ge12Pt4Th1,4.71,Other,True,Ge70.588Pt23.529Th5.882,Ge-Pt-Th,3,Supercon,Th1Pt4Ge12,MP-mp-1208358,Th1Ge12Pt4,Ge-Pt-Th,Ge70.588Pt23.529Th5.882,I m -3,cubic,7.560178341675973,7.560178340000001,7.56017834,data/final/MP/cifs/Ge12Pt4Th1-MP-mp-1208358.cif,data/source/MP/raw/cifs/mp-1208358.cif,mp-1208358,0.0,,2019-01-12 11:17:24.378000,9.405204155764055,,,{'GGA': {'task_id': 'mp-1669332'}},0.0038559641176449,4.56436714,520.0,-93.7728771,-5.516051594117648,"{'tags': ['LaFe4P12', 'Thorium platinum germanide (1/4/12)', 'ThPt4Ge12']}",-93.7728771,-5.516051594117648,-0.3881796323529418,['bandstructure'],True,[189911],True,2021-05-12 10:58:39.488000,NM,17,5,mp-1208358,,Th(Ge3Pt)4,"{'functional': 'PBE', 'labels': ['Th', 'Ge_d', 'Pt'], 'pot_type': 'paw'}","{'Th': 1.0, 'Ge': 12.0, 'Pt': 4.0}",GGA,mp-1208358,"['mp-1208358', 'mp-1425603', 'mp-1669332', 'mp-1811963', 'mp-1637877']",0.0005041,"{'Th': 1.0, 'Ge': 12.0, 'Pt': 4.0}",332.63981497934697,[],NM,False,204,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.5154529833757232e-06,0.0005041,0,0.0005041,MP,data/source/MP/cleaned/cifs/MP-mp-1208358.cif,False,,data/final/MP/graphs/Ge12Pt4Th1-MP-mp-1208358.json,0,True,m-3,2,0,0,0,0,0,0,0,0,1,0,1.0,False
Be13Lu1,1,0.0,2.0,False,Be26Lu2,Be26Lu2,0.0,Other,True,Be92.857Lu7.143,Be-Lu,2,Supercon,Be13Lu1,MP-mp-976039,Lu2Be26,Be-Lu,Be92.857Lu7.143,F m -3 c,cubic,7.14846348,7.148463479999999,7.148463479999999,data/final/MP/cifs/Be13Lu1-MP-mp-976039.cif,data/source/MP/raw/cifs/mp-976039.cif,mp-976039,0.0,,2015-09-17 13:38:35,3.755997136916299,10.17188/1314941,"@misc{osti_1314941,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LuBe13 (SG:226) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1314941"",
    place = ""United States"",
    year = ""2016"",
    month = ""8"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686355'}},0.0,4.03167721,520.0,-111.33919841,-3.9763999432142856,{'tags': ['Beryllium lutetium (13/1)']},-111.33919841,-3.9763999432142856,-0.1811629600000002,"['xas', 'bandstructure']",True,"[616323, 616321]",True,2021-05-12 10:57:55.580000,NM,28,6,mp-976039,,LuBe13,"{'functional': 'PBE', 'labels': ['Lu_3', 'Be_sv'], 'pot_type': 'paw'}","{'Lu': 1.0, 'Be': 13.0}",GGA,mp-976039,"['mp-1005294', 'mp-1010827', 'mp-976039', 'mp-1686355', 'mp-1777887', 'mp-1012822']",0.00088675,"{'Lu': 2.0, 'Be': 26.0}",258.2992291554738,[],NM,False,226,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.866067722302439e-06,0.00088675,0,0.0017735,MP,data/source/MP/cleaned/cifs/MP-mp-976039.cif,False,,data/final/MP/graphs/Be13Lu1-MP-mp-976039.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Be5Pd1,1,0.0,1.0,True,Be5Pd1,Be5Pd1,0.0,Other,True,Be83.333Pd16.667,Be-Pd,2,Supercon,Be5Pd1,MP-mp-650,Be5Pd1,Be-Pd,Be83.333Pd16.667,F -4 3 m,cubic,4.23742931,4.23742931,4.23742931,data/final/MP/cifs/Be5Pd1-MP-mp-650.cif,data/source/MP/raw/cifs/mp-650.cif,mp-650,0.0,,2011-05-12 20:15:00,4.675355101854835,10.17188/1280938,"@misc{osti_1280938,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Be5Pd (SG:216) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1280938"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700496'}},0.0,5.16613157,520.0,-25.76899779,-4.294832965,{'tags': ['Beryllium palladium (5/1)']},-25.76899779,-4.294832965,-0.3153419424999999,"['xas', 'elasticity', 'bandstructure']",True,"[616387, 58729]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-650,,Be5Pd,"{'functional': 'PBE', 'labels': ['Be_sv', 'Pd'], 'pot_type': 'paw'}","{'Be': 5.0, 'Pd': 1.0}",GGA,mp-650,"['mp-650', 'mp-912108', 'mp-928185', 'mp-928714', 'mp-1438098', 'mp-1700496', 'mp-1794494', 'mp-1592981']",0.0008144,"{'Be': 5.0, 'Pd': 1.0}",53.80125432597112,[],NM,False,216,0,"[0, 0, 0, 0, 0, 0]",1.513719355065055e-05,0.0008144,0,0.0008144,MP,data/source/MP/cleaned/cifs/MP-mp-650.cif,False,,data/final/MP/graphs/Be5Pd1-MP-mp-650.json,0,True,-43m,5,0,0,0,0,0,0,0,0,0,1,1.0,False
Os2Y1,1,0.0,4.0,False,Os8Y4,Os8Y4,4.7,Other,True,Os66.667Y33.333,Os-Y,2,Supercon,Os2Y1,MP-mp-570670,Y4Os8,Os-Y,Os66.667Y33.333,P 63/m m c,hexagonal,5.334591995296273,5.33459183,8.843562,data/final/MP/cifs/Os2Y1-MP-mp-570670.cif,data/source/MP/raw/cifs/mp-570670.cif,mp-570670,0.0,,2014-02-24 18:38:31,14.304092818740637,10.17188/1275847,"@misc{osti_1275847,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YOs2 (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1275847"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697828'}},0.0,6.23429816,520.0,-119.23726327,-9.936438605833333,"{'tags': ['Osmium yttrium (2/1)', 'Yttrium osmium (1/2)']}",-119.23726327,-9.936438605833333,-0.2960373980555554,"['xas', 'elasticity', 'bandstructure']",True,"[647871, 150518]",True,2021-05-12 10:56:27.046000,NM,12,9,mp-570670,,YOs2,"{'functional': 'PBE', 'labels': ['Y_sv', 'Os_pv'], 'pot_type': 'paw'}","{'Y': 1.0, 'Os': 2.0}",GGA,mp-570670,"['mp-914502', 'mp-977896', 'mp-570670', 'mp-1095597', 'mp-1433243', 'mp-1697828', 'mp-1833303', 'mp-1005329', 'mp-1601801']",0.00303965,"{'Y': 4.0, 'Os': 8.0}",217.951698252902,[],NM,False,194,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",5.578575481385637e-05,0.00303965,0,0.0121586,MP,data/source/MP/cleaned/cifs/MP-mp-570670.cif,False,,data/final/MP/graphs/Os2Y1-MP-mp-570670.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Cu3Sb1,1,0.0,2.0,False,Cu6Sb2,Cu6Sb2,0.9205,Other,True,Cu75Sb25,Cu-Sb,2,Supercon,Cu3Sb1,MP-mp-20900,Cu6Sb2,Cu-Sb,Cu75Sb25,P m m n,orthorhombic,4.343706,4.98255,5.49945,data/final/MP/cifs/Cu3Sb1-MP-mp-20900.cif,data/source/MP/raw/cifs/mp-20900.cif,mp-20900,0.0,,2014-02-22 13:39:40,8.716778127244357,10.17188/1196096,"@misc{osti_1196096,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Cu3Sb (SG:59) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196096"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672646'}},0.0630264600000014,8.64178587,520.0,-32.20928675,-4.02616084375,"{'tags': ['Copper antimonide (3/1)', 'Antimony copper (1/3)']}",-32.20928675,-4.02616084375,0.0324944687500003,"['xas', 'elasticity', 'bandstructure']",True,"[628990, 44479, 628991, 628985]",True,2021-05-12 10:56:14.760000,NM,8,8,mp-20900,,Cu3Sb,"{'functional': 'PBE', 'labels': ['Cu_pv', 'Sb'], 'pot_type': 'paw'}","{'Cu': 3.0, 'Sb': 1.0}",GGA,mp-20900,"['mp-926138', 'mp-925728', 'mp-910273', 'mp-20900', 'mp-1300481', 'mp-1672646', 'mp-1803603', 'mp-1592200']",0.00106375,"{'Cu': 6.0, 'Sb': 2.0}",119.02312431386834,[],NM,False,59,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.7874677817981862e-05,0.00106375,0,0.0021275,MP,data/source/MP/cleaned/cifs/MP-mp-20900.cif,False,,data/final/MP/graphs/Cu3Sb1-MP-mp-20900.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ce0.12Cu1Sm1.88O4,2,0.0342857142857143,1.0,True,Ce0.12Cu1Sm1.88O4,Cu1Sm2O4,3.9,Cuprate,True,Ce1.714Cu14.286Sm26.857O57.142857142857146,Ce-Cu-Sm-O,4,Supercon,Sm1.88Ce0.12Cu1O4,MP-mp-4210,Sm2Cu1O4,Cu-Sm-O,Cu14.286Sm28.571O57.142857142857146,I 4/m m m,tetragonal,3.936481999770292,3.936481999770292,6.66682973,data/final/MP/cifs/Ce0.12Cu1Sm1.88O4-MP-mp-4210-synth_doped.cif,data/source/MP/raw/cifs/mp-4210.cif,mp-4210,0.0,,2011-05-13 10:20:22,7.575626216473968,10.17188/1207966,"@misc{osti_1207966,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sm2CuO4 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207966"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-670158'}},0.0084157301785579,3.24265454,520.0,-51.71666507,-7.38809501,"{'tags': ['Samarium cuprate', 'Disamarium copper oxide', 'Disamarium copper tetraoxide']}",-51.71666507,-7.38809501,-3.0194917299999995,"['xas', 'elasticity', 'bandstructure']",True,"[261378, 72243, 71182, 95371, 261377]",True,2021-05-12 10:56:20.740000,NM,7,8,mp-4210,oxide,Sm2CuO4,"{'functional': 'PBE', 'labels': ['Sm_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sm': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-4210,"['mp-660482', 'mp-670158', 'mp-4210', 'mp-1412888', 'mp-1702500', 'mp-1798108', 'mp-1589420', 'mp-688388']",0.0004776,"{'Sm': 2.0, 'Cu': 1.0, 'O': 4.0}",93.8732216032902,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",5.087712894507291e-06,0.0004776,0,0.0004776,MP,data/source/MP/cleaned/cifs/MP-mp-4210.cif,True,,data/final/MP/graphs/Ce0.12Cu1Sm1.88O4-MP-mp-4210-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ba2Cu3La0.6Pr0.4O7,2,0.0153846153846153,2.0,False,Ba4Cu6La1.2Pr0.8O14,Ba4Cu6La1Pr1O14,54.8,Cuprate,True,Ba15.385Cu23.077La4.615Pr3.077O53.84615384615385,Ba-Cu-La-Pr-O,5,Supercon,La0.6Pr0.4Ba2Cu3O7,MP-mp-1228253,Ba4La1Pr1Cu6O14,Ba-Cu-La-Pr-O,Ba15.385Cu23.077La3.846Pr3.846O53.84615384615385,P m m m,orthorhombic,3.905432,3.977981,23.854019,data/final/MP/cifs/Ba2Cu3La0.6Pr0.4O7-MP-mp-1228253-synth_doped.cif,data/source/MP/raw/cifs/mp-1228253.cif,mp-1228253,0.0,,2019-01-13 03:59:16.220000,6.427211818969123,,,{'GGA': {'task_id': 'mp-1681296'}},0.0269668878044804,3.53296398,520.0,-157.72373695,-6.066297574999999,{'tags': []},-157.72373695,-6.066297574999999,-2.1570097419230763,[],False,[],True,2021-05-12 11:00:59.151000,NM,26,4,mp-1228253,oxide,Ba4LaPr(Cu3O7)2,"{'functional': 'PBE', 'labels': ['Ba_sv', 'La', 'Pr_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 4.0, 'La': 1.0, 'Pr': 1.0, 'Cu': 6.0, 'O': 14.0}",GGA,mp-1228253,"['mp-1228253', 'mp-1346084', 'mp-1681296', 'mp-1844089']",0.0009849,"{'Ba': 4.0, 'La': 1.0, 'Pr': 1.0, 'Cu': 6.0, 'O': 14.0}",370.589700999212,[],NM,False,47,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.657656155431298e-06,0.0009849,0,0.0009849,MP,data/source/MP/cleaned/cifs/MP-mp-1228253.cif,True,,data/final/MP/graphs/Ba2Cu3La0.6Pr0.4O7-MP-mp-1228253-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
As2Ba0.68Fe2Na0.32,3,0.072,2.0,False,As4Ba1.36Fe4Na0.64,As4Ba1Fe4Na1,23.8,Ferrite,True,As40Ba13.6Fe40Na6.4,As-Ba-Fe-Na,4,Supercon,Ba0.68Na0.32Fe2As2,MP-mp-1227868,Ba1Na1Fe4As4,As-Ba-Fe-Na,As40Ba10Fe40Na10,C m m m,orthorhombic,5.458732000131759,5.462821,6.96934908,data/final/MP/cifs/As2Ba0.68Fe2Na0.32-MP-mp-1227868-synth_doped.cif,data/source/MP/raw/cifs/mp-1227868.cif,mp-1227868,0.0,,2019-01-13 03:39:01.428000,5.934244973483095,,,{'GGA': {'task_id': 'mp-1731957'}},0.0195872770000011,4.30353274,520.0,-59.62394279,-5.962394279,{'tags': []},-59.62394279,-5.962394279,-0.3865939246551718,[],False,[],True,2021-05-12 11:00:59.151000,FM,10,4,mp-1227868,,BaNa(FeAs)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Na_pv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Na': 1.0, 'Fe': 4.0, 'As': 4.0}",GGA,mp-1227868,"['mp-1227868', 'mp-1396889', 'mp-1731957', 'mp-1827521']",0.9949323,"{'Ba': 1.0, 'Na': 1.0, 'Fe': 4.0, 'As': 4.0}",191.22642477974767,[],FM,True,65,1,"[0.0, 0.0, 0.3, 0.3, 0.3, 0.3, 0.0, 0.0, 0.0, 0.0]",0.0052029017493055,0.9949323,4,0.9949323,MP,data/source/MP/cleaned/cifs/MP-mp-1227868.cif,True,,data/final/MP/graphs/As2Ba0.68Fe2Na0.32-MP-mp-1227868-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
As2Co0.1Fe1.9Sr1,2,0.04,1.0,True,As2Co0.1Fe1.9Sr1,As2Fe2Sr1,0.0,Ferrite,True,As40Co2Fe38Sr20,As-Co-Fe-Sr,4,Supercon,Sr1Fe1.9Co0.1As2,MP-mp-4488,Sr1Fe2As2,As-Fe-Sr,As40Fe40Sr20,I 4/m m m,tetragonal,3.9729799997357778,3.9729799997357778,6.45523327,data/final/MP/cifs/As2Co0.1Fe1.9Sr1-MP-mp-4488-synth_doped.cif,data/source/MP/raw/cifs/mp-4488.cif,mp-4488,0.0,,2011-05-13 03:37:13,6.319998834487784,10.17188/1208187,"@misc{osti_1208187,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr(FeAs)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208187"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672865'}},0.0,5.13397273,520.0,-30.61898897,-6.123797794,"{'tags': ['Strontium diiron arsenide - HT', 'Strontium diiron arsenide', 'Strontium diiron diarsenide', 'Iron strontium arsenide (2/1/2)', 'Strontium diiron arsenide - LT']}",-30.61898897,-6.123797794,-0.5342483613333335,"['xas', 'elasticity', 'bandstructure']",True,"[182330, 181993, 610527, 163209, 163208, 163869]",True,2021-05-12 10:56:20.740000,NM,5,8,mp-4488,,Sr(FeAs)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Fe': 2.0, 'As': 2.0}",GGA,mp-4488,"['mp-906356', 'mp-920135', 'mp-919110', 'mp-4488', 'mp-1439153', 'mp-1672865', 'mp-1873948', 'mp-1592272']",0.0029206,"{'Sr': 1.0, 'Fe': 2.0, 'As': 2.0}",91.7377588211838,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",3.183640016422098e-05,0.0029206,0,0.0029206,MP,data/source/MP/cleaned/cifs/MP-mp-4488.cif,True,,data/final/MP/graphs/As2Co0.1Fe1.9Sr1-MP-mp-4488-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Bi2Cu2Sr2Y1O8.53,2,0.0318523288259282,1.8756465416178196,False,Bi3.751Cu3.751Sr3.751Y1.876O16,Bi4Cu4Sr4Y2O16,0.0,Cuprate,True,Bi12.878Cu12.878Sr12.878Y6.439O54.92594977462975,Bi-Cu-Sr-Y-O,5,Supercon,Bi2Sr2Y1Cu2O8.53,MP-mp-1208863,Sr4Y2Cu4Bi4O16,Bi-Cu-Sr-Y-O,Bi13.333Cu13.333Sr13.333Y6.667O53.333333333333336,C c c m,orthorhombic,5.350205,5.505885998177413,15.59802851,data/final/MP/cifs/Bi2Cu2Sr2Y1O8.53-MP-mp-1208863-synth_doped.cif,data/source/MP/raw/cifs/mp-1208863.cif,mp-1208863,0.0,,2019-01-12 11:41:58.514000,6.881971262733002,,,{'GGA': {'task_id': 'mp-1680775'}},0.0913935707916726,5.2812548,520.0,-185.05210166,-6.1684033886666665,"{'tags': ['high-Tc cuprate family', 'Sr2(Sr0.4Y0.6)Cu2Bi2O8.7', 'Sr2.4Cu2Y0.6Bi2O8.7']}",-185.05210166,-6.1684033886666665,-2.174294854,[],False,[],True,2021-05-12 11:00:21.818000,FM,30,4,mp-1208863,oxide,Sr2YCu2(BiO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Y_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Y': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",GGA,mp-1208863,"['mp-1208863', 'mp-1359079', 'mp-1680775', 'mp-1819085']",0.1409948,"{'Sr': 4.0, 'Y': 2.0, 'Cu': 4.0, 'Bi': 4.0, 'O': 16.0}",452.2677998757687,[],FM,True,66,1,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.1, 0.1, 0.1, 0.1, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0006235013858547,0.1409948,4,0.2819896,MP,data/source/MP/cleaned/cifs/MP-mp-1208863.cif,True,,data/final/MP/graphs/Bi2Cu2Sr2Y1O8.53-MP-mp-1208863-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Li1.25Ti1.75O4,3,0.0714285714285714,2.0,False,Li2.5Ti3.5O8,Li2Ti4O8,0.0,Oxide,True,Li17.857Ti25O57.142857142857146,Li-Ti-O,3,Supercon,Li1.25Ti1.75O4,MP-mp-5670,Li2Ti4O8,Li-Ti-O,Li14.286Ti28.571O57.142857142857146,F d -3 m,cubic,5.986032260000001,5.98603226,5.98603226,data/final/MP/cifs/Li1.25Ti1.75O4-MP-mp-5670-synth_doped.cif,data/source/MP/raw/cifs/mp-5670.cif,mp-5670,0.0,,2011-05-14 11:10:22,3.649565337909552,10.17188/1273637,"@misc{osti_1273637,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LiTi2O4 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1273637"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699404'}},0.0,5.03116805,520.0,-114.93444733,-8.209603380714286,"{'tags': ['Lithium titanium oxide (1/2/4)', 'Lithium titanium(III) titanium(IV) oxide', 'Lithium titanium(III) titanium oxide', 'Lithium titanium titanium(III) oxide', 'Lithium titano(III)titanate', 'Spinel-(Li,Ti)']}",-114.93444733,-8.209603380714286,-3.2462103921428564,"['bandstructure', 'elasticity']",True,"[72859, 78482, 154982, 81329, 15789, 48127]",True,2021-05-12 10:56:22.739000,NM,14,7,mp-5670,oxide,LiTi2O4,"{'functional': 'PBE', 'labels': ['Li_sv', 'Ti_pv', 'O'], 'pot_type': 'paw'}","{'Li': 1.0, 'Ti': 2.0, 'O': 4.0}",GGA,mp-5670,"['mp-923613', 'mp-922835', 'mp-908534', 'mp-5670', 'mp-1418091', 'mp-1699404', 'mp-1787951']",0.0521081,"{'Li': 2.0, 'Ti': 4.0, 'O': 8.0}",151.67086379131675,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0006871207652868,0.0521081,0,0.1042162,MP,data/source/MP/cleaned/cifs/MP-mp-5670.cif,True,,data/final/MP/graphs/Li1.25Ti1.75O4-MP-mp-5670-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
As1Fe0.85Ir0.15Sm1O1,3,0.075,2.0,False,As2Fe1.7Ir0.3Sm2O2,As2Fe2Sm2O2,16.0,Ferrite,True,As25Fe21.25Ir3.75Sm25O25,As-Fe-Ir-Sm-O,5,Supercon,Sm1Fe0.85Ir0.15As1O1,MP-mp-20349,Sm2Fe2As2O2,As-Fe-Sm-O,As25Fe25Sm25O25,P 4/n m m,tetragonal,4.026492,4.026492,9.046755,data/final/MP/cifs/As1Fe0.85Ir0.15Sm1O1-MP-mp-20349-synth_doped.cif,data/source/MP/raw/cifs/mp-20349.cif,mp-20349,0.0,,2014-02-19 11:24:42,6.727802583283198,,,{'GGA+U': {'task_id': 'mp-1695938'}},0.3015723809374986,3.77685593,520.0,-52.73407138,-6.5917589225,{'tags': ['Samarium iron arsenic oxide (1/1/1/1)']},-52.73407138,-6.5917589225,-1.6285904237499995,"['xas', 'elasticity', 'bandstructure']",True,"[236652, 236653, 422002, 163457, 163458]",True,2021-05-12 10:56:16.728000,FM,8,10,mp-20349,oxide,SmFeAsO,"{'functional': 'PBE', 'labels': ['Sm_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Sm': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-20349,"['mp-24944', 'mp-1078897', 'mp-1079866', 'mp-1173321', 'mp-20349', 'mp-1425472', 'mp-1695938', 'mp-1772503', 'mp-1789694', 'mp-1588381']",3.75729895,"{'Sm': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",146.67176231613362,[],FM,True,129,1,"[0.0, 0.0, 3.5, 3.5, -0.0, -0.0, -0.0, -0.0]",0.0512341147425717,3.75729895,2,7.5145979,MP,data/source/MP/cleaned/cifs/MP-mp-20349.cif,True,,data/final/MP/graphs/As1Fe0.85Ir0.15Sm1O1-MP-mp-20349-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Be13Th0.035U0.965,2,0.005,2.0,False,Be26Th0.07U1.93,Be26U2,0.55,Heavy_fermion,True,Be92.857Th0.25U6.893,Be-Th-U,3,Supercon,Be13U0.9645Th0.0355,MP-mp-1163,U2Be26,Be-U,Be92.857U7.143,F m -3 c,cubic,7.174675929999999,7.174675929999999,7.174675929999999,data/final/MP/cifs/Be13Th0.035U0.965-MP-mp-1163-synth_doped.cif,data/source/MP/raw/cifs/mp-1163.cif,mp-1163,0.0,,2011-05-15 13:39:09,4.516943134220159,10.17188/1188115,"@misc{osti_1188115,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UBe13 (SG:226) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188115"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1676276'}},0.0,5.60901004,520.0,-121.44122023,-4.337186436785714,"{'tags': ['Uranium beryllium (1/13)', 'Beryllium uranium (13/1)']}",-121.44122023,-4.337186436785714,-0.0583452042857146,"['xas', 'bandstructure']",True,"[616470, 58748, 616481, 58747, 58749, 659562, 107528, 600563, 58750, 616488, 58751]",True,2021-05-12 10:56:51.169000,NM,28,8,mp-1163,,UBe13,"{'functional': 'PBE', 'labels': ['U', 'Be_sv'], 'pot_type': 'paw'}","{'U': 1.0, 'Be': 13.0}",GGA,mp-1163,"['mp-1163', 'mp-906858', 'mp-920459', 'mp-921486', 'mp-1381018', 'mp-1676276', 'mp-1775695', 'mp-1603627']",0.0460573,"{'U': 2.0, 'Be': 26.0}",261.15110606061,[],NM,False,226,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0003527252914587,0.0460573,0,0.0921146,MP,data/source/MP/cleaned/cifs/MP-mp-1163.cif,True,,data/final/MP/graphs/Be13Th0.035U0.965-MP-mp-1163-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Si2Ta5,3,0.0952380952380952,0.8,True,Si1.6Ta4,Si2Ta4,0.0,Other,True,Si28.571Ta71.429,Si-Ta,2,Supercon,Si2Ta5,MP-mp-2783,Ta4Si2,Si-Ta,Si33.333Ta66.667,I 4/m c m,tetragonal,5.064350521166502,5.06435052,5.064350519999999,data/final/MP/cifs/Si2Ta5-MP-mp-2783-synth_doped.cif,data/source/MP/raw/cifs/mp-2783.cif,mp-2783,0.0,,2011-05-13 04:15:18,13.2745948473238,10.17188/1202002,"@misc{osti_1202002,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ta2Si (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1202002"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697009'}},0.0016131517708348,7.45958288,520.0,-61.62053009,-10.270088348333331,{'tags': ['Tantalum silicide (2/1)']},-61.62053009,-10.270088348333331,-0.5327985883333343,"['xas', 'elasticity', 'bandstructure']",True,"[652302, 76160, 42526]",True,2021-05-12 10:56:18.721000,NM,6,16,mp-2783,,Ta2Si,"{'functional': 'PBE', 'labels': ['Ta_pv', 'Si'], 'pot_type': 'paw'}","{'Ta': 2.0, 'Si': 1.0}",GGA,mp-2783,"['mp-924868', 'mp-909837', 'mp-925426', 'mp-2783', 'mp-1072341', 'mp-1072298', 'mp-1072369', 'mp-1138632', 'mp-1146351', 'mp-1258626', 'mp-1263104', 'mp-1441064', 'mp-1697009', 'mp-1795946', 'mp-1595051', 'mp-1072362']",6.855e-05,"{'Ta': 4.0, 'Si': 2.0}",97.56668657988396,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0]",1.4051927436087278e-06,6.855e-05,0,0.0001371,MP,data/source/MP/cleaned/cifs/MP-mp-2783.cif,True,,data/final/MP/graphs/Si2Ta5-MP-mp-2783-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As2Eu0.784Fe2K0.216,3,0.0863999999999999,1.0,True,As2Eu0.784Fe2K0.216,As2Eu1Fe2,0.0,Ferrite,True,As40Eu15.68Fe40K4.32,As-Eu-Fe-K,4,Supercon,Eu0.784K0.216Fe2As2,MP-mp-20890,Eu1Fe2As2,As-Eu-Fe,As40Eu20Fe40,I 4/m m m,tetragonal,3.9736679999368567,3.9736679999368567,6.07120609,data/final/MP/cifs/As2Eu0.784Fe2K0.216-MP-mp-20890-synth_doped.cif,data/source/MP/raw/cifs/mp-20890.cif,mp-20890,0.0,,2014-02-21 09:03:25,8.079887417044961,10.17188/1196086,"@misc{osti_1196086,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Eu(FeAs)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196086"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687595'}},0.0,5.69045342,520.0,-39.43180547,-7.886361094,"{'tags': ['High pressure experimental phase', 'Europium diiron diarsenide - HP', 'Europium diiron diarsenide', 'Europium iron arsenide (1/2/2)']}",-39.43180547,-7.886361094,-0.5763016570000005,"['xas', 'bandstructure']",True,"[169689, 169687, 185355, 169691, 163211, 185356, 610431, 169690, 169688, 163210]",True,2021-05-12 10:56:57.051000,FM,5,16,mp-20890,,Eu(FeAs)2,"{'functional': 'PBE', 'labels': ['Eu', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Eu': 1.0, 'Fe': 2.0, 'As': 2.0}",GGA,mp-20890,"['mp-991161', 'mp-993140', 'mp-20890', 'mp-1069324', 'mp-1069480', 'mp-1069596', 'mp-1069907', 'mp-1070115', 'mp-1069978', 'mp-1442076', 'mp-1687595', 'mp-1782260', 'mp-994461', 'mp-1594012', 'mp-1069557', 'mp-1070074']",6.9579645,"{'Eu': 1.0, 'Fe': 2.0, 'As': 2.0}",84.97992844321493,[],FM,True,139,1,"[6.7, -0.0, -0.0, 0.0, 0.0]",0.0818777401613068,6.9579645,1,6.9579645,MP,data/source/MP/cleaned/cifs/MP-mp-20890.cif,True,,data/final/MP/graphs/As2Eu0.784Fe2K0.216-MP-mp-20890-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Si2W3,1,0.0,2.0,False,Si4W6,Si4W6,2.84,Other,True,Si40W60,Si-W,2,Supercon,Si2W3,MP-mp-1079377,Si4W6,Si-W,Si40W60,P 4/m b m,tetragonal,3.343505,6.615847,6.615847,data/final/MP/cifs/Si2W3-MP-mp-1079377.cif,data/source/MP/raw/cifs/mp-1079377.cif,mp-1079377,0.0,,2018-04-14 22:12:43,13.790785846491136,,,{'GGA': {'task_id': 'mp-1702523'}},0.2380536050000028,9.07651627,520.0,-99.42948369,-9.942948369,{'tags': ['Tungsten silicide (3/2)']},-99.42948369,-9.942948369,0.0304531210000021,['bandstructure'],True,[652552],True,2021-05-12 10:58:16.596000,NM,10,5,mp-1079377,,Si2W3,"{'functional': 'PBE', 'labels': ['Si', 'W_pv'], 'pot_type': 'paw'}","{'Si': 2.0, 'W': 3.0}",GGA,mp-1079377,"['mp-1079377', 'mp-1422426', 'mp-1702523', 'mp-1934281', 'mp-1599977']",9.8e-06,"{'Si': 4.0, 'W': 6.0}",146.3433131590496,[],NM,False,38,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, 0.0]",1.339316404480895e-07,9.8e-06,0,1.96e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1079377.cif,False,,data/final/MP/graphs/Si2W3-MP-mp-1079377.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Cr0.79Pt0.21,3,0.08,8.0,False,Cr6.32Pt1.68,Cr6Pt2,0.0,Other,True,Cr79Pt21,Cr-Pt,2,Supercon,Cr0.79Pt0.21,MP-mp-446,Cr6Pt2,Cr-Pt,Cr75Pt25,P m -3 n,cubic,4.677137,4.677137,4.677137,data/final/MP/cifs/Cr0.79Pt0.21-MP-mp-446-synth_doped.cif,data/source/MP/raw/cifs/mp-446.cif,mp-446,0.0,,2011-05-14 07:30:38,11.395552440735688,10.17188/1208169,"@misc{osti_1208169,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Cr3Pt (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208169"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702362'}},0.0751529233333361,7.27226864,520.0,-70.12698298,-8.7658728725,{'tags': ['Chromium platinum (3/1)']},-70.12698298,-8.7658728725,-0.0083603424999996,"['xas', 'elasticity', 'bandstructure']",True,"[102837, 102836]",True,2021-05-12 10:56:20.740000,FM,8,8,mp-446,,Cr3Pt,"{'functional': 'PBE', 'labels': ['Cr_pv', 'Pt'], 'pot_type': 'paw'}","{'Cr': 3.0, 'Pt': 1.0}",GGA,mp-446,"['mp-941249', 'mp-941551', 'mp-934775', 'mp-446', 'mp-1504950', 'mp-1702362', 'mp-1795671', 'mp-1588107']",0.6271698,"{'Cr': 6.0, 'Pt': 2.0}",102.3152273455694,[],FM,True,223,1,"[0.2, 0.2, 0.2, 0.2, 0.2, 0.2, 0.0, 0.0]",0.0122595593299467,0.6271698,6,1.2543396,MP,data/source/MP/cleaned/cifs/MP-mp-446.cif,True,,data/final/MP/graphs/Cr0.79Pt0.21-MP-mp-446-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Al2Gd0.004La0.996,2,0.0026666666666666,2.0,False,Al4Gd0.008La1.992,Al4La2,1.38,Other,True,Al66.667Gd0.133La33.2,Al-Gd-La,3,Supercon,La0.996Gd0.004Al2,MP-mp-2694,La2Al4,Al-La,Al66.667La33.333,F d -3 m,cubic,5.75810346,5.75810346,5.75810346,data/final/MP/cifs/Al2Gd0.004La0.996-MP-mp-2694-synth_doped.cif,data/source/MP/raw/cifs/mp-2694.cif,mp-2694,0.0,,2011-05-12 21:07:48,4.744791242841679,10.17188/1201263,"@misc{osti_1201263,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaAl2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201263"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686658'}},0.0,8.10972418,520.0,-27.8605497,-4.64342495,{'tags': ['Aluminium lanthanum (2/1)']},-27.8605497,-4.64342495,-0.5010386950000001,"['xas', 'elasticity', 'bandstructure']",True,"[608275, 608277, 608265, 608290, 608288, 57933, 608270, 608269, 603920, 608272, 608286, 608273, 608289, 604450, 608266]",True,2021-05-12 10:56:18.721000,NM,6,10,mp-2694,,LaAl2,"{'functional': 'PBE', 'labels': ['La', 'Al'], 'pot_type': 'paw'}","{'La': 1.0, 'Al': 2.0}",GGA,mp-2694,"['mp-940230', 'mp-925817', 'mp-940644', 'mp-2694', 'mp-1258643', 'mp-1440554', 'mp-1686658', 'mp-1787219', 'mp-1596037', 'mp-1594760']",0.0008869,"{'La': 2.0, 'Al': 4.0}",134.99677475891534,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",1.3139573172527638e-05,0.0008869,0,0.0017738,MP,data/source/MP/cleaned/cifs/MP-mp-2694.cif,True,,data/final/MP/graphs/Al2Gd0.004La0.996-MP-mp-2694-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Rh2Y1,1,0.0,2.0,False,Rh4Y2,Rh4Y2,0.0,Other,True,Rh66.667Y33.333,Rh-Y,2,Supercon,Rh2Y1,MP-mp-921,Y2Rh4,Rh-Y,Rh66.667Y33.333,F d -3 m,cubic,5.35588273,5.35588273,5.35588273,data/final/MP/cifs/Rh2Y1-MP-mp-921.cif,data/source/MP/raw/cifs/mp-921.cif,mp-921,0.0,,2011-05-14 00:14:59,9.009607652314168,10.17188/1313050,"@misc{osti_1313050,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YRh2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1313050"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688599'}},0.0,5.51065275,520.0,-46.77992505,-7.796654175,{'tags': ['Rhodium yttrium (2/1)']},-46.77992505,-7.796654175,-0.7316252238888895,"['xas', 'elasticity', 'bandstructure']",True,"[105975, 650540, 650526, 105974, 650538, 650531, 650533]",True,2021-05-12 10:56:35.166000,NM,6,8,mp-921,,YRh2,"{'functional': 'PBE', 'labels': ['Y_sv', 'Rh_pv'], 'pot_type': 'paw'}","{'Y': 1.0, 'Rh': 2.0}",GGA,mp-921,"['mp-930601', 'mp-990738', 'mp-913816', 'mp-921', 'mp-1439758', 'mp-1688599', 'mp-1921460', 'mp-1595661']",7.735e-05,"{'Y': 2.0, 'Rh': 4.0}",108.63710427714128,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",1.4240070280716324e-06,7.735e-05,0,0.0001547,MP,data/source/MP/cleaned/cifs/MP-mp-921.cif,False,,data/final/MP/graphs/Rh2Y1-MP-mp-921.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Al12Re1,1,0.0,1.0,True,Al12Re1,Al12Re1,0.0,Other,True,Al92.308Re7.692,Al-Re,2,Supercon,Al12Re1,MP-mp-1648,Al12Re1,Al-Re,Al92.308Re7.692,I m -3,cubic,6.5269944514469325,6.52699445,6.52699445,data/final/MP/cifs/Al12Re1-MP-mp-1648.cif,data/source/MP/raw/cifs/mp-1648.cif,mp-1648,0.0,,2011-05-13 02:55:18,3.956298541354384,10.17188/1191891,"@misc{osti_1191891,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Al12Re (SG:204) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191891"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697999'}},0.0,7.7075937,520.0,-59.255638,-4.558126,{'tags': ['Aluminium rhenium (12/1)']},-59.255638,-4.558126,-0.1434000657692307,"['xas', 'elasticity', 'bandstructure']",True,"[58150, 109107]",True,2021-05-12 10:56:14.760000,NM,13,9,mp-1648,,Al12Re,"{'functional': 'PBE', 'labels': ['Al', 'Re_pv'], 'pot_type': 'paw'}","{'Al': 12.0, 'Re': 1.0}",GGA,mp-1648,"['mp-992303', 'mp-991767', 'mp-1648', 'mp-1253205', 'mp-1418204', 'mp-1697999', 'mp-1831451', 'mp-993899', 'mp-1601951']",0.0005884,"{'Al': 12.0, 'Re': 1.0}",214.0512846009313,[],NM,False,204,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.748873949049124e-06,0.0005884,0,0.0005884,MP,data/source/MP/cleaned/cifs/MP-mp-1648.cif,False,,data/final/MP/graphs/Al12Re1-MP-mp-1648.json,0,True,m-3,2,0,0,0,0,0,0,0,0,1,0,1.0,False
Ge0.44Nb3Sn0.56,2,0.03,2.0,False,Ge0.88Nb6Sn1.12,Ge1Nb6Sn1,6.8,Other,True,Ge11Nb75Sn14,Ge-Nb-Sn,3,Supercon,Nb3Sn0.56Ge0.44,MP-mp-1220377,Nb6Sn1Ge1,Ge-Nb-Sn,Ge12.5Nb75Sn12.5,P m -3,cubic,5.257683,5.257683,5.257683,data/final/MP/cifs/Ge0.44Nb3Sn0.56-MP-mp-1220377-synth_doped.cif,data/source/MP/raw/cifs/mp-1220377.cif,mp-1220377,0.0,,2019-01-12 21:14:01.957000,8.555097085551632,,,{'GGA': {'task_id': 'mp-1753393'}},0.041374483958334,6.24154069,520.0,-70.84482418,-8.8556030225,{'tags': []},-70.84482418,-8.8556030225,-0.2005492787499996,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,8,5,mp-1220377,,Nb6SnGe,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Sn_d', 'Ge_d'], 'pot_type': 'paw'}","{'Nb': 6.0, 'Sn': 1.0, 'Ge': 1.0}",GGA,mp-1220377,"['mp-1220377', 'mp-1392635', 'mp-1753393', 'mp-1926728', 'mp-1621241']",0.9917683,"{'Nb': 6.0, 'Sn': 1.0, 'Ge': 1.0}",145.33934321471764,[],NM,False,200,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0068238116263867,0.9917683,0,0.9917683,MP,data/source/MP/cleaned/cifs/MP-mp-1220377.cif,True,,data/final/MP/graphs/Ge0.44Nb3Sn0.56-MP-mp-1220377-synth_doped.json,0,True,m-3,2,0,0,0,0,0,0,1,0,0,0,1.0,False
Lu1Pd2Sn1,1,0.0,1.0,True,Lu1Pd2Sn1,Lu1Pd2Sn1,2.98,Other,True,Lu25Pd50Sn25,Lu-Pd-Sn,3,Supercon,Lu1Pd2Sn1,MP-mp-5181,Lu1Sn1Pd2,Lu-Pd-Sn,Lu25Pd50Sn25,F m -3 m,cubic,4.75243639,4.75243639,4.75243639,data/final/MP/cifs/Lu1Pd2Sn1-MP-mp-5181.cif,data/source/MP/raw/cifs/mp-5181.cif,mp-5181,0.0,,2011-05-13 00:09:00,11.081771287787682,10.17188/1263132,"@misc{osti_1263132,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LuSnPd2 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1263132"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677618'}},0.0,6.66819757,520.0,-22.49982417,-5.6249560425,{'tags': ['Lutetium palladium tin (1/2/1)']},-22.49982417,-5.6249560425,-0.9023845437500002,"['xas', 'bandstructure']",True,"[104818, 104817]",True,2021-05-12 10:57:10.838000,NM,4,8,mp-5181,,LuSnPd2,"{'functional': 'PBE', 'labels': ['Lu_3', 'Sn_d', 'Pd'], 'pot_type': 'paw'}","{'Lu': 1.0, 'Sn': 1.0, 'Pd': 2.0}",GGA,mp-5181,"['mp-5181', 'mp-991946', 'mp-993663', 'mp-1437609', 'mp-1677618', 'mp-1801320', 'mp-994960', 'mp-1589010']",0.0008289,"{'Lu': 1.0, 'Sn': 1.0, 'Pd': 2.0}",75.89863069308518,[],NM,False,225,0,"[0, 0, 0, 0]",1.0921145644272048e-05,0.0008289,0,0.0008289,MP,data/source/MP/cleaned/cifs/MP-mp-5181.cif,False,,data/final/MP/graphs/Lu1Pd2Sn1-MP-mp-5181.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ga5Mn1.85,2,0.0312825860271116,2.0,False,Ga10Mn3.7,Ga10Mn4,0.0,Other,True,Ga72.993Mn27.007,Ga-Mn,2,Supercon,Ga5Mn1.85,MP-mp-607225,Mn4Ga10,Ga-Mn,Ga71.429Mn28.571,P 4/m b m,tetragonal,2.701908,8.847074,8.847074,data/final/MP/cifs/Ga5Mn1.85-MP-mp-607225-synth_doped.cif,data/source/MP/raw/cifs/mp-607225.cif,mp-607225,0.0,,2013-05-26 07:05:31,7.200126330920139,10.17188/1277547,"@misc{osti_1277547,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Mn2Ga5 (SG:127) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277547"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-919000'}},0.0322265842857136,4.74225302,520.0,-68.801362,-4.914383,{'tags': ['Manganese gallide (2/5)']},-68.801362,-4.914383,-0.1337386147660098,"['xas', 'bandstructure']",True,"[634613, 634639, 249632]",True,2021-05-12 10:57:28.836000,FM,14,10,mp-607225,,Mn2Ga5,"{'functional': 'PBE', 'labels': ['Mn_pv', 'Ga_d'], 'pot_type': 'paw'}","{'Mn': 2.0, 'Ga': 5.0}",GGA,mp-607225,"['mp-607225', 'mp-919000', 'mp-920104', 'mp-906172', 'mp-1103866', 'mp-1104223', 'mp-1418651', 'mp-1696039', 'mp-1789519', 'mp-1598175']",4.52660645,"{'Mn': 4.0, 'Ga': 10.0}",211.4802801066189,[],FM,True,127,1,"[2.4, 2.4, 2.4, 2.4, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0428087805417875,4.52660645,4,9.0532129,MP,data/source/MP/cleaned/cifs/MP-mp-607225.cif,True,,data/final/MP/graphs/Ga5Mn1.85-MP-mp-607225-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Bi1.7Ca2Cu3Pb0.3Sr2O10,3,0.031578947368421,1.0,True,Bi1.7Ca2Cu3Pb0.3Sr2O10,Bi2Ca2Cu3Sr2O10,107.25,Cuprate,True,Bi8.947Ca10.526Cu15.789Pb1.579Sr10.526O52.631578947368425,Bi-Ca-Cu-Pb-Sr-O,6,Supercon,Bi1.7Pb0.3Sr2Ca2Cu3O10,MP-mp-1209015,Sr2Ca2Cu3Bi2O10,Bi-Ca-Cu-Sr-O,Bi10.526Ca10.526Cu15.789Sr10.526O52.631578947368425,I 4/m m m,tetragonal,3.7791800000000006,3.77918,19.006110040118298,data/final/MP/cifs/Bi1.7Ca2Cu3Pb0.3Sr2O10-MP-mp-1209015-synth_doped.cif,data/source/MP/raw/cifs/mp-1209015.cif,mp-1209015,0.0,,2019-01-12 11:49:19.218000,6.326909644319984,,,,0.0713479901315814,4.66362603,520.0,-109.00493972,-5.737102090526316,"{'tags': ['Sr1.9Ca2Cu3Bi2.1O10.05', 'high-Tc cuprate family', 'Ba2Ca2Cu3Tl2O10']}",-109.00493972,-5.737102090526316,-2.0488133880701755,[],False,[],True,2021-05-12 11:00:21.818000,NM,19,2,mp-1209015,oxide,Sr2Ca2Cu3(BiO5)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ca': 2.0, 'Cu': 3.0, 'Bi': 2.0, 'O': 10.0}",GGA,mp-1209015,"['mp-1209015', 'mp-1925561']",0.005042,"{'Sr': 2.0, 'Ca': 2.0, 'Cu': 3.0, 'Bi': 2.0, 'O': 10.0}",268.75259830640584,[],NM,False,107,0,"[0.0, 0.0, 0.0, 0.0, 0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",1.876074885144588e-05,0.005042,0,0.005042,MP,data/source/MP/cleaned/cifs/MP-mp-1209015.cif,True,,data/final/MP/graphs/Bi1.7Ca2Cu3Pb0.3Sr2O10-MP-mp-1209015-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Cd0.1In0.9La3,2,0.0499999999999999,1.0,True,Cd0.1In0.9La3,In1La3,9.55,Other,True,Cd2.5In22.5La75,Cd-In-La,3,Supercon,Cd0.1In0.9La3,MP-mp-20909,La3In1,In-La,In25La75,P m -3 m,cubic,5.076766,5.076766,5.076766,data/final/MP/cifs/Cd0.1In0.9La3-MP-mp-20909-synth_doped.cif,data/source/MP/raw/cifs/mp-20909.cif,mp-20909,0.0,,2014-02-21 06:52:52,6.7455760598452565,10.17188/1196104,"@misc{osti_1196104,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La3In (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196104"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671685'}},0.0,8.16935076,520.0,-18.73796121,-4.6844903025,"{'tags': ['Indium lanthanum (1/3)', 'Lanthanum indium (3/1)']}",-18.73796121,-4.6844903025,-0.2945640412500001,"['xas', 'bandstructure']",True,"[639844, 51950, 639851, 639840, 603208, 107019]",True,2021-05-12 10:56:57.051000,NM,4,8,mp-20909,,La3In,"{'functional': 'PBE', 'labels': ['La', 'In_d'], 'pot_type': 'paw'}","{'La': 3.0, 'In': 1.0}",GGA,mp-20909,"['mp-906743', 'mp-921394', 'mp-920373', 'mp-20909', 'mp-1476042', 'mp-1671685', 'mp-1778647', 'mp-1590323']",0.0489742,"{'La': 3.0, 'In': 1.0}",130.84629766481785,[],NM,False,221,0,"[0, 0, 0, 0]",0.0003742880071811,0.0489742,0,0.0489742,MP,data/source/MP/cleaned/cifs/MP-mp-20909.cif,True,,data/final/MP/graphs/Cd0.1In0.9La3-MP-mp-20909-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
As1Fe0.84Ir0.16Sm1O1,3,0.08,2.0,False,As2Fe1.68Ir0.32Sm2O2,As2Fe2Sm2O2,17.3,Ferrite,True,As25Fe21Ir4Sm25O25,As-Fe-Ir-Sm-O,5,Supercon,Sm1Fe0.84Ir0.16As1O1,MP-mp-20349,Sm2Fe2As2O2,As-Fe-Sm-O,As25Fe25Sm25O25,P 4/n m m,tetragonal,4.026492,4.026492,9.046755,data/final/MP/cifs/As1Fe0.84Ir0.16Sm1O1-MP-mp-20349-synth_doped.cif,data/source/MP/raw/cifs/mp-20349.cif,mp-20349,0.0,,2014-02-19 11:24:42,6.727802583283198,,,{'GGA+U': {'task_id': 'mp-1695938'}},0.3015723809374986,3.77685593,520.0,-52.73407138,-6.5917589225,{'tags': ['Samarium iron arsenic oxide (1/1/1/1)']},-52.73407138,-6.5917589225,-1.6285904237499995,"['xas', 'elasticity', 'bandstructure']",True,"[236652, 236653, 422002, 163457, 163458]",True,2021-05-12 10:56:16.728000,FM,8,10,mp-20349,oxide,SmFeAsO,"{'functional': 'PBE', 'labels': ['Sm_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Sm': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-20349,"['mp-24944', 'mp-1078897', 'mp-1079866', 'mp-1173321', 'mp-20349', 'mp-1425472', 'mp-1695938', 'mp-1772503', 'mp-1789694', 'mp-1588381']",3.75729895,"{'Sm': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",146.67176231613362,[],FM,True,129,1,"[0.0, 0.0, 3.5, 3.5, -0.0, -0.0, -0.0, -0.0]",0.0512341147425717,3.75729895,2,7.5145979,MP,data/source/MP/cleaned/cifs/MP-mp-20349.cif,True,,data/final/MP/graphs/As1Fe0.84Ir0.16Sm1O1-MP-mp-20349-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
As2Fe1.9Mn0.1Sr1,2,0.04,1.0,True,As2Fe1.9Mn0.1Sr1,As2Fe2Sr1,0.0,Ferrite,True,As40Fe38Mn2Sr20,As-Fe-Mn-Sr,4,Supercon,Sr1Fe1.9Mn0.1As2,MP-mp-4488,Sr1Fe2As2,As-Fe-Sr,As40Fe40Sr20,I 4/m m m,tetragonal,3.9729799997357778,3.9729799997357778,6.45523327,data/final/MP/cifs/As2Fe1.9Mn0.1Sr1-MP-mp-4488-synth_doped.cif,data/source/MP/raw/cifs/mp-4488.cif,mp-4488,0.0,,2011-05-13 03:37:13,6.319998834487784,10.17188/1208187,"@misc{osti_1208187,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr(FeAs)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208187"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672865'}},0.0,5.13397273,520.0,-30.61898897,-6.123797794,"{'tags': ['Strontium diiron arsenide - HT', 'Strontium diiron arsenide', 'Strontium diiron diarsenide', 'Iron strontium arsenide (2/1/2)', 'Strontium diiron arsenide - LT']}",-30.61898897,-6.123797794,-0.5342483613333335,"['xas', 'elasticity', 'bandstructure']",True,"[182330, 181993, 610527, 163209, 163208, 163869]",True,2021-05-12 10:56:20.740000,NM,5,8,mp-4488,,Sr(FeAs)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Fe': 2.0, 'As': 2.0}",GGA,mp-4488,"['mp-906356', 'mp-920135', 'mp-919110', 'mp-4488', 'mp-1439153', 'mp-1672865', 'mp-1873948', 'mp-1592272']",0.0029206,"{'Sr': 1.0, 'Fe': 2.0, 'As': 2.0}",91.7377588211838,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",3.183640016422098e-05,0.0029206,0,0.0029206,MP,data/source/MP/cleaned/cifs/MP-mp-4488.cif,True,,data/final/MP/graphs/As2Fe1.9Mn0.1Sr1-MP-mp-4488-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Re1Zr2,1,0.0,10.0,False,Re10Zr20,Re10Zr20,0.0,Other,True,Re33.333Zr66.667,Re-Zr,2,Supercon,Re1Zr2,MP-mp-1193848,Zr20Re10,Re-Zr,Re33.333Zr66.667,P 42/m n m,tetragonal,5.682099,10.222811,10.222811,data/final/MP/cifs/Re1Zr2-MP-mp-1193848.cif,data/source/MP/raw/cifs/mp-1193848.cif,mp-1193848,0.0,,2019-01-11 23:33:38.359000,10.30907659933355,,,{'GGA': {'task_id': 'mp-1752531'}},0.0844003301333327,4.92779095,520.0,-299.28664207,-9.976221402333334,{'tags': ['Zirconium rhenium (1.33/0.67)']},-299.28664207,-9.976221402333334,-0.1295785873333348,[],False,[650215],True,2021-05-12 10:59:56.869000,NM,30,4,mp-1193848,,Zr2Re,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Re_pv'], 'pot_type': 'paw'}","{'Zr': 2.0, 'Re': 1.0}",GGA,mp-1193848,"['mp-1193848', 'mp-1443672', 'mp-1752531', 'mp-1891645']",0.02150138,"{'Zr': 20.0, 'Re': 10.0}",593.8126695430682,[],NM,False,136,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0003620902871025,0.02150138,0,0.2150138,MP,data/source/MP/cleaned/cifs/MP-mp-1193848.cif,False,,data/final/MP/graphs/Re1Zr2-MP-mp-1193848.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
As1F0.082Fe1Pr1O0.918,2,0.0409999999999999,2.0,False,As2F0.164Fe2Pr2O1.836,As2Fe2Pr2O2,14.6,Ferrite,True,As25F2.05Fe25Pr25O22.95,As-F-Fe-Pr-O,5,Supercon,Pr1Fe1As1F0.082O0.918,MP-mp-22491,Pr2Fe2As2O2,As-Fe-Pr-O,As25Fe25Pr25O25,P 4/n m m,tetragonal,4.094889,4.094889,9.258722,data/final/MP/cifs/As1F0.082Fe1Pr1O0.918-MP-mp-22491-synth_doped.cif,data/source/MP/raw/cifs/mp-22491.cif,mp-22491,0.0,,2014-02-25 19:17:30,6.153806906111091,,,{'GGA+U': {'task_id': 'mp-1695715'}},0.3808778432291664,4.12348168,520.0,-51.7633941,-6.4704242625,{'tags': ['Praseodymium iron arsenic oxide (1/1/1/1)']},-51.7633941,-6.4704242625,-1.491677511249999,"['xas', 'bandstructure']",True,"[162830, 162833, 246832, 90316, 422000, 236649, 236648, 602491]",True,2021-05-12 10:57:10.838000,FM,8,8,mp-22491,oxide,PrFeAsO,"{'functional': 'PBE', 'labels': ['Pr_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Pr': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-22491,"['mp-510622', 'mp-1079608', 'mp-1079857', 'mp-22491', 'mp-1476145', 'mp-1695715', 'mp-1778524', 'mp-1596397']",3.7947681,"{'Pr': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",155.25132378854377,[],FM,True,129,1,"[0.0, 0.0, 3.5, 3.5, 0.0, 0.0, 0.0, 0.0]",0.0488854846116297,3.7947681,2,7.5895362,MP,data/source/MP/cleaned/cifs/MP-mp-22491.cif,True,,data/final/MP/graphs/As1F0.082Fe1Pr1O0.918-MP-mp-22491-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
As1F0.14Fe1Sm1O0.86,3,0.07,2.0,False,As2F0.28Fe2Sm2O1.72,As2Fe2Sm2O2,26.9,Ferrite,True,As25F3.5Fe25Sm25O21.5,As-F-Fe-Sm-O,5,Supercon,Sm1Fe1As1F0.14O0.86,MP-mp-20349,Sm2Fe2As2O2,As-Fe-Sm-O,As25Fe25Sm25O25,P 4/n m m,tetragonal,4.026492,4.026492,9.046755,data/final/MP/cifs/As1F0.14Fe1Sm1O0.86-MP-mp-20349-synth_doped.cif,data/source/MP/raw/cifs/mp-20349.cif,mp-20349,0.0,,2014-02-19 11:24:42,6.727802583283198,,,{'GGA+U': {'task_id': 'mp-1695938'}},0.3015723809374986,3.77685593,520.0,-52.73407138,-6.5917589225,{'tags': ['Samarium iron arsenic oxide (1/1/1/1)']},-52.73407138,-6.5917589225,-1.6285904237499995,"['xas', 'elasticity', 'bandstructure']",True,"[236652, 236653, 422002, 163457, 163458]",True,2021-05-12 10:56:16.728000,FM,8,10,mp-20349,oxide,SmFeAsO,"{'functional': 'PBE', 'labels': ['Sm_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Sm': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-20349,"['mp-24944', 'mp-1078897', 'mp-1079866', 'mp-1173321', 'mp-20349', 'mp-1425472', 'mp-1695938', 'mp-1772503', 'mp-1789694', 'mp-1588381']",3.75729895,"{'Sm': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",146.67176231613362,[],FM,True,129,1,"[0.0, 0.0, 3.5, 3.5, -0.0, -0.0, -0.0, -0.0]",0.0512341147425717,3.75729895,2,7.5145979,MP,data/source/MP/cleaned/cifs/MP-mp-20349.cif,True,,data/final/MP/graphs/As1F0.14Fe1Sm1O0.86-MP-mp-20349-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
C2Tm1,3,0.1333333333333334,6.0,False,C12Tm6,C12Tm8,0.0,Carbon,True,C66.667Tm33.333,C-Tm,2,Supercon,C2Tm1,MP-mp-9545,Tm8C12,C-Tm,C60Tm40,I -4 3 d,cubic,7.006420911553215,7.00642091,7.00642091,data/final/MP/cifs/C2Tm1-MP-mp-9545-synth_doped.cif,data/source/MP/raw/cifs/mp-9545.cif,mp-9545,0.0,,2011-06-03 14:12:24,9.379903627580342,10.17188/1313322,"@misc{osti_1313322,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Tm2C3 (SG:220) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1313322"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1669529'}},0.0673239339000026,5.1994414,520.0,-152.03572509,-7.6017862545,{'tags': ['Thulium carbide (2/3)']},-152.03572509,-7.6017862545,-0.275383665166666,"['xas', 'bandstructure']",True,[86292],True,2021-05-12 10:57:55.580000,NM,20,8,mp-9545,,Tm2C3,"{'functional': 'PBE', 'labels': ['Tm_3', 'C'], 'pot_type': 'paw'}","{'Tm': 2.0, 'C': 3.0}",GGA,mp-9545,"['mp-916859', 'mp-939973', 'mp-937466', 'mp-9545', 'mp-1432652', 'mp-1669529', 'mp-1922534', 'mp-1607432']",0.00484005,"{'Tm': 8.0, 'C': 12.0}",264.76878447085585,[],NM,False,220,0,"[-0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",7.312115753634491e-05,0.00484005,0,0.0193602,MP,data/source/MP/cleaned/cifs/MP-mp-9545.cif,True,,data/final/MP/graphs/C2Tm1-MP-mp-9545-synth_doped.json,0,True,-43m,5,0,0,0,0,0,0,0,0,1,0,1.0,False
Al0.983Ga0.017Nb3,2,0.0085,2.0,False,Al1.966Ga0.034Nb6,Al2Nb6,18.8,Other,True,Al24.575Ga0.425Nb75,Al-Ga-Nb,3,Supercon,Nb3Al0.983Ga0.017,MP-mp-796,Nb6Al2,Al-Nb,Al25Nb75,P m -3 n,cubic,5.215254,5.215254,5.215254,data/final/MP/cifs/Al0.983Ga0.017Nb3-MP-mp-796-synth_doped.cif,data/source/MP/raw/cifs/mp-796.cif,mp-796,0.0,,2011-05-13 16:07:37,7.157298025966356,,,{'GGA': {'task_id': 'mp-1686893'}},0.0460773865000003,5.52947534,520.0,-69.48918494,-8.6861481175,"{'tags': ['Aluminium niobium (1/3)', 'Niobium aluminide (3/1)', 'Aluminum niobium (1/3)']}",-69.48918494,-8.6861481175,-0.1737753800000003,"['bandstructure', 'elasticity']",True,"[608675, 608654, 608688, 608668, 608669, 608685, 608676, 608683, 58014, 608657, 107856, 608655, 608666, 608691, 608656, 608665, 608673, 608653, 608661]",True,2021-05-12 10:56:31.128000,NM,8,10,mp-796,,Nb3Al,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Al': 1.0}",GGA,mp-796,"['mp-911586', 'mp-927906', 'mp-796', 'mp-927472', 'mp-1260512', 'mp-1440919', 'mp-1686893', 'mp-1927652', 'mp-1591599', 'mp-1587739']",0.16323955,"{'Nb': 6.0, 'Al': 2.0}",141.8490379078192,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0023015954483396,0.16323955,0,0.3264791,MP,data/source/MP/cleaned/cifs/MP-mp-796.cif,True,,data/final/MP/graphs/Al0.983Ga0.017Nb3-MP-mp-796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba8Ge46,3,0.037037037037037,0.217383152173913,False,Ba1.739Ge10,Ba2Ge10,10.0,Other,True,Ba14.815Ge85.185,Ba-Ge,2,Supercon,Ba8Ge46,MP-mp-1095284,Ba2Ge10,Ba-Ge,Ba16.667Ge83.333,I m m a,orthorhombic,4.847208000877076,8.53668023,8.536680228683617,data/final/MP/cifs/Ba8Ge46-MP-mp-1095284-synth_doped.cif,data/source/MP/raw/cifs/mp-1095284.cif,mp-1095284,0.0,,2018-04-27 12:24:46,5.739911413387473,,,{'GGA': {'task_id': 'mp-1677297'}},0.0573065406249995,3.5551503,520.0,-52.56208893,-4.3801740775,"{'tags': ['Barium pentagermanide', 'Barium germanide (1/5)']}",-52.56208893,-4.3801740775,-0.2078223933333335,['bandstructure'],True,"[251586, 194880]",True,2021-05-12 10:58:18.470000,NM,12,6,mp-1095284,,BaGe5,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ge_d'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Ge': 5.0}",GGA,mp-1095284,"['mp-1095284', 'mp-1095288', 'mp-1436186', 'mp-1677297', 'mp-1933889', 'mp-1598790']",1.7e-06,"{'Ba': 2.0, 'Ge': 10.0}",289.6019041163525,[],NM,False,74,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.1740254299688554e-08,1.7e-06,0,3.4e-06,MP,data/source/MP/cleaned/cifs/MP-mp-1095284.cif,True,,data/final/MP/graphs/Ba8Ge46-MP-mp-1095284-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,0,1,0,1.0,False
Be5Co1,1,0.0,1.0,True,Be5Co1,Be5Co1,0.0,Other,True,Be83.333Co16.667,Be-Co,2,Supercon,Be5Co1,MP-mp-1071690,Be5Co1,Be-Co,Be83.333Co16.667,F -4 3 m,cubic,4.07702355,4.07702355,4.07702355,data/final/MP/cifs/Be5Co1-MP-mp-1071690.cif,data/source/MP/raw/cifs/mp-1071690.cif,mp-1071690,0.0,,2018-03-22 06:38:23,3.603654583234001,,,{'GGA': {'task_id': 'mp-1696295'}},0.0,4.24666978,520.0,-26.9565204,-4.4927534,"{'tags': ['Friauf-Laves phase', 'Be5Co m', 'Be5Au', 'Beryllium cobalt (5/1)']}",-26.9565204,-4.4927534,-0.1918563800000002,['bandstructure'],True,[616209],True,2021-05-12 10:58:14.654000,FM,6,8,mp-1071690,,Be5Co,"{'functional': 'PBE', 'labels': ['Be_sv', 'Co'], 'pot_type': 'paw'}","{'Be': 5.0, 'Co': 1.0}",GGA,mp-1071690,"['mp-1071697', 'mp-1071704', 'mp-1071690', 'mp-1441810', 'mp-1696295', 'mp-1790560', 'mp-1596875', 'mp-1071710']",0.1097801,"{'Be': 5.0, 'Co': 1.0}",47.91976313490895,[],FM,True,216,1,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.1]",0.0022909149131421,0.1097801,1,0.1097801,MP,data/source/MP/cleaned/cifs/MP-mp-1071690.cif,False,,data/final/MP/graphs/Be5Co1-MP-mp-1071690.json,0,True,-43m,5,0,0,0,0,0,0,0,0,0,1,1.0,False
Ir1La1Si1,1,0.0,4.0,False,Ir4La4Si4,Ir4La4Si4,2.3,Other,True,Ir33.333La33.333Si33.333,Ir-La-Si,3,Supercon,La1Ir1Si1,MP-mp-3555,La4Si4Ir4,Ir-La-Si,Ir33.333La33.333Si33.333,P 21 3,cubic,6.431906,6.431906,6.431906,data/final/MP/cifs/Ir1La1Si1-MP-mp-3555.cif,data/source/MP/raw/cifs/mp-3555.cif,mp-3555,0.0,,2011-05-14 12:34:16,8.966769103347517,10.17188/1183745,"@misc{osti_1183745,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaSiIr (SG:198) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1183745"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695721'}},0.0,8.17898582,520.0,-88.76161872,-7.39680156,{'tags': ['Lanthanum iridium silicide (1/1/1)']},-88.76161872,-7.39680156,-0.996884378333334,"['xas', 'bandstructure']",True,"[640758, 27187, 86275]",True,2021-05-12 10:57:06.958000,NM,12,10,mp-3555,,LaSiIr,"{'functional': 'PBE', 'labels': ['La', 'Si', 'Ir'], 'pot_type': 'paw'}","{'La': 1.0, 'Si': 1.0, 'Ir': 1.0}",GGA,mp-3555,"['mp-905063', 'mp-918401', 'mp-919409', 'mp-3555', 'mp-1102154', 'mp-1155993', 'mp-1116299', 'mp-1414605', 'mp-1695721', 'mp-1600842']",0.001392625,"{'La': 4.0, 'Si': 4.0, 'Ir': 4.0}",266.0841872225306,[],NM,False,198,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.093510350294247e-05,0.001392625,0,0.0055705,MP,data/source/MP/cleaned/cifs/MP-mp-3555.cif,False,,data/final/MP/graphs/Ir1La1Si1-MP-mp-3555.json,0,True,23,1,0,0,0,0,0,0,1,0,0,0,1.0,False
Br0.5C2I1.5Y2,1,0.0,2.0,False,Br1C4I3Y4,Br1C4I3Y4,11.35,Other,True,Br8.333C33.333I25Y33.333,Br-C-I-Y,4,Supercon,Y2I1.5Br0.5C2,MP-mp-1216139,Y4C4I3Br1,Br-C-I-Y,Br8.333C33.333I25Y33.333,C 1 m 1,monoclinic,3.9134000015946073,4.11983949,20.94590078,data/final/MP/cifs/Br0.5C2I1.5Y2-MP-mp-1216139.cif,data/source/MP/raw/cifs/mp-1216139.cif,mp-1216139,0.0,,2019-01-12 17:42:01.602000,4.84126793242244,,,{'GGA': {'task_id': 'mp-1738830'}},0.0036428937499932,4.23928904,520.0,-79.91319197,-6.659432664166666,{'tags': []},-79.91319197,-6.659432664166666,-1.0501844982638897,[],False,[],True,2021-05-12 11:00:40.103000,NM,12,4,mp-1216139,,Y4C4I3Br,"{'functional': 'PBE', 'labels': ['Y_sv', 'C', 'I', 'Br'], 'pot_type': 'paw'}","{'Y': 4.0, 'C': 4.0, 'I': 3.0, 'Br': 1.0}",GGA,mp-1216139,"['mp-1216139', 'mp-1395130', 'mp-1738830', 'mp-1807880']",0.0050195,"{'Y': 4.0, 'C': 4.0, 'I': 3.0, 'Br': 1.0}",296.44645143797163,[],NM,False,8,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.6932231691936033e-05,0.0050195,0,0.0050195,MP,data/source/MP/cleaned/cifs/MP-mp-1216139.cif,False,,data/final/MP/graphs/Br0.5C2I1.5Y2-MP-mp-1216139.json,0,True,m,0,0,5,0,0,0,0,0,1,0,0,1.0,False
Ce0.04Cu1Nd1.96O4,2,0.0114285714285714,1.0,True,Ce0.04Cu1Nd1.96O4,Cu1Nd2O4,0.0,Cuprate,True,Ce0.571Cu14.286Nd28O57.142857142857146,Ce-Cu-Nd-O,4,Supercon,Nd1.96Ce0.04Cu1O4,MP-mp-4158,Nd2Cu1O4,Cu-Nd-O,Cu14.286Nd28.571O57.142857142857146,I 4/m m m,tetragonal,3.973854000245551,3.973854000245551,6.78296857,data/final/MP/cifs/Ce0.04Cu1Nd1.96O4-MP-mp-4158-synth_doped.cif,data/source/MP/raw/cifs/mp-4158.cif,mp-4158,0.0,,2011-05-13 10:19:33,7.086167303782593,10.17188/1207899,"@misc{osti_1207899,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nd2CuO4 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207899"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-670050'}},0.0009497997619085,3.16510927,520.0,-51.48091453,-7.354416361428571,"{'tags': ['Dineodymium copper tetraoxide', 'Dineodymium copper oxide', 'Dineodymium cuprate', 'High pressure experimental phase']}",-51.48091453,-7.354416361428571,-2.971653917142857,"['xas', 'elasticity', 'bandstructure']",True,"[261376, 203228, 160629, 261375, 69479, 186590, 4203, 75830, 75825, 202885, 203229, 71181, 82067, 75828, 69886, 75826, 75829, 75824, 75827, 69482, 86752]",True,2021-05-12 10:56:20.740000,NM,7,11,mp-4158,oxide,Nd2CuO4,"{'functional': 'PBE', 'labels': ['Nd_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Nd': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-4158,"['mp-670050', 'mp-660368', 'mp-4158', 'mp-1078016', 'mp-1173374', 'mp-1440751', 'mp-1668619', 'mp-1797319', 'mp-1588086', 'mp-1590518', 'mp-688505']",0.0084899,"{'Nd': 2.0, 'Cu': 1.0, 'O': 4.0}",97.4899480873212,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",8.708487558528232e-05,0.0084899,0,0.0084899,MP,data/source/MP/cleaned/cifs/MP-mp-4158.cif,True,,data/final/MP/graphs/Ce0.04Cu1Nd1.96O4-MP-mp-4158-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
C1Hf0.9Ta0.1,3,0.0999999999999999,1.0,True,C1Hf0.9Ta0.1,C1Hf1,5.0,Other,True,C50Hf45Ta5,C-Hf-Ta,3,Supercon,C1Hf0.9Ta0.1,MP-mp-21075,Hf1C1,C-Hf,C50Hf50,F m -3 m,cubic,3.28897426,3.28897426,3.28897426,data/final/MP/cifs/C1Hf0.9Ta0.1-MP-mp-21075-synth_doped.cif,data/source/MP/raw/cifs/mp-21075.cif,mp-21075,0.0,,2014-02-15 06:54:13,12.57416771071356,10.17188/1196352,"@misc{osti_1196352,
    author = ""Persson, Kristin"",
    title = ""Materials Data on HfC (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196352"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686608'}},0.0,5.97796141,520.0,-21.06360483,-10.531802415,"{'tags': ['Hafnium carbide (1/1)', 'Hafnium carbide']}",-21.06360483,-10.531802415,-0.9398176399999992,"['xas', 'elasticity', 'bandstructure']",True,"[618012, 618010, 618002, 658336, 618020, 618017, 180600, 618008, 185978, 618018, 181793, 618016, 108134, 618005, 22262, 618000, 618013, 617997, 618011, 658398, 618001, 617998, 618015, 618004, 159873, 192046, 618009, 618003]",True,2021-05-12 10:56:16.728000,NM,2,17,mp-21075,,HfC,"{'functional': 'PBE', 'labels': ['Hf_pv', 'C'], 'pot_type': 'paw'}","{'Hf': 1.0, 'C': 1.0}",GGA,mp-21075,"['mp-919916', 'mp-906043', 'mp-918940', 'mp-21075', 'mp-1058491', 'mp-1058503', 'mp-1058524', 'mp-1061352', 'mp-1061374', 'mp-1061411', 'mp-1440553', 'mp-1686608', 'mp-1791532', 'mp-1590031', 'mp-1595311', 'mp-1058520', 'mp-1061403']",5.9e-05,"{'Hf': 1.0, 'C': 1.0}",25.1574387937518,[],NM,False,225,0,"[0, 0]",2.345230787748293e-06,5.9e-05,0,5.9e-05,MP,data/source/MP/cleaned/cifs/MP-mp-21075.cif,True,,data/final/MP/graphs/C1Hf0.9Ta0.1-MP-mp-21075-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
B2C1Ho0.8Lu0.2Ni2,3,0.0666666666666666,1.0,True,B2C1Ho0.8Lu0.2Ni2,B2C1Ho1Ni2,8.77,Other,True,B33.333C16.667Ho13.333Lu3.333Ni33.333,B-C-Ho-Lu-Ni,5,Supercon,Ho0.8Lu0.2Ni2B2C1,MP-mp-6646,Ho1Ni2B2C1,B-C-Ho-Ni,B33.333C16.667Ho16.667Ni33.333,I 4/m m m,tetragonal,3.529863997734658,3.529863997734658,5.76032203,data/final/MP/cifs/B2C1Ho0.8Lu0.2Ni2-MP-mp-6646-synth_doped.cif,data/source/MP/raw/cifs/mp-6646.cif,mp-6646,0.0,,2011-05-13 04:24:09,8.11075125231065,10.17188/1281460,"@misc{osti_1281460,
    author = ""Persson, Kristin"",
    title = ""Materials Data on HoNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281460"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1670774'}},0.0,6.70981387,520.0,-41.84364575,-6.973940958333333,{'tags': ['Holmium dinickel diboride carbide']},-41.84364575,-6.973940958333333,-0.5192332130555558,"['xas', 'elasticity', 'bandstructure']",True,"[79064, 56650, 79065, 79062, 79063, 79575]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-6646,,HoNi2B2C,"{'functional': 'PBE', 'labels': ['Ho_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Ho': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6646,"['mp-1007146', 'mp-6646', 'mp-1000682', 'mp-1439301', 'mp-1670774', 'mp-1782657', 'mp-1011887', 'mp-1589032']",0.0032459,"{'Ho': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",64.68537905730652,[],NM,False,139,0,"[0.0, -0.0, -0.0, 0.0, 0.0, 0.0]",5.017980952271099e-05,0.0032459,0,0.0032459,MP,data/source/MP/cleaned/cifs/MP-mp-6646.cif,True,,data/final/MP/graphs/B2C1Ho0.8Lu0.2Ni2-MP-mp-6646-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As2Ba0.6Fe2Na0.4,2,0.0399999999999999,2.0,False,As4Ba1.2Fe4Na0.8,As4Ba1Fe4Na1,33.85,Ferrite,True,As40Ba12Fe40Na8,As-Ba-Fe-Na,4,Supercon,Ba0.6Na0.4Fe2As2,MP-mp-1227868,Ba1Na1Fe4As4,As-Ba-Fe-Na,As40Ba10Fe40Na10,C m m m,orthorhombic,5.458732000131759,5.462821,6.96934908,data/final/MP/cifs/As2Ba0.6Fe2Na0.4-MP-mp-1227868-synth_doped.cif,data/source/MP/raw/cifs/mp-1227868.cif,mp-1227868,0.0,,2019-01-13 03:39:01.428000,5.934244973483095,,,{'GGA': {'task_id': 'mp-1731957'}},0.0195872770000011,4.30353274,520.0,-59.62394279,-5.962394279,{'tags': []},-59.62394279,-5.962394279,-0.3865939246551718,[],False,[],True,2021-05-12 11:00:59.151000,FM,10,4,mp-1227868,,BaNa(FeAs)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Na_pv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Na': 1.0, 'Fe': 4.0, 'As': 4.0}",GGA,mp-1227868,"['mp-1227868', 'mp-1396889', 'mp-1731957', 'mp-1827521']",0.9949323,"{'Ba': 1.0, 'Na': 1.0, 'Fe': 4.0, 'As': 4.0}",191.22642477974767,[],FM,True,65,1,"[0.0, 0.0, 0.3, 0.3, 0.3, 0.3, 0.0, 0.0, 0.0, 0.0]",0.0052029017493055,0.9949323,4,0.9949323,MP,data/source/MP/cleaned/cifs/MP-mp-1227868.cif,True,,data/final/MP/graphs/As2Ba0.6Fe2Na0.4-MP-mp-1227868-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ba2Ca0.2Cu2Tl1Y0.8O7,3,0.0307692307692307,1.0,True,Ba2Ca0.2Cu2Tl1Y0.8O7,Ba2Cu2Tl1Y1O7,0.0,Cuprate,True,Ba15.385Ca1.538Cu15.385Tl7.692Y6.154O53.84615384615385,Ba-Ca-Cu-Tl-Y-O,6,Supercon,Tl1Ba2Ca0.2Y0.8Cu2O7,MP-mp-654374,Ba2Y1Tl1Cu2O7,Ba-Cu-Tl-Y-O,Ba15.385Cu15.385Tl7.692Y7.692O53.84615384615385,P 4/m m m,tetragonal,3.878228,3.878228,12.810361,data/final/MP/cifs/Ba2Ca0.2Cu2Tl1Y0.8O7-MP-mp-654374-synth_doped.cif,data/source/MP/raw/cifs/mp-654374.cif,mp-654374,0.0,,2014-05-08 13:13:23,6.955225967854238,10.17188/1272635,"@misc{osti_1272635,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2YTlCu2O7 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1272635"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699646'}},0.0,3.99185235,520.0,-79.5022295,-6.115556115384615,{'tags': ['Thallium(III) yttrium dibarium dicopper oxide']},-79.5022295,-6.115556115384615,-2.216156400384615,['bandstructure'],True,[74163],True,2021-05-12 10:58:51.532000,NM,13,8,mp-654374,oxide,Ba2YTlCu2O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Tl_d', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Tl': 1.0, 'Cu': 2.0, 'O': 7.0}",GGA,mp-654374,"['mp-932671', 'mp-916258', 'mp-931592', 'mp-654374', 'mp-1436144', 'mp-1699646', 'mp-1827635', 'mp-1597270']",0.2426102,"{'Ba': 2.0, 'Y': 1.0, 'Tl': 1.0, 'Cu': 2.0, 'O': 7.0}",192.67618717551863,[],NM,False,123,0,"[0.0, 0.0, 0.0, 0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0012591602706928,0.2426102,0,0.2426102,MP,data/source/MP/cleaned/cifs/MP-mp-654374.cif,True,,data/final/MP/graphs/Ba2Ca0.2Cu2Tl1Y0.8O7-MP-mp-654374-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ce0.88La0.12Ru2,3,0.08,2.0,False,Ce1.76La0.24Ru4,Ce2Ru4,6.14,Heavy_fermion,True,Ce29.333La4Ru66.667,Ce-La-Ru,3,Supercon,Ce0.88La0.12Ru2,MP-mp-607,Ce2Ru4,Ce-Ru,Ce33.333Ru66.667,F d -3 m,cubic,5.35903077,5.35903077,5.35903077,data/final/MP/cifs/Ce0.88La0.12Ru2-MP-mp-607-synth_doped.cif,data/source/MP/raw/cifs/mp-607.cif,mp-607,0.0,,2011-05-13 22:34:26,10.444470046690055,10.17188/1277529,"@misc{osti_1277529,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeRu2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277529"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686879'}},0.0,8.61419203,520.0,-50.66413619,-8.444022698333333,"{'tags': ['Cerium ruthenium (1/2)', 'Cerium ruthenium hydride (1/2/4)']}",-50.66413619,-8.444022698333333,-0.2833998766666663,"['xas', 'elasticity', 'bandstructure']",True,"[621326, 656077, 621978, 621973, 621980, 621984, 102277, 621972, 621976, 621979, 604113, 621977, 621982, 621983, 102276, 656078]",True,2021-05-12 10:56:27.046000,NM,6,14,mp-607,,CeRu2,"{'functional': 'PBE', 'labels': ['Ce', 'Ru_pv'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Ru': 2.0}",GGA,mp-607,"['mp-928203', 'mp-912221', 'mp-928809', 'mp-607', 'mp-1071462', 'mp-1071593', 'mp-1071613', 'mp-1077792', 'mp-1440763', 'mp-1686879', 'mp-1803198', 'mp-1591928', 'mp-1591642', 'mp-1071635']",1.005e-05,"{'Ce': 2.0, 'Ru': 4.0}",108.82877852828122,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",1.846937939745105e-07,1.005e-05,0,2.01e-05,MP,data/source/MP/cleaned/cifs/MP-mp-607.cif,True,,data/final/MP/graphs/Ce0.88La0.12Ru2-MP-mp-607-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Rh1Sb1,1,0.0,4.0,False,Rh4Sb4,Rh4Sb4,0.0,Other,True,Rh50Sb50,Rh-Sb,2,Supercon,Rh1Sb1,MP-mp-20619,Sb4Rh4,Rh-Sb,Rh50Sb50,P n m a,orthorhombic,3.916516,6.056949,6.423349,data/final/MP/cifs/Rh1Sb1-MP-mp-20619.cif,data/source/MP/raw/cifs/mp-20619.cif,mp-20619,0.0,,2014-02-21 13:44:40,9.793324256214346,10.17188/1195753,"@misc{osti_1195753,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SbRh (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195753"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701132'}},0.0,8.90639889,520.0,-49.94190805,-6.24273850625,"{'tags': ['Rhodium antimonide', 'Rhodium(III) antimonide']}",-49.94190805,-6.24273850625,-0.5920839512500002,"['xas', 'elasticity', 'bandstructure']",True,"[991, 650252, 650244, 76621]",True,2021-05-12 10:56:14.760000,NM,8,8,mp-20619,,SbRh,"{'functional': 'PBE', 'labels': ['Sb', 'Rh_pv'], 'pot_type': 'paw'}","{'Sb': 1.0, 'Rh': 1.0}",GGA,mp-20619,"['mp-924297', 'mp-925075', 'mp-909333', 'mp-20619', 'mp-1475690', 'mp-1701132', 'mp-1779147', 'mp-1596796']",0.000612125,"{'Sb': 4.0, 'Rh': 4.0}",152.3755692784271,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.6068848907963702e-05,0.000612125,0,0.0024485,MP,data/source/MP/cleaned/cifs/MP-mp-20619.cif,False,,data/final/MP/graphs/Rh1Sb1-MP-mp-20619.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Al1Hf0.75Pd2Y0.25,3,0.125,1.0,True,Al1Hf0.75Pd2Y0.25,Al1Hf1Pd2,3.2,Other,True,Al25Hf18.75Pd50Y6.25,Al-Hf-Pd-Y,4,Supercon,Pd2Hf0.75Y0.25Al1,MP-mp-16501,Hf1Al1Pd2,Al-Hf-Pd,Al25Hf25Pd50,F m -3 m,cubic,4.54692712,4.546927119999999,4.546927119999999,data/final/MP/cifs/Al1Hf0.75Pd2Y0.25-MP-mp-16501-synth_doped.cif,data/source/MP/raw/cifs/mp-16501.cif,mp-16501,0.0,,2011-05-27 21:56:24,10.44984767592138,10.17188/1191910,"@misc{osti_1191910,
    author = ""Persson, Kristin"",
    title = ""Materials Data on HfAlPd2 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191910"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700405'}},0.0,6.61493459,520.0,-27.37713212,-6.84428303,{'tags': ['Aluminium hafnium palladium (1/1/2)']},-27.37713212,-6.84428303,-0.8286509549999996,"['xas', 'elasticity', 'bandstructure']",True,[57906],True,2021-05-12 10:56:14.760000,NM,4,9,mp-16501,,HfAlPd2,"{'functional': 'PBE', 'labels': ['Hf_pv', 'Al', 'Pd'], 'pot_type': 'paw'}","{'Hf': 1.0, 'Al': 1.0, 'Pd': 2.0}",GGA,mp-16501,"['mp-992272', 'mp-991913', 'mp-16501', 'mp-1259704', 'mp-1441337', 'mp-1700405', 'mp-1791306', 'mp-993887', 'mp-1592387']",0.0011945,"{'Hf': 1.0, 'Al': 1.0, 'Pd': 2.0}",66.47203609057466,[],NM,False,225,0,"[0, 0, 0, 0]",1.7969962562488334e-05,0.0011945,0,0.0011945,MP,data/source/MP/cleaned/cifs/MP-mp-16501.cif,True,,data/final/MP/graphs/Al1Hf0.75Pd2Y0.25-MP-mp-16501-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Fe2Ti1,1,0.0,4.0,False,Fe8Ti4,Fe8Ti4,0.0,Other,True,Fe66.667Ti33.333,Fe-Ti,2,Supercon,Fe2Ti1,MP-mp-2454,Ti4Fe8,Fe-Ti,Fe66.667Ti33.333,P 63/m m c,hexagonal,4.783092002270985,4.783090979999999,7.770169,data/final/MP/cifs/Fe2Ti1-MP-mp-2454.cif,data/source/MP/raw/cifs/mp-2454.cif,mp-2454,0.0,,2011-05-16 05:52:02,6.884089524734768,10.17188/1200137,"@misc{osti_1200137,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TiFe2 (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1200137"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1670772'}},0.0,5.80331072,520.0,-102.74275738,-8.561896448333334,"{'tags': ['Iron titanium (2/1)', 'Titanium iron (1/2)']}",-102.74275738,-8.561896448333334,-0.2833934761111116,"['xas', 'elasticity', 'bandstructure']",True,"[103663, 633956, 155674, 633951, 633945, 633926, 658417, 657043, 107646, 633948, 633927, 633934, 633929, 633931, 633944]",True,2021-05-12 10:56:16.728000,FiM,12,20,mp-2454,,TiFe2,"{'functional': 'PBE', 'labels': ['Ti_pv', 'Fe_pv'], 'pot_type': 'paw'}","{'Ti': 1.0, 'Fe': 2.0}",GGA,mp-2454,"['mp-921491', 'mp-917269', 'mp-920467', 'mp-2454', 'mp-567860', 'mp-1101839', 'mp-1101888', 'mp-1101906', 'mp-1101965', 'mp-1102357', 'mp-1102620', 'mp-1103055', 'mp-1103274', 'mp-1103279', 'mp-1103659', 'mp-1439296', 'mp-1659014', 'mp-1670772', 'mp-1866155', 'mp-1591914']",2.6305642,"{'Ti': 4.0, 'Fe': 8.0}",153.94955623253855,[],FiM,True,194,3,"[-0.6, -0.6, -0.6, -0.6, 1.7, 1.7, 1.7, 1.7, 1.7, 1.7, 1.6, 1.6]",0.0683487309577319,2.6305642,12,10.5222568,MP,data/source/MP/cleaned/cifs/MP-mp-2454.cif,False,,data/final/MP/graphs/Fe2Ti1-MP-mp-2454.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Fe1Se0.25Te0.75,1,0.0,4.0,False,Fe4Se1Te3,Fe4Se1Te3,13.225,Ferrite,True,Fe50Se12.5Te37.5,Fe-Se-Te,3,Supercon,Fe1Se0.25Te0.75,MP-mp-1224987,Fe4Te3Se1,Fe-Se-Te,Fe50Se12.5Te37.5,I 4 m m,tetragonal,5.13773746,5.13773746,7.4290486185030735,data/final/MP/cifs/Fe1Se0.25Te0.75-MP-mp-1224987.cif,data/source/MP/raw/cifs/mp-1224987.cif,mp-1224987,0.0,,2019-01-13 01:09:44.863000,6.651173429977408,,,,0.0666660184375,5.58340921,520.0,-47.62935805,-5.95366975625,{'tags': []},-47.62935805,-5.95366975625,-0.3201887477929688,[],False,[],True,2021-05-12 11:00:54.298000,FM,8,2,mp-1224987,,Fe4Te3Se,"{'functional': 'PBE', 'labels': ['Fe_pv', 'Te', 'Se'], 'pot_type': 'paw'}","{'Fe': 4.0, 'Te': 3.0, 'Se': 1.0}",GGA,mp-1224987,"['mp-1224987', 'mp-1829800']",7.861253,"{'Fe': 4.0, 'Te': 3.0, 'Se': 1.0}",171.05278460528558,[],FM,True,107,1,"[2.0, 2.0, 2.0, 2.0, 0.0, 0.0, 0.0, 0.0]",0.0459580533467508,7.861253,4,7.861253,MP,data/source/MP/cleaned/cifs/MP-mp-1224987.cif,False,,data/final/MP/graphs/Fe1Se0.25Te0.75-MP-mp-1224987.json,0,True,4mm,0,0,0,0,5,0,0,0,0,1,0,1.0,False
C2Th0.19Y0.81,3,0.1266666666666666,1.0,True,C2Th0.19Y0.81,C2Y1,3.52,Carbon,True,C66.667Th6.333Y27,C-Th-Y,3,Supercon,Y0.81Th0.19C2,MP-mp-313,Y1C2,C-Y,C66.667Y33.333,I 4/m m m,tetragonal,3.6847620031018047,4.05388196,3.6847620031018047,data/final/MP/cifs/C2Th0.19Y0.81-MP-mp-313-synth_doped.cif,data/source/MP/raw/cifs/mp-313.cif,mp-313,0.0,,2011-05-12 18:28:55,4.447058270599283,10.17188/1205571,"@misc{osti_1205571,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YC2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1205571"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686717'}},0.068494783958334,5.01076797,520.0,-25.48704506,-8.495681686666666,{'tags': ['Yttrium carbide (1/2)']},-25.48704506,-8.495681686666666,-0.1890041822222213,"['xas', 'elasticity', 'bandstructure']",True,"[619117, 33607, 619112, 619108, 619126, 74666, 619115, 95963]",True,2021-05-12 10:56:20.740000,NM,3,9,mp-313,,YC2,"{'functional': 'PBE', 'labels': ['Y_sv', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'C': 2.0}",GGA,mp-313,"['mp-1000986', 'mp-313', 'mp-1007425', 'mp-1442291', 'mp-1686717', 'mp-1791028', 'mp-1012183', 'mp-1591717', 'mp-1592070']",0.0001427,"{'Y': 1.0, 'C': 2.0}",42.16722581497335,[],NM,False,139,0,"[0, 0, 0]",3.384144848090244e-06,0.0001427,0,0.0001427,MP,data/source/MP/cleaned/cifs/MP-mp-313.cif,True,,data/final/MP/graphs/C2Th0.19Y0.81-MP-mp-313-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Mo15Se19Sn2,1,0.0,2.0,False,Mo30Se38Sn4,Mo30Se38Sn4,0.0,Chevrel,True,Mo41.667Se52.778Sn5.556,Mo-Se-Sn,3,Supercon,Sn2Mo15Se19,MP-mp-1199886,Sn4Mo30Se38,Mo-Se-Sn,Mo41.667Se52.778Sn5.556,R -3 c,trigonal,9.831943836343092,9.83194383634309,19.99848957,data/final/MP/cifs/Mo15Se19Sn2-MP-mp-1199886.cif,data/source/MP/raw/cifs/mp-1199886.cif,mp-1199886,0.0049000000000001,,2019-01-12 04:23:59.441000,6.571993238671073,,,,0.0712268672222231,4.68116652,520.0,-507.48805882,-7.048445261388888,{'tags': ['Tin molybdenum selenide (2/15/19)']},-507.48805882,-7.048445261388888,-0.7107200604036458,[],False,[644361],True,2021-05-12 11:00:08.243000,NM,72,2,mp-1199886,,Sn2Mo15Se19,"{'functional': 'PBE', 'labels': ['Sn_d', 'Mo_pv', 'Se'], 'pot_type': 'paw'}","{'Sn': 2.0, 'Mo': 15.0, 'Se': 19.0}",GGA,mp-1199886,"['mp-1199886', 'mp-1363843']",0.0135255,"{'Sn': 4.0, 'Mo': 30.0, 'Se': 38.0}",1605.337648301934,[],NM,False,167,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.6850660687247654e-05,0.0135255,0,0.027051,MP,data/source/MP/cleaned/cifs/MP-mp-1199886.cif,False,,data/final/MP/graphs/Mo15Se19Sn2-MP-mp-1199886.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
B6Fe0.1Y0.9,2,0.0285714285714285,1.0,True,B6Fe0.1Y0.9,B6Y1,3.3,Other,True,B85.714Fe1.429Y12.857,B-Fe-Y,3,Supercon,Y0.9Fe0.1B6,MP-mp-2203,Y1B6,B-Y,B85.714Y14.286,P m -3 m,cubic,4.1021,4.1021,4.1021,data/final/MP/cifs/B6Fe0.1Y0.9-MP-mp-2203-synth_doped.cif,data/source/MP/raw/cifs/mp-2203.cif,mp-2203,0.0,,2011-05-12 20:11:15,3.699194842606093,10.17188/1197299,"@misc{osti_1197299,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YB6 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197299"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686414'}},0.0285229421428576,6.62579631,520.0,-49.33978236,-7.048540337142858,"{'tags': ['Yttrium boride (1/6)', 'Yttrium octahedro-hexaboride', 'Yttrium hexaboride']}",-49.33978236,-7.048540337142858,-0.3995658030952376,"['xas', 'elasticity', 'bandstructure']",True,"[194635, 615723, 54730, 615726, 615714, 659505, 76126, 615728, 615710]",True,2021-05-12 10:56:16.728000,NM,7,9,mp-2203,,YB6,"{'functional': 'PBE', 'labels': ['Y_sv', 'B'], 'pot_type': 'paw'}","{'Y': 1.0, 'B': 6.0}",GGA,mp-2203,"['mp-1000404', 'mp-1006875', 'mp-2203', 'mp-1077859', 'mp-1440131', 'mp-1686414', 'mp-1801281', 'mp-1011609', 'mp-1592923']",3.48e-05,"{'Y': 1.0, 'B': 6.0}",69.026957252261,[],NM,False,221,0,"[0, 0, 0, 0, 0, 0, 0]",5.041508620005138e-07,3.48e-05,0,3.48e-05,MP,data/source/MP/cleaned/cifs/MP-mp-2203.cif,True,,data/final/MP/graphs/B6Fe0.1Y0.9-MP-mp-2203-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
B2C1Ho0.75Ni2Y0.25,3,0.0833333333333333,1.0,True,B2C1Ho0.75Ni2Y0.25,B2C1Ho1Ni2,8.9,Other,True,B33.333C16.667Ho12.5Ni33.333Y4.167,B-C-Ho-Ni-Y,5,Supercon,Ho0.75Y0.25Ni2B2C1,MP-mp-6646,Ho1Ni2B2C1,B-C-Ho-Ni,B33.333C16.667Ho16.667Ni33.333,I 4/m m m,tetragonal,3.529863997734658,3.529863997734658,5.76032203,data/final/MP/cifs/B2C1Ho0.75Ni2Y0.25-MP-mp-6646-synth_doped.cif,data/source/MP/raw/cifs/mp-6646.cif,mp-6646,0.0,,2011-05-13 04:24:09,8.11075125231065,10.17188/1281460,"@misc{osti_1281460,
    author = ""Persson, Kristin"",
    title = ""Materials Data on HoNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281460"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1670774'}},0.0,6.70981387,520.0,-41.84364575,-6.973940958333333,{'tags': ['Holmium dinickel diboride carbide']},-41.84364575,-6.973940958333333,-0.5192332130555558,"['xas', 'elasticity', 'bandstructure']",True,"[79064, 56650, 79065, 79062, 79063, 79575]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-6646,,HoNi2B2C,"{'functional': 'PBE', 'labels': ['Ho_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Ho': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6646,"['mp-1007146', 'mp-6646', 'mp-1000682', 'mp-1439301', 'mp-1670774', 'mp-1782657', 'mp-1011887', 'mp-1589032']",0.0032459,"{'Ho': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",64.68537905730652,[],NM,False,139,0,"[0.0, -0.0, -0.0, 0.0, 0.0, 0.0]",5.017980952271099e-05,0.0032459,0,0.0032459,MP,data/source/MP/cleaned/cifs/MP-mp-6646.cif,True,,data/final/MP/graphs/B2C1Ho0.75Ni2Y0.25-MP-mp-6646-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As2Ba0.5Fe1.9K0.5Ni0.1,2,0.04,2.0,False,As4Ba1Fe3.8K1Ni0.2,As4Ba1Fe4K1,26.75,Ferrite,True,As40Ba10Fe38K10Ni2,As-Ba-Fe-K-Ni,5,Supercon,Ba0.5K0.5Fe1.9Ni0.1As2,MP-mp-1223517,K1Ba1Fe4As4,As-Ba-Fe-K,As40Ba10Fe40K10,C m m m,orthorhombic,5.479027,5.480024002658328,7.13170472,data/final/MP/cifs/As2Ba0.5Fe1.9K0.5Ni0.1-MP-mp-1223517-synth_doped.cif,data/source/MP/raw/cifs/mp-1223517.cif,mp-1223517,0.0,,2019-01-12 23:54:03.876000,5.87534599912672,,,{'GGA': {'task_id': 'mp-1743010'}},0.0132513644999994,4.21185628,520.0,-59.66633886,-5.966633886,{'tags': []},-59.66633886,-5.966633886,-0.4120461663000007,[],False,[],True,2021-05-12 11:00:52.054000,FM,10,4,mp-1223517,,KBa(FeAs)4,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",GGA,mp-1223517,"['mp-1223517', 'mp-1396881', 'mp-1743010', 'mp-1827585']",0.9947188,"{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",197.6961518155852,[],FM,True,65,1,"[0.0, 0.0, 0.3, 0.3, 0.3, 0.3, 0.0, 0.0, 0.0, 0.0]",0.0050315536790412,0.9947188,4,0.9947188,MP,data/source/MP/cleaned/cifs/MP-mp-1223517.cif,True,,data/final/MP/graphs/As2Ba0.5Fe1.9K0.5Ni0.1-MP-mp-1223517-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Nb0.8Pd0.2,1,0.0,5.0,False,Nb4Pd1,Nb4Pd1,1.98,Other,True,Nb80Pd20,Nb-Pd,2,Supercon,Nb0.8Pd0.2,MP-mp-1220401,Nb4Pd1,Nb-Pd,Nb80Pd20,F m m m,orthorhombic,2.825980487504089,2.82598049,11.596635499999998,data/final/MP/cifs/Nb0.8Pd0.2-MP-mp-1220401.cif,data/source/MP/raw/cifs/mp-1220401.cif,mp-1220401,0.0,,2019-01-12 21:15:14.217000,8.995919496480209,,,{'GGA': {'task_id': 'mp-1760632'}},0.0225370139999991,5.00166034,520.0,-46.16866506,-9.233733012,{'tags': []},-46.16866506,-9.233733012,-0.1167126180000011,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,5,5,mp-1220401,,Nb4Pd,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Pd'], 'pot_type': 'paw'}","{'Nb': 4.0, 'Pd': 1.0}",GGA,mp-1220401,"['mp-1220401', 'mp-1387862', 'mp-1760632', 'mp-1782044', 'mp-1585413']",0.0018365,"{'Nb': 4.0, 'Pd': 1.0}",88.24148124977143,[],NM,False,69,0,"[0, 0, 0, 0, 0]",2.0812207297401385e-05,0.0018365,0,0.0018365,MP,data/source/MP/cleaned/cifs/MP-mp-1220401.cif,False,,data/final/MP/graphs/Nb0.8Pd0.2-MP-mp-1220401.json,0,True,mmm,0,0,0,7,0,0,0,0,0,0,1,1.0,False
Nb1Pt2,1,0.0,1.0,True,Nb1Pt2,Nb1Pt2,0.0,Other,True,Nb33.333Pt66.667,Nb-Pt,2,Supercon,Nb1Pt2,MP-mp-11514,Nb1Pt2,Nb-Pt,Nb33.333Pt66.667,I m m m,orthorhombic,2.826088000966543,4.01251600087279,4.940383369999999,data/final/MP/cifs/Nb1Pt2-MP-mp-11514.cif,data/source/MP/raw/cifs/mp-11514.cif,mp-11514,0.0,,2011-05-27 21:26:45,16.497626434342827,10.17188/1188022,"@misc{osti_1188022,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbPt2 (SG:71) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188022"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668465'}},0.0,6.94726863,520.0,-24.30389271,-8.10129757,"{'tags': ['Niobium platinum (1/2)', 'Platinum niobium (2/1)']}",-24.30389271,-8.10129757,-0.6869240833333331,"['xas', 'elasticity', 'bandstructure']",True,"[645233, 105200]",True,2021-05-12 10:56:12.755000,NM,3,12,mp-11514,,NbPt2,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Pt'], 'pot_type': 'paw'}","{'Nb': 1.0, 'Pt': 2.0}",GGA,mp-11514,"['mp-991528', 'mp-993479', 'mp-11514', 'mp-1062809', 'mp-1062922', 'mp-1063034', 'mp-1439553', 'mp-1668465', 'mp-1790565', 'mp-994788', 'mp-1596413', 'mp-1062965']",0.0025641,"{'Nb': 1.0, 'Pt': 2.0}",48.62298726765462,[],NM,False,71,0,"[0, 0, 0]",5.273431650518337e-05,0.0025641,0,0.0025641,MP,data/source/MP/cleaned/cifs/MP-mp-11514.cif,False,,data/final/MP/graphs/Nb1Pt2-MP-mp-11514.json,0,True,mmm,0,0,0,7,0,0,0,0,0,1,0,1.0,False
Br2C2Y2,1,0.0,1.0,True,Br2C2Y2,Br2C2Y2,5.04,Other,True,Br33.333C33.333Y33.333,Br-C-Y,3,Supercon,Y2Br2C2,MP-mp-643367,Y2C2Br2,Br-C-Y,Br33.333C33.333Y33.333,C 1 2/m 1,monoclinic,3.846773999724948,4.02928774,10.04420137,data/final/MP/cifs/Br2C2Y2-MP-mp-643367.cif,data/source/MP/raw/cifs/mp-643367.cif,mp-643367,0.0,,2013-06-28 23:28:36,4.453038714645779,10.17188/1280298,"@misc{osti_1280298,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YCBr (SG:12) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1280298"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698781'}},0.0,3.4577348,520.0,-41.14365364,-6.857275606666666,{'tags': ['Yttrium bromide carbide (2/2/2)']},-41.14365364,-6.857275606666666,-1.2585473713888884,"['xas', 'elasticity', 'bandstructure']",True,[78871],True,2021-05-12 10:56:27.046000,NM,6,11,mp-643367,,YCBr,"{'functional': 'PBE', 'labels': ['Y_sv', 'C', 'Br'], 'pot_type': 'paw'}","{'Y': 1.0, 'C': 1.0, 'Br': 1.0}",GGA,mp-643367,"['mp-643367', 'mp-1002327', 'mp-1003939', 'mp-1048935', 'mp-1048950', 'mp-1423619', 'mp-1698781', 'mp-1779867', 'mp-1009265', 'mp-1593059', 'mp-1048942']",0.0169429,"{'Y': 2.0, 'C': 2.0, 'Br': 2.0}",134.8560417099284,[],NM,False,12,0,"[0, 0, 0, 0, 0, 0]",0.000251273873757,0.0169429,0,0.0338858,MP,data/source/MP/cleaned/cifs/MP-mp-643367.cif,False,,data/final/MP/graphs/Br2C2Y2-MP-mp-643367.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
B1La1N1Ni1,1,0.0,2.0,False,B2La2N2Ni2,B2La2N2Ni2,1.96,Ferrite,True,B25La25N25Ni25,B-La-N-Ni,4,Supercon,La1Ni1B1N1,MP-mp-20881,La2Ni2B2N2,B-La-N-Ni,B25La25N25Ni25,P 4/n m m,tetragonal,3.779501,3.779501,7.307433,data/final/MP/cifs/B1La1N1Ni1-MP-mp-20881.cif,data/source/MP/raw/cifs/mp-20881.cif,mp-20881,0.0,,2015-01-21 11:53:01,7.076401417704857,10.17188/1196077,"@misc{osti_1196077,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaNiBN (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196077"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699032'}},0.0,9.42029533,520.0,-59.09440206,-7.3868002575,{'tags': ['Lanthanum nickel boron nitride']},-59.09440206,-7.3868002575,-1.044042637291667,"['xas', 'bandstructure']",True,"[77939, 262508]",True,2021-05-12 10:56:57.051000,NM,8,8,mp-20881,,LaNiBN,"{'functional': 'PBE', 'labels': ['La', 'Ni_pv', 'B', 'N'], 'pot_type': 'paw'}","{'La': 1.0, 'Ni': 1.0, 'B': 1.0, 'N': 1.0}",GGA,mp-20881,"['mp-927698', 'mp-917624', 'mp-927278', 'mp-20881', 'mp-1434191', 'mp-1699032', 'mp-1934813', 'mp-1588353']",0.00067965,"{'La': 2.0, 'Ni': 2.0, 'B': 2.0, 'N': 2.0}",104.3839606442116,[],NM,False,129,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.3022115578016026e-05,0.00067965,0,0.0013593,MP,data/source/MP/cleaned/cifs/MP-mp-20881.cif,False,,data/final/MP/graphs/B1La1N1Ni1-MP-mp-20881.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Co1Lu3,1,0.0,4.0,False,Co4Lu12,Co4Lu12,0.175,Other,True,Co25Lu75,Co-Lu,2,Supercon,Co1Lu3,MP-mp-1189116,Lu12Co4,Co-Lu,Co25Lu75,P n m a,orthorhombic,6.120835,6.824176,9.108132,data/final/MP/cifs/Co1Lu3-MP-mp-1189116.cif,data/source/MP/raw/cifs/mp-1189116.cif,mp-1189116,0.0,,2019-01-11 19:57:08.706000,10.19314986052506,,,,0.0,3.24829212,520.0,-86.14209655,-5.383881034375,"{'tags': ['Lutetium cobalt (3/1)', 'Fe3C', 'Lu3Co']}",-86.14209655,-5.383881034375,-0.2160886956249994,[],False,[624053],True,2021-05-12 10:59:54.607000,NM,16,3,mp-1189116,,Lu3Co,"{'functional': 'PBE', 'labels': ['Lu_3', 'Co'], 'pot_type': 'paw'}","{'Lu': 3.0, 'Co': 1.0}",GGA,mp-1189116,"['mp-1189116', 'mp-1842381', 'mp-1987577']",0.00020515,"{'Lu': 12.0, 'Co': 4.0}",380.44353413029216,[],NM,False,62,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0, -0.0, -0.0]",2.1569560956684982e-06,0.00020515,0,0.0008206,MP,data/source/MP/cleaned/cifs/MP-mp-1189116.cif,False,,data/final/MP/graphs/Co1Lu3-MP-mp-1189116.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Cl1Hf1N1Na0.28,2,0.0292682926829268,6.0,False,Cl6Hf6N6Na1.68,Cl6Hf6N6Na2,22.9,Other,True,Cl30.488Hf30.488N30.488Na8.537,Cl-Hf-N-Na,4,Supercon,Na0.28Hf1N1Cl1,MP-mp-1220765,Na2Hf6N6Cl6,Cl-Hf-N-Na,Cl30Hf30N30Na10,C 1 2/m 1,monoclinic,6.327425994906367,6.32844823,10.40157369,data/final/MP/cifs/Cl1Hf1N1Na0.28-MP-mp-1220765-synth_doped.cif,data/source/MP/raw/cifs/mp-1220765.cif,mp-1220765,0.0,,2019-01-12 21:33:40.303000,6.645973211107905,,,{'GGA': {'task_id': 'mp-1684280'}},0.1194778939999974,5.91846799,520.0,-157.73704614,-7.886852307,{'tags': []},-157.73704614,-7.886852307,-2.004433647155172,[],False,[],True,2021-05-12 11:00:47.244000,NM,20,4,mp-1220765,,NaHf3(NCl)3,"{'functional': 'PBE', 'labels': ['Na_pv', 'Hf_pv', 'N', 'Cl'], 'pot_type': 'paw'}","{'Na': 1.0, 'Hf': 3.0, 'N': 3.0, 'Cl': 3.0}",GGA,mp-1220765,"['mp-1220765', 'mp-1373092', 'mp-1684280', 'mp-1838829']",0.0001618,"{'Na': 2.0, 'Hf': 6.0, 'N': 6.0, 'Cl': 6.0}",353.21645722828464,[],NM,False,12,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",9.161521027058388e-07,0.0001618,0,0.0003236,MP,data/source/MP/cleaned/cifs/MP-mp-1220765.cif,True,,data/final/MP/graphs/Cl1Hf1N1Na0.28-MP-mp-1220765-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
Ba0.87Bi1K0.13O3,3,0.052,4.0,False,Ba3.48Bi4K0.52O12,Ba4Bi4O12,0.0,Oxide,True,Ba17.4Bi20K2.6O60,Ba-Bi-K-O,4,Supercon,Ba0.87K0.13Bi1O3,MP-mp-559051,Ba4Bi4O12,Ba-Bi-O,Ba20Bi20O60,P 1 21/c 1,monoclinic,6.244045,6.28001,8.808393428799683,data/final/MP/cifs/Ba0.87Bi1K0.13O3-MP-mp-559051-synth_doped.cif,data/source/MP/raw/cifs/mp-559051.cif,mp-559051,0.0769000000000001,,2015-02-15 08:08:39,7.5826930836026865,10.17188/1270621,"@misc{osti_1270621,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BaBiO3 (SG:14) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1270621"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1709167'}},0.0,3.73830111,520.0,-119.03610928,-5.951805464,"{'tags': ['Barium bismuth(III) bismuth(V) oxide', 'Perovskite, double']}",-119.03610928,-5.951805464,-2.2334278330000004,"['xas', 'elasticity', 'bandstructure']",True,[172756],True,2021-05-12 10:56:22.739000,NM,20,8,mp-559051,oxide,BaBiO3,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Bi': 1.0, 'O': 3.0}",GGA,mp-559051,"['mp-944043', 'mp-933995', 'mp-944705', 'mp-559051', 'mp-1422516', 'mp-1709167', 'mp-1843835', 'mp-1607458']",9.0625e-05,"{'Ba': 4.0, 'Bi': 4.0, 'O': 12.0}",345.39699590112576,[],NM,False,14,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.0495169451438142e-06,9.0625e-05,0,0.0003625,MP,data/source/MP/cleaned/cifs/MP-mp-559051.cif,True,,data/final/MP/graphs/Ba0.87Bi1K0.13O3-MP-mp-559051-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,1,0,0,0,1.0,False
Fe2P1,1,0.0,6.0,False,Fe12P6,Fe12P6,0.0,Ferrite,True,Fe66.667P33.333,Fe-P,2,Supercon,Fe2P1,MP-mp-1189340,Fe12P6,Fe-P,Fe66.667P33.333,I m m 2,orthorhombic,6.051285,6.516672,6.731531619441647,data/final/MP/cifs/Fe2P1-MP-mp-1189340.cif,data/source/MP/raw/cifs/mp-1189340.cif,mp-1189340,0.0,,2019-01-11 20:07:14.170000,7.131994240267425,,,,0.0,8.4712406,520.0,-142.36976555,-7.909431419444445,{'tags': ['Iron phosphide (2/1) - orthorhombic']},-142.36976555,-7.909431419444445,-0.4583249505555563,[],False,[169788],True,2021-05-12 10:59:54.607000,FM,18,2,mp-1189340,,Fe2P,"{'functional': 'PBE', 'labels': ['Fe_pv', 'P'], 'pot_type': 'paw'}","{'Fe': 2.0, 'P': 1.0}",GGA,mp-1189340,"['mp-1189340', 'mp-1834902']",3.007444983333333,"{'Fe': 12.0, 'P': 6.0}",199.29804389206151,[],FM,True,44,6,"[1.3, 1.3, 1.3, 1.3, 0.9, 0.9, 1.8, 1.8, 2.3, 2.3, 2.5, 1.1, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0905411289925799,3.007444983333333,12,18.0446699,MP,data/source/MP/cleaned/cifs/MP-mp-1189340.cif,False,,data/final/MP/graphs/Fe2P1-MP-mp-1189340.json,0,True,mm2,0,0,0,6,0,0,0,0,0,1,0,1.0,False
Ba2Cu4Pr0.2Y0.8O8,3,0.0266666666666666,1.0,True,Ba2Cu4Pr0.2Y0.8O8,Ba2Cu4Y1O8,66.78571429,Cuprate,True,Ba13.333Cu26.667Pr1.333Y5.333O53.333333333333336,Ba-Cu-Pr-Y-O,5,Supercon,Y0.8Pr0.2Ba2Cu4O8,MP-mp-6790,Ba2Y1Cu4O8,Ba-Cu-Y-O,Ba13.333Cu26.667Y6.667O53.333333333333336,C m m m,orthorhombic,3.889922,3.899603999537882,13.88942687,data/final/MP/cifs/Ba2Cu4Pr0.2Y0.8O8-MP-mp-6790-synth_doped.cif,data/source/MP/raw/cifs/mp-6790.cif,mp-6790,0.0,,2011-05-16 03:21:24,5.936250568336678,10.17188/1283441,"@misc{osti_1283441,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Y(CuO2)4 (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1283441"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686864'}},0.0,3.31391536,520.0,-91.58381472,-6.105587648,"{'tags': ['Yttrium barium copper oxide (1/2/4/8)', 'High pressure experimental phase']}",-91.58381472,-6.105587648,-2.0529924817777783,"['xas', 'bandstructure']",True,"[72261, 85273, 74251, 400273, 85277, 85275, 400280, 67632, 85272, 67631, 83920, 66613, 85279, 400277, 75689, 74259, 85278, 85280, 66603, 94265, 400276, 88873, 71417, 75712, 97052, 66605, 72258, 85281, 85274, 400279, 66604, 69698]",True,2021-05-12 10:57:34.594000,NM,15,10,mp-6790,oxide,Ba2Y(CuO2)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-6790,"['mp-1000664', 'mp-6790', 'mp-1007136', 'mp-1237713', 'mp-1440937', 'mp-1686864', 'mp-1834179', 'mp-1011883', 'mp-1590064', 'mp-1590433']",0.0004643,"{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",208.60454115924333,[],NM,False,65,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.225742533790601e-06,0.0004643,0,0.0004643,MP,data/source/MP/cleaned/cifs/MP-mp-6790.cif,True,,data/final/MP/graphs/Ba2Cu4Pr0.2Y0.8O8-MP-mp-6790-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
B2C1Ho0.9Lu0.1Ni2,2,0.0333333333333333,1.0,True,B2C1Ho0.9Lu0.1Ni2,B2C1Ho1Ni2,8.77,Other,True,B33.333C16.667Ho15Lu1.667Ni33.333,B-C-Ho-Lu-Ni,5,Supercon,Ho0.9Lu0.1Ni2B2C1,MP-mp-6646,Ho1Ni2B2C1,B-C-Ho-Ni,B33.333C16.667Ho16.667Ni33.333,I 4/m m m,tetragonal,3.529863997734658,3.529863997734658,5.76032203,data/final/MP/cifs/B2C1Ho0.9Lu0.1Ni2-MP-mp-6646-synth_doped.cif,data/source/MP/raw/cifs/mp-6646.cif,mp-6646,0.0,,2011-05-13 04:24:09,8.11075125231065,10.17188/1281460,"@misc{osti_1281460,
    author = ""Persson, Kristin"",
    title = ""Materials Data on HoNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281460"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1670774'}},0.0,6.70981387,520.0,-41.84364575,-6.973940958333333,{'tags': ['Holmium dinickel diboride carbide']},-41.84364575,-6.973940958333333,-0.5192332130555558,"['xas', 'elasticity', 'bandstructure']",True,"[79064, 56650, 79065, 79062, 79063, 79575]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-6646,,HoNi2B2C,"{'functional': 'PBE', 'labels': ['Ho_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Ho': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6646,"['mp-1007146', 'mp-6646', 'mp-1000682', 'mp-1439301', 'mp-1670774', 'mp-1782657', 'mp-1011887', 'mp-1589032']",0.0032459,"{'Ho': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",64.68537905730652,[],NM,False,139,0,"[0.0, -0.0, -0.0, 0.0, 0.0, 0.0]",5.017980952271099e-05,0.0032459,0,0.0032459,MP,data/source/MP/cleaned/cifs/MP-mp-6646.cif,True,,data/final/MP/graphs/B2C1Ho0.9Lu0.1Ni2-MP-mp-6646-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Hf0.84Nb0.16V2,3,0.1066666666666666,2.0,False,Hf1.68Nb0.32V4,Hf2V4,10.67,Other,True,Hf28Nb5.333V66.667,Hf-Nb-V,3,Supercon,V2Hf0.84Nb0.16,MP-mp-1077017,Hf2V4,Hf-V,Hf33.333V66.667,I 41/a m d,tetragonal,5.147745850539648,5.14774585,5.14774585,data/final/MP/cifs/Hf0.84Nb0.16V2-MP-mp-1077017-synth_doped.cif,data/source/MP/raw/cifs/mp-1077017.cif,mp-1077017,0.0,,2018-04-07 18:44:03,9.47163160017764,,,{'GGA': {'task_id': 'mp-1759109'}},0.0337706083333326,5.06389256,520.0,-56.04737833,-9.341229721666666,{'tags': ['Hafnium vanadium (1/2)']},-56.04737833,-9.341229721666666,0.033770608333332,['bandstructure'],True,[187951],True,2021-05-12 10:58:14.654000,NM,6,5,mp-1077017,,HfV2,"{'functional': 'PBE', 'labels': ['Hf_pv', 'V_pv'], 'pot_type': 'paw'}","{'Hf': 1.0, 'V': 2.0}",GGA,mp-1077017,"['mp-1077017', 'mp-1391381', 'mp-1759109', 'mp-1796366', 'mp-1627385']",0.03458425,"{'Hf': 2.0, 'V': 4.0}",98.30836742237948,[],NM,False,141,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0007035871087434,0.03458425,0,0.0691685,MP,data/source/MP/cleaned/cifs/MP-mp-1077017.cif,True,,data/final/MP/graphs/Hf0.84Nb0.16V2-MP-mp-1077017-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ir1Os1Th1,1,0.0,2.0,False,Ir2Os2Th2,Ir2Os2Th2,3.61,Other,True,Ir33.333Os33.333Th33.333,Ir-Os-Th,3,Supercon,Th1Ir1Os1,MP-mp-1217331,Th2Ir2Os2,Ir-Os-Th,Ir33.333Os33.333Th33.333,I m m a,orthorhombic,5.229975999739646,5.51065975,5.510659749819138,data/final/MP/cifs/Ir1Os1Th1-MP-mp-1217331.cif,data/source/MP/raw/cifs/mp-1217331.cif,mp-1217331,0.0,,2019-01-12 18:41:08.802000,17.693529320010914,,,{'GGA': {'task_id': 'mp-1760937'}},0.1405699283333366,8.83618928,520.0,-58.21941631,-9.703236051666666,{'tags': []},-58.21941631,-9.703236051666666,-0.5433510766666672,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,6,5,mp-1217331,,ThIrOs,"{'functional': 'PBE', 'labels': ['Th', 'Ir', 'Os_pv'], 'pot_type': 'paw'}","{'Th': 1.0, 'Ir': 1.0, 'Os': 1.0}",GGA,mp-1217331,"['mp-1217331', 'mp-1384641', 'mp-1760937', 'mp-1803919', 'mp-1626460']",9.775e-05,"{'Th': 2.0, 'Ir': 2.0, 'Os': 2.0}",115.33893883093477,[],NM,False,74,0,"[0, 0, 0, 0, 0, 0]",1.6950043236184645e-06,9.775e-05,0,0.0001955,MP,data/source/MP/cleaned/cifs/MP-mp-1217331.cif,False,,data/final/MP/graphs/Ir1Os1Th1-MP-mp-1217331.json,0,True,mmm,0,0,0,7,0,0,0,0,0,1,0,1.0,False
Al1Nb2.859V0.141,3,0.0705,2.0,False,Al2Nb5.718V0.282,Al2Nb6,17.2,Other,True,Al25Nb71.475V3.525,Al-Nb-V,3,Supercon,Nb2.859V0.141Al1,MP-mp-796,Nb6Al2,Al-Nb,Al25Nb75,P m -3 n,cubic,5.215254,5.215254,5.215254,data/final/MP/cifs/Al1Nb2.859V0.141-MP-mp-796-synth_doped.cif,data/source/MP/raw/cifs/mp-796.cif,mp-796,0.0,,2011-05-13 16:07:37,7.157298025966356,,,{'GGA': {'task_id': 'mp-1686893'}},0.0460773865000003,5.52947534,520.0,-69.48918494,-8.6861481175,"{'tags': ['Aluminium niobium (1/3)', 'Niobium aluminide (3/1)', 'Aluminum niobium (1/3)']}",-69.48918494,-8.6861481175,-0.1737753800000003,"['bandstructure', 'elasticity']",True,"[608675, 608654, 608688, 608668, 608669, 608685, 608676, 608683, 58014, 608657, 107856, 608655, 608666, 608691, 608656, 608665, 608673, 608653, 608661]",True,2021-05-12 10:56:31.128000,NM,8,10,mp-796,,Nb3Al,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Al': 1.0}",GGA,mp-796,"['mp-911586', 'mp-927906', 'mp-796', 'mp-927472', 'mp-1260512', 'mp-1440919', 'mp-1686893', 'mp-1927652', 'mp-1591599', 'mp-1587739']",0.16323955,"{'Nb': 6.0, 'Al': 2.0}",141.8490379078192,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0023015954483396,0.16323955,0,0.3264791,MP,data/source/MP/cleaned/cifs/MP-mp-796.cif,True,,data/final/MP/graphs/Al1Nb2.859V0.141-MP-mp-796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Si2Y1,1,0.0,2.0,False,Si4Y2,Si4Y2,0.0,Other,True,Si66.667Y33.333,Si-Y,2,Supercon,Si2Y1,MP-mp-12769,Y2Si4,Si-Y,Si66.667Y33.333,I 41/a m d,tetragonal,3.995300002194591,3.995300002194591,7.819317710000001,data/final/MP/cifs/Si2Y1-MP-mp-12769.cif,data/source/MP/raw/cifs/mp-12769.cif,mp-12769,0.0,,2011-05-27 23:41:56,4.139842478163755,10.17188/1189176,"@misc{osti_1189176,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YSi2 (SG:141) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189176"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698596'}},0.0438692750000004,7.01000549,520.0,-37.92151639,-6.320252731666667,{'tags': ['Yttrium silicide (1/2) - HT']},-37.92151639,-6.320252731666667,-0.5005530138888888,"['xas', 'elasticity', 'bandstructure']",True,[150662],True,2021-05-12 10:56:12.755000,NM,6,14,mp-12769,,YSi2,"{'functional': 'PBE', 'labels': ['Y_sv', 'Si'], 'pot_type': 'paw'}","{'Y': 1.0, 'Si': 2.0}",GGA,mp-12769,"['mp-919587', 'mp-918579', 'mp-905391', 'mp-12769', 'mp-1071778', 'mp-1071760', 'mp-1071798', 'mp-1077276', 'mp-1143579', 'mp-1440469', 'mp-1698596', 'mp-1803016', 'mp-1586173', 'mp-1071796']",0.00013215,"{'Y': 2.0, 'Si': 4.0}",116.38403072337334,[],NM,False,141,0,"[0, 0, 0, 0, 0, 0]",2.2709301126389048e-06,0.00013215,0,0.0002643,MP,data/source/MP/cleaned/cifs/MP-mp-12769.cif,False,,data/final/MP/graphs/Si2Y1-MP-mp-12769.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
La1Ru2,1,0.0,2.0,False,La2Ru4,La2Ru4,3.7032,Other,True,La33.333Ru66.667,La-Ru,2,Supercon,La1Ru2,MP-mp-2019,La2Ru4,La-Ru,La33.333Ru66.667,F d -3 m,cubic,5.46409128,5.464091279999999,5.464091279999999,data/final/MP/cifs/La1Ru2-MP-mp-2019.cif,data/source/MP/raw/cifs/mp-2019.cif,mp-2019,0.0,,2011-05-13 21:42:56,9.818667150990734,10.17188/1195329,"@misc{osti_1195329,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaRu2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195329"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686817'}},0.0017745359523804,8.6251779,520.0,-47.76122776,-7.960204626666666,"{'tags': ['Lanthanum ruthenium hydride (1/2/4)', 'Lanthanum ruthenium (1/2)']}",-47.76122776,-7.960204626666666,-0.1319424883333321,"['xas', 'elasticity', 'bandstructure']",True,"[104712, 641760, 641778, 638256, 641771, 641766, 641774, 638255, 641762, 104713, 641761, 641775, 641777]",True,2021-05-12 10:56:14.760000,NM,6,14,mp-2019,,LaRu2,"{'functional': 'PBE', 'labels': ['La', 'Ru_pv'], 'pot_type': 'paw'}","{'La': 1.0, 'Ru': 2.0}",GGA,mp-2019,"['mp-935098', 'mp-941760', 'mp-941909', 'mp-2019', 'mp-1072861', 'mp-1072969', 'mp-1072939', 'mp-1077306', 'mp-1442150', 'mp-1686817', 'mp-1803378', 'mp-1590466', 'mp-1596026', 'mp-1072974']",0.000191,"{'La': 2.0, 'Ru': 4.0}",115.35564200581236,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",3.311498192526659e-06,0.000191,0,0.000382,MP,data/source/MP/cleaned/cifs/MP-mp-2019.cif,False,,data/final/MP/graphs/La1Ru2-MP-mp-2019.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Cu1La1.828Sr0.172O4,3,0.0491428571428571,1.0,True,Cu1La1.828Sr0.172O4,Cu1La2O4,39.35,Cuprate,True,Cu14.286La26.114Sr2.457O57.142857142857146,Cu-La-Sr-O,4,Supercon,La1.828Sr0.172Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La1.828Sr0.172O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La1.828Sr0.172O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Cr3Ge1,1,0.0,2.0,False,Cr6Ge2,Cr6Ge2,0.0,Other,True,Cr75Ge25,Cr-Ge,2,Supercon,Cr3Ge1,MP-mp-20685,Cr6Ge2,Cr-Ge,Cr75Ge25,P m -3 n,cubic,4.588331,4.588331,4.588331,data/final/MP/cifs/Cr3Ge1-MP-mp-20685.cif,data/source/MP/raw/cifs/mp-20685.cif,mp-20685,0.0,,2014-02-22 11:56:41,7.860403851200858,10.17188/1195843,"@misc{osti_1195843,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Cr3Ge (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195843"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-926431'}},0.0,7.17973754,520.0,-68.05982841,-8.50747855125,"{'tags': ['Chromium germanium (3/1)', 'Germanium chromium (1/3)', 'Chromium germanide (3/1)']}",-68.05982841,-8.50747855125,-0.1119359849999988,"['xas', 'elasticity', 'bandstructure']",True,"[189870, 626086, 626094, 626089, 186002, 626098, 53127, 626082]",True,2021-05-12 10:56:14.760000,NM,8,9,mp-20685,,Cr3Ge,"{'functional': 'PBE', 'labels': ['Cr_pv', 'Ge_d'], 'pot_type': 'paw'}","{'Cr': 3.0, 'Ge': 1.0}",GGA,mp-20685,"['mp-926956', 'mp-926431', 'mp-910691', 'mp-20685', 'mp-1079114', 'mp-1079293', 'mp-1439461', 'mp-1796375', 'mp-1588382']",0.0013865,"{'Cr': 6.0, 'Ge': 2.0}",96.59712937582589,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",2.8706857211162248e-05,0.0013865,0,0.002773,MP,data/source/MP/cleaned/cifs/MP-mp-20685.cif,False,,data/final/MP/graphs/Cr3Ge1-MP-mp-20685.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Al3Pd2U0.98Y0.02,2,0.0066666666666666,1.0,True,Al3Pd2U0.98Y0.02,Al3Pd2U1,0.0,Heavy_fermion,True,Al50Pd33.333U16.333Y0.333,Al-Pd-U-Y,4,Supercon,U0.98Y0.02Pd2Al3,MP-mp-4561,U1Al3Pd2,Al-Pd-U,Al50Pd33.333U16.667,P 6/m m m,hexagonal,4.239652,5.384229999094356,5.3842309,data/final/MP/cifs/Al3Pd2U0.98Y0.02-MP-mp-4561-synth_doped.cif,data/source/MP/raw/cifs/mp-4561.cif,mp-4561,0.0,,2011-05-12 23:59:10,8.296603403902926,10.17188/1208253,"@misc{osti_1208253,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UAl3Pd2 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208253"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700804'}},0.0796314472916668,8.0468212,520.0,-36.36476907,-6.060794845,"{'tags': ['Aluminium palladium uranium (3/2/1)', 'Aluminum palladium uranium (3/2/1)']}",-36.36476907,-6.060794845,-0.5794779916666665,"['xas', 'elasticity', 'bandstructure']",True,"[657574, 106242, 659234]",True,2021-05-12 10:56:20.740000,FM,6,9,mp-4561,,UAl3Pd2,"{'functional': 'PBE', 'labels': ['U', 'Al', 'Pd'], 'pot_type': 'paw'}","{'U': 1.0, 'Al': 3.0, 'Pd': 2.0}",GGA,mp-4561,"['mp-4561', 'mp-991619', 'mp-993538', 'mp-1251974', 'mp-1441898', 'mp-1700804', 'mp-1933710', 'mp-994863', 'mp-1593816']",2.2050571,"{'U': 1.0, 'Al': 3.0, 'Pd': 2.0}",106.4408038742404,[],FM,True,191,1,"[2.2, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0207162762750765,2.2050571,1,2.2050571,MP,data/source/MP/cleaned/cifs/MP-mp-4561.cif,True,,data/final/MP/graphs/Al3Pd2U0.98Y0.02-MP-mp-4561-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Al0.2Nb3Sn0.8,3,0.0999999999999999,2.0,False,Al0.4Nb6Sn1.6,Nb6Sn2,16.85,Other,True,Al5Nb75Sn20,Al-Nb-Sn,3,Supercon,Nb3Sn0.8Al0.2,MP-mp-1326,Nb6Sn2,Nb-Sn,Nb75Sn25,P m -3 n,cubic,5.334611,5.334611,5.334611,data/final/MP/cifs/Al0.2Nb3Sn0.8-MP-mp-1326-synth_doped.cif,data/source/MP/raw/cifs/mp-1326.cif,mp-1326,0.0,,2011-05-14 09:51:48,8.694218121896231,10.17188/1189484,"@misc{osti_1189484,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Sn (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189484"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668415'}},0.0,6.59372491,520.0,-69.93787048,-8.74223381,{'tags': ['Niobium tin (3/1)']},-69.93787048,-8.74223381,-0.163862066250001,"['xas', 'elasticity', 'bandstructure']",True,"[105230, 645503, 645489, 105231, 645498, 645485, 645474, 645496, 645480, 645488, 645482, 645487, 645500, 645493, 645477, 645484, 645502, 645483, 150878, 645479, 645481, 645486, 645473]",True,2021-05-12 10:56:12.755000,NM,8,9,mp-1326,,Nb3Sn,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Sn_d'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Sn': 1.0}",GGA,mp-1326,"['mp-930046', 'mp-913770', 'mp-930577', 'mp-1326', 'mp-1440651', 'mp-1668415', 'mp-1880085', 'mp-1594093', 'mp-1594507']",0.62023085,"{'Nb': 6.0, 'Sn': 2.0}",151.81275738025872,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0081709977567491,0.62023085,0,1.2404617,MP,data/source/MP/cleaned/cifs/MP-mp-1326.cif,True,,data/final/MP/graphs/Al0.2Nb3Sn0.8-MP-mp-1326-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Sr4V3O9.44,3,0.0866180048661799,0.25,False,Sr1V0.75O2.36,Sr1V1O3,0.0,Oxide,True,Sr24.331V18.248O57.42092457420925,Sr-V-O,3,Supercon,Sr4V3O9.44,MP-mp-18717,Sr1V1O3,Sr-V-O,Sr20V20O60,P m -3 m,cubic,3.900891,3.900891,3.900891,data/final/MP/cifs/Sr4V3O9.44-MP-mp-18717-synth_doped.cif,data/source/MP/raw/cifs/mp-18717.cif,mp-18717,0.0,,2014-02-15 00:19:39,5.21885807260035,10.17188/1193364,"@misc{osti_1193364,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SrVO3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1193364"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",,0.0391016768603389,4.67096136,520.0,-36.25355595,-7.25071119,{'tags': ['Strontium vanadate(IV)']},-36.25355595,-7.25071119,-2.8794546823333342,"['xas', 'elasticity']",False,"[108826, 96291, 88982]",True,2021-05-12 10:56:14.760000,FM,5,2,mp-18717,oxide,SrVO3,"{'functional': 'PBE', 'labels': ['Sr_sv', 'V_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 1.0, 'V': 1.0, 'O': 3.0}",GGA+U,mp-18717,"['mp-18717', 'mp-1794484']",0.999467,"{'Sr': 1.0, 'V': 1.0, 'O': 3.0}",59.35966561911505,[],FM,True,221,1,"[0.0, 1.1, 0.0, 0.0, 0.0]",0.0168374769226825,0.999467,1,0.999467,MP,data/source/MP/cleaned/cifs/MP-mp-18717.cif,True,,data/final/MP/graphs/Sr4V3O9.44-MP-mp-18717-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
C1Hf0.05Mo0.95,2,0.05,1.0,True,C1Hf0.05Mo0.95,C1Mo1,12.7,Other,True,C50Hf2.5Mo47.5,C-Hf-Mo,3,Supercon,Mo0.95Hf0.05C1,MP-mp-2305,Mo1C1,C-Mo,C50Mo50,P -6 m 2,hexagonal,2.835086,2.92410600478411,2.92410507,data/final/MP/cifs/C1Hf0.05Mo0.95-MP-mp-2305-synth_doped.cif,data/source/MP/raw/cifs/mp-2305.cif,mp-2305,0.0,,2011-05-12 17:49:42,8.538697979393088,10.17188/1199194,"@misc{osti_1199194,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MoC (SG:187) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199194"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668222'}},0.0010243049999996,8.62658168,520.0,-20.24014809,-10.120074045,{'tags': ['Molybdenum carbide (1/1)']},-20.24014809,-10.120074045,-0.0838621800000005,"['xas', 'elasticity', 'bandstructure']",True,"[77156, 618300]",True,2021-05-12 10:56:16.728000,NM,2,9,mp-2305,,MoC,"{'functional': 'PBE', 'labels': ['Mo_pv', 'C'], 'pot_type': 'paw'}","{'Mo': 1.0, 'C': 1.0}",GGA,mp-2305,"['mp-927633', 'mp-927239', 'mp-911174', 'mp-2305', 'mp-1116092', 'mp-1440368', 'mp-1668222', 'mp-1791400', 'mp-1638434']",0.0001977,"{'Mo': 1.0, 'C': 1.0}",20.99340614335182,[],NM,False,187,0,"[0, 0]",9.417242664197564e-06,0.0001977,0,0.0001977,MP,data/source/MP/cleaned/cifs/MP-mp-2305.cif,True,,data/final/MP/graphs/C1Hf0.05Mo0.95-MP-mp-2305-synth_doped.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Ag1Y1,1,0.0,1.0,True,Ag1Y1,Ag1Y1,0.0,Other,True,Ag50Y50,Ag-Y,2,Supercon,Ag1Y1,MP-mp-2474,Y1Ag1,Ag-Y,Ag50Y50,P m -3 m,cubic,3.653523,3.653523,3.653523,data/final/MP/cifs/Ag1Y1-MP-mp-2474.cif,data/source/MP/raw/cifs/mp-2474.cif,mp-2474,0.0,,2011-05-12 19:07:54,6.700101543631394,10.17188/1200216,"@misc{osti_1200216,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YAg (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1200216"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688495'}},0.0,3.59635234,520.0,-9.9587341,-4.97936705,"{'tags': ['Silver yttrium (1/1)', 'Yttrium silver (1/1)']}",-9.9587341,-4.97936705,-0.3298534916666664,"['xas', 'elasticity', 'bandstructure']",True,"[605963, 605954, 190092, 190974, 604535, 58376]",True,2021-05-12 10:56:16.728000,NM,2,17,mp-2474,,YAg,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ag'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ag': 1.0}",GGA,mp-2474,"['mp-912036', 'mp-928663', 'mp-928128', 'mp-2474', 'mp-1059365', 'mp-1059403', 'mp-1059374', 'mp-1059548', 'mp-1059555', 'mp-1059578', 'mp-1442192', 'mp-1688495', 'mp-1784186', 'mp-1597185', 'mp-1597004', 'mp-1059579', 'mp-1059404']",0.0060224,"{'Y': 1.0, 'Ag': 1.0}",48.76806645246836,[],NM,False,221,0,"[0, 0]",0.0001234906453769,0.0060224,0,0.0060224,MP,data/source/MP/cleaned/cifs/MP-mp-2474.cif,False,,data/final/MP/graphs/Ag1Y1-MP-mp-2474.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Cu1Sr2O3.2,2,0.032258064516129,0.9376666666666664,True,Cu0.938Sr1.875O3,Cu1Sr2O3,0.0,Cuprate,True,Cu16.129Sr32.258O51.612903225806456,Cu-Sr-O,3,Supercon,Sr2Cu1O3.2,MP-mp-5456,Sr2Cu1O3,Cu-Sr-O,Cu16.667Sr33.333O50,I m m m,orthorhombic,3.5486719996916936,3.973221999464672,6.882681430000001,data/final/MP/cifs/Cu1Sr2O3.2-MP-mp-5456-synth_doped.cif,data/source/MP/raw/cifs/mp-5456.cif,mp-5456,0.0,,2011-05-13 06:08:08,5.321943242365502,10.17188/1267081,"@misc{osti_1267081,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr2CuO3 (SG:71) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1267081"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668116'}},0.0,3.61711129,520.0,-34.88196178,-5.813660296666666,"{'tags': ['Distrontium cuprate', 'Distrontium copper oxide', 'Distrontium cuprate(II)', 'High pressure experimental phase']}",-34.88196178,-5.813660296666666,-2.4368141980555555,"['xas', 'elasticity', 'bandstructure']",True,"[151807, 151808, 151812, 151809, 151810, 202993, 246686, 15127, 151811]",True,2021-05-12 10:56:22.739000,NM,6,9,mp-5456,oxide,Sr2CuO3,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Cu': 1.0, 'O': 3.0}",GGA,mp-5456,"['mp-990251', 'mp-990223', 'mp-5456', 'mp-1142034', 'mp-1440170', 'mp-1668116', 'mp-1782763', 'mp-990260', 'mp-1588501']",0.0018128,"{'Sr': 2.0, 'Cu': 1.0, 'O': 3.0}",89.48166977668829,[],NM,False,71,0,"[0, 0, 0, 0, 0, 0]",2.0258897766705173e-05,0.0018128,0,0.0018128,MP,data/source/MP/cleaned/cifs/MP-mp-5456.cif,True,,data/final/MP/graphs/Cu1Sr2O3.2-MP-mp-5456-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,0,1,0,1.0,False
Ba2Co1Cu2Y1O7.33,2,0.022851866812857,0.9549959072305594,True,Ba1.91Co0.955Cu1.91Y0.955O7,Ba2Co1Cu2Y1O7,0.0,Cuprate,True,Ba15.004Co7.502Cu15.004Y7.502O54.9887471867967,Ba-Co-Cu-Y-O,5,Supercon,Y1Ba2Cu2Co1O7.33,MP-mp-1214571,Ba2Y1Co1Cu2O7,Ba-Co-Cu-Y-O,Ba15.385Co7.692Cu15.385Y7.692O53.84615384615385,P m m m,orthorhombic,3.86629601,3.91930101,11.819924,data/final/MP/cifs/Ba2Co1Cu2Y1O7.33-MP-mp-1214571-synth_doped.cif,data/source/MP/raw/cifs/mp-1214571.cif,mp-1214571,0.0,,2019-01-12 16:23:33.184000,6.133574139151574,,,{'GGA+U': {'task_id': 'mp-1720354'}},0.0401337653108972,3.39484028,520.0,-82.69443448,-6.361110344615384,"{'tags': ['Ba2Cu3YO7', 'high-Tc cuprate family', 'Ba2Cu2.95YCo0.05O7']}",-82.69443448,-6.361110344615384,-2.222658733589744,[],False,[],True,2021-05-12 11:00:35.508000,FM,13,29,mp-1214571,oxide,Ba2YCoCu2O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Co', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Co': 1.0, 'Cu': 2.0, 'O': 7.0}",GGA+U,mp-1214571,"['mp-1214571', 'mp-1289285', 'mp-1293149', 'mp-1284703', 'mp-1316036', 'mp-1310862', 'mp-1314594', 'mp-1307897', 'mp-1310186', 'mp-1313917', 'mp-1307955', 'mp-1320648', 'mp-1306530', 'mp-1311782', 'mp-1303620', 'mp-1318538', 'mp-1309592', 'mp-1305900', 'mp-1305902', 'mp-1322322', 'mp-1304479', 'mp-1303747', 'mp-1304542', 'mp-1309099', 'mp-1316563', 'mp-1302424', 'mp-1310638', 'mp-1446471', 'mp-1720354']",2.4388165,"{'Ba': 2.0, 'Y': 1.0, 'Co': 1.0, 'Cu': 2.0, 'O': 7.0}",179.10940895363504,[],FM,True,47,1,"[0.0, 0.0, 0.0, 2.1, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0136163505549355,2.4388165,1,2.4388165,MP,data/source/MP/cleaned/cifs/MP-mp-1214571.cif,True,,data/final/MP/graphs/Ba2Co1Cu2Y1O7.33-MP-mp-1214571-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
B2C1Ho0.15Lu0.85Ni2,2,0.05,1.0,True,B2C1Ho0.15Lu0.85Ni2,B2C1Lu1Ni2,15.1,Other,True,B33.333C16.667Ho2.5Lu14.167Ni33.333,B-C-Ho-Lu-Ni,5,Supercon,Ho0.15Lu0.85Ni2B2C1,MP-mp-6544,Lu1Ni2B2C1,B-C-Lu-Ni,B33.333C16.667Lu16.667Ni33.333,I 4/m m m,tetragonal,3.4660159989239463,3.4660159989239463,5.81490896,data/final/MP/cifs/B2C1Ho0.15Lu0.85Ni2-MP-mp-6544-synth_doped.cif,data/source/MP/raw/cifs/mp-6544.cif,mp-6544,0.0,,2011-05-13 04:17:06,8.54504130524706,10.17188/1281287,"@misc{osti_1281287,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LuNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281287"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702891'}},0.0,6.71335166,520.0,-41.78223818,-6.963706363333333,{'tags': []},-41.78223818,-6.963706363333333,-0.5192416763888884,"['xas', 'bandstructure']",True,"[75609, 83230, 79564]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6544,,LuNi2B2C,"{'functional': 'PBE', 'labels': ['Lu_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Lu': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6544,"['mp-1000584', 'mp-1007055', 'mp-6544', 'mp-1441469', 'mp-1702891', 'mp-1783160', 'mp-1011794', 'mp-1588498']",0.0023161,"{'Lu': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",63.34823894903922,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",3.656139520884231e-05,0.0023161,0,0.0023161,MP,data/source/MP/cleaned/cifs/MP-mp-6544.cif,True,,data/final/MP/graphs/B2C1Ho0.15Lu0.85Ni2-MP-mp-6544-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
C0.9Nb2S1,2,0.0384615384615384,2.0,False,C1.8Nb4S2,C2Nb4S2,5.0,Other,True,C23.077Nb51.282S25.641,C-Nb-S,3,Supercon,Nb2S1C0.9,MP-mp-9988,Nb4C2S2,C-Nb-S,C25Nb50S25,P 63/m m c,hexagonal,3.343598003728437,3.34359817,11.580941,data/final/MP/cifs/C0.9Nb2S1-MP-mp-9988-synth_doped.cif,data/source/MP/raw/cifs/mp-9988.cif,mp-9988,0.0,,2011-05-28 14:17:21,6.80916159531999,10.17188/1317400,"@misc{osti_1317400,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb2CS (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1317400"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703916'}},0.0247363409375012,7.73433733,520.0,-73.20869059,-9.15108632375,"{'tags': ['Niobium sulfide carbide (2/1/1)', 'Diniobium sulfide carbide']}",-73.20869059,-9.15108632375,-0.8853761620312515,"['xas', 'elasticity', 'bandstructure']",True,"[43010, 180619]",True,2021-05-12 10:56:37.246000,NM,8,8,mp-9988,,Nb2CS,"{'functional': 'PBE', 'labels': ['Nb_pv', 'C', 'S'], 'pot_type': 'paw'}","{'Nb': 2.0, 'C': 1.0, 'S': 1.0}",GGA,mp-9988,"['mp-909913', 'mp-925443', 'mp-9988', 'mp-925879', 'mp-1415588', 'mp-1703916', 'mp-1802770', 'mp-1593375']",0.00040745,"{'Nb': 4.0, 'C': 2.0, 'S': 2.0}",112.12504313391082,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",7.267778697991365e-06,0.00040745,0,0.0008149,MP,data/source/MP/cleaned/cifs/MP-mp-9988.cif,True,,data/final/MP/graphs/C0.9Nb2S1-MP-mp-9988-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ir0.97Pt0.03Te2,2,0.02,4.0,False,Ir3.88Pt0.12Te8,Ir4Te8,3.07,Other,True,Ir32.333Pt1Te66.667,Ir-Pt-Te,3,Supercon,Ir0.97Pt0.03Te2,MP-mp-569322,Te8Ir4,Ir-Te,Ir33.333Te66.667,P n m a,orthorhombic,4.049805,5.441863,13.587474,data/final/MP/cifs/Ir0.97Pt0.03Te2-MP-mp-569322-synth_doped.cif,data/source/MP/raw/cifs/mp-569322.cif,mp-569322,0.0,,2014-02-16 04:48:25,9.924328423353325,10.17188/1275037,"@misc{osti_1275037,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Te2Ir (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1275037"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1746248'}},0.0123894575000003,7.60847828,520.0,-63.94410921,-5.3286757675,{'tags': ['Iridium telluride (1/2)']},-63.94410921,-5.3286757675,-0.5683316741666667,"['xas', 'bandstructure']",True,[93894],True,2021-05-12 10:57:24.969000,NM,12,7,mp-569322,,Te2Ir,"{'functional': 'PBE', 'labels': ['Te', 'Ir'], 'pot_type': 'paw'}","{'Te': 2.0, 'Ir': 1.0}",GGA,mp-569322,"['mp-927873', 'mp-927408', 'mp-569322', 'mp-911451', 'mp-1392626', 'mp-1746248', 'mp-1810340']",0.000153075,"{'Te': 8.0, 'Ir': 4.0}",299.44732816890644,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.0447669503153013e-06,0.000153075,0,0.0006123,MP,data/source/MP/cleaned/cifs/MP-mp-569322.cif,True,,data/final/MP/graphs/Ir0.97Pt0.03Te2-MP-mp-569322-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
C2Cu0.05La1Ni0.95,2,0.025,1.0,True,C2Cu0.05La1Ni0.95,C2La1Ni1,3.15,Other,True,C50Cu1.25La25Ni23.75,C-Cu-La-Ni,4,Supercon,La1Ni0.95Cu0.05C2,MP-mp-1018048,La1Ni1C2,C-La-Ni,C50La25Ni25,A m m 2,orthorhombic,3.82731293,3.82731293,3.977635,data/final/MP/cifs/C2Cu0.05La1Ni0.95-MP-mp-1018048-synth_doped.cif,data/source/MP/raw/cifs/mp-1018048.cif,mp-1018048,0.0,,2017-04-06 23:27:44,6.5955568384756855,10.17188/1350127,"@article{osti_1350127,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaNiC2 (SG:38) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1350127"",
    place = ""United States"",
    year = ""2017"",
    month = ""4""
}
",{'GGA': {'task_id': 'mp-1697101'}},0.0,8.87914765,520.0,-30.18892584,-7.54723146,"{'tags': ['LaNiC2', 'Lanthanum nickel carbide (1/1/2)', 'CeNiC2']}",-30.18892584,-7.54723146,-0.2548051637499995,"['bandstructure', 'elasticity']",True,[618179],True,2021-05-12 10:56:08.727000,NM,4,12,mp-1018048,,LaNiC2,"{'functional': 'PBE', 'labels': ['La', 'Ni_pv', 'C'], 'pot_type': 'paw'}","{'La': 1.0, 'Ni': 1.0, 'C': 2.0}",GGA,mp-1018048,"['mp-1018048', 'mp-1018270', 'mp-1018463', 'mp-1067001', 'mp-1067047', 'mp-1067181', 'mp-1115476', 'mp-1412950', 'mp-1697101', 'mp-1783297', 'mp-1594865', 'mp-1067093']",0.005804,"{'La': 1.0, 'Ni': 1.0, 'C': 2.0}",55.79651958097468,[],NM,False,38,0,"[0.0, -0.0, 0.0, 0.0]",0.0001040208250189,0.005804,0,0.005804,MP,data/source/MP/cleaned/cifs/MP-mp-1018048.cif,True,,data/final/MP/graphs/C2Cu0.05La1Ni0.95-MP-mp-1018048-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Al0.5Ga0.5Nb3,1,0.0,2.0,False,Al1Ga1Nb6,Al1Ga1Nb6,18.75,Other,True,Al12.5Ga12.5Nb75,Al-Ga-Nb,3,Supercon,Nb3Ga0.5Al0.5,MP-mp-1220348,Nb6Al1Ga1,Al-Ga-Nb,Al12.5Ga12.5Nb75,P m -3,cubic,5.200229,5.200229,5.200229,data/final/MP/cifs/Al0.5Ga0.5Nb3-MP-mp-1220348.cif,data/source/MP/raw/cifs/mp-1220348.cif,mp-1220348,0.0,,2019-01-12 21:12:34.707000,7.724213490019127,,,{'GGA': {'task_id': 'mp-1752644'}},0.0490749666875007,5.24232507,520.0,-68.77635789,-8.59704473625,{'tags': []},-68.77635789,-8.59704473625,-0.1743569746875,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,8,5,mp-1220348,,Nb6AlGa,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al', 'Ga_d'], 'pot_type': 'paw'}","{'Nb': 6.0, 'Al': 1.0, 'Ga': 1.0}",GGA,mp-1220348,"['mp-1220348', 'mp-1411514', 'mp-1752644', 'mp-1787843', 'mp-1619126']",0.0457429,"{'Nb': 6.0, 'Al': 1.0, 'Ga': 1.0}",140.62657729809163,[],NM,False,200,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0003252791960017,0.0457429,0,0.0457429,MP,data/source/MP/cleaned/cifs/MP-mp-1220348.cif,False,,data/final/MP/graphs/Al0.5Ga0.5Nb3-MP-mp-1220348.json,0,True,m-3,2,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Cu3La0.3Pr0.7O7,3,0.0461538461538461,1.0,True,Ba2Cu3La0.3Pr0.7O7,Ba2Cu3Pr1O7,0.0,Cuprate,True,Ba15.385Cu23.077La2.308Pr5.385O53.84615384615385,Ba-Cu-La-Pr-O,5,Supercon,La0.3Pr0.7Ba2Cu3O7,MP-mp-20936,Ba2Pr1Cu3O7,Ba-Cu-Pr-O,Ba15.385Cu23.077Pr7.692O53.84615384615385,P m m m,orthorhombic,3.903923,3.95568,11.916432,data/final/MP/cifs/Ba2Cu3La0.3Pr0.7O7-MP-mp-20936-synth_doped.cif,data/source/MP/raw/cifs/mp-20936.cif,mp-20936,0.0,,2014-02-22 14:41:55,6.480717836004672,10.17188/1196129,"@misc{osti_1196129,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2PrCu3O7 (SG:47) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196129"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698257'}},0.0256000172756332,3.18514576,520.0,-78.62827906,-6.048329158461538,"{'tags': ['Dibarium praseodymium tricopper heptaoxide', 'Praseodymium dibarium dicopper copper(III) oxide', 'Praseodymium dibarium tricopper heptaoxide', 'Praseodymium dibarium copper(III) dicopper oxide']}",-78.62827906,-6.048329158461538,-2.145007016153845,"['xas', 'bandstructure']",True,"[41452, 94377, 81168, 173910, 89221]",True,2021-05-12 10:56:57.051000,NM,13,8,mp-20936,oxide,Ba2PrCu3O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Pr_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Pr': 1.0, 'Cu': 3.0, 'O': 7.0}",GGA,mp-20936,"['mp-988090', 'mp-987725', 'mp-20936', 'mp-1417367', 'mp-1698257', 'mp-1833655', 'mp-988324', 'mp-1602318']",0.0007234,"{'Ba': 2.0, 'Pr': 1.0, 'Cu': 3.0, 'O': 7.0}",184.02152853403555,[],NM,False,47,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.931061793491212e-06,0.0007234,0,0.0007234,MP,data/source/MP/cleaned/cifs/MP-mp-20936.cif,True,,data/final/MP/graphs/Ba2Cu3La0.3Pr0.7O7-MP-mp-20936-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Al0.3Cr0.7,3,0.0666666666666666,3.0,False,Al0.9Cr2.1,Al1Cr2,0.0,Other,True,Al30Cr70,Al-Cr,2,Supercon,Al0.3Cr0.7,MP-mp-1699,Al1Cr2,Al-Cr,Al33.333Cr66.667,I 4/m m m,tetragonal,2.95837999723296,2.95837999723296,4.80225519,data/final/MP/cifs/Al0.3Cr0.7-MP-mp-1699-synth_doped.cif,data/source/MP/raw/cifs/mp-1699.cif,mp-1699,0.0,{'GGA': {'task_id': 'mp-1591635'}},2011-05-12 20:03:31,5.748722101448739,10.17188/1192273,"@misc{osti_1192273,
    author = ""Persson, Kristin"",
    title = ""Materials Data on AlCr2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1192273"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",,0.0,7.62680443,520.0,-23.41842857,-7.806142856666667,{'tags': ['Aluminium chromium (1/2)']},-23.41842857,-7.806142856666667,-0.1222525999999994,"['xas', 'elasticity']",False,"[606746, 57651, 606748]",True,2021-05-12 10:56:14.760000,FM,3,5,mp-1699,,AlCr2,"{'functional': 'PBE', 'labels': ['Al', 'Cr_pv'], 'pot_type': 'paw'}","{'Al': 1.0, 'Cr': 2.0}",GGA,mp-1699,"['mp-1699', 'mp-1256308', 'mp-1439918', 'mp-1791106', 'mp-1591635']",0.1650259,"{'Al': 1.0, 'Cr': 2.0}",37.83223572229163,[],FM,True,139,1,"[0.0, 0.1, 0.1]",0.0043620446122025,0.1650259,2,0.1650259,MP,data/source/MP/cleaned/cifs/MP-mp-1699.cif,True,,data/final/MP/graphs/Al0.3Cr0.7-MP-mp-1699-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ba1,1,0.0,4.0,False,Ba4,Ba4,3.4375,Other,True,Ba100,Ba,1,Supercon,Ba1,MP-mp-1096835,Ba4,Ba,Ba100,C m c m,orthorhombic,5.85034682,5.85034682,6.578505,data/final/MP/cifs/Ba1-MP-mp-1096835.cif,data/source/MP/raw/cifs/mp-1096835.cif,mp-1096835,0.0,,2018-05-10 23:18:55,4.193889148209845,,,,0.5134990174999998,1.86091474,520.0,-5.62188725,-1.4054718125,{'tags': ['Barium catena-silicate 5.3-hydrate']},-5.62188725,-1.4054718125,0.5134990174999998,[],False,[],True,2021-05-12 10:59:26.677000,NM,4,3,mp-1096835,,Ba,"{'functional': 'PBE', 'labels': ['Ba_sv'], 'pot_type': 'paw'}",{'Ba': 1.0},GGA,mp-1096835,"['mp-1096835', 'mp-1830081', 'mp-1981997']",0.0033701,{'Ba': 4.0},217.4943975296203,[],NM,False,63,0,"[0, 0, 0, 0]",6.198044709709876e-05,0.0033701,0,0.0134804,MP,data/source/MP/cleaned/cifs/MP-mp-1096835.cif,False,,data/final/MP/graphs/Ba1-MP-mp-1096835.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
C3Cr7,1,0.0,8.0,False,C24Cr56,C24Cr56,0.0,Other,True,C30Cr70,C-Cr,2,Supercon,C3Cr7,MP-mp-1196316,Cr56C24,C-Cr,C30Cr70,P 63 m c,hexagonal,4.476581,13.937979995191416,13.93797934,data/final/MP/cifs/C3Cr7-MP-mp-1196316.cif,data/source/MP/raw/cifs/mp-1196316.cif,mp-1196316,0.0,,2019-01-12 01:30:40.577000,7.055496191048325,,,,0.0,8.13612162,520.0,-770.00105555,-9.625013194375,{'tags': ['Chromium carbide (7/3)']},-770.00105555,-9.625013194375,-0.099845755375,[],False,[52289],True,2021-05-12 10:59:59.077000,NM,80,3,mp-1196316,,Cr7C3,"{'functional': 'PBE', 'labels': ['Cr_pv', 'C'], 'pot_type': 'paw'}","{'Cr': 7.0, 'C': 3.0}",GGA,mp-1196316,"['mp-1196316', 'mp-1350838', 'mp-1878195']",0.06442165,"{'Cr': 56.0, 'C': 24.0}",753.1417541635182,[],NM,False,36,0,"[-0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0, 0.0, -0.0, 0.0, -0.0, -0.0, -0.0, 0.0, -0.0, 0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0006842977396365,0.06442165,0,0.5153732,MP,data/source/MP/cleaned/cifs/MP-mp-1196316.cif,False,,data/final/MP/graphs/C3Cr7-MP-mp-1196316.json,0,True,6mm,0,5,0,0,0,0,0,1,0,0,0,1.0,False
C1Ta1,1,0.0,1.0,True,C1Ta1,C1Ta1,8.6375,Other,True,C50Ta50,C-Ta,2,Supercon,C1Ta1,MP-mp-1086,Ta1C1,C-Ta,C50Ta50,F m -3 m,cubic,3.16930633,3.1693063299999995,3.1693063299999995,data/final/MP/cifs/C1Ta1-MP-mp-1086.cif,data/source/MP/raw/cifs/mp-1086.cif,mp-1086,0.0,,2011-05-12 17:28:32,14.234280973849424,10.17188/1187404,"@misc{osti_1187404,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TaC (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187404"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686613'}},0.0,8.2505789,520.0,-22.23710222,-11.11855111,"{'tags': ['Tantalum carbide (1/1)', 'Tantalum(IV) carbide']}",-22.23710222,-11.11855111,-0.5762719450000002,"['xas', 'elasticity', 'bandstructure']",True,"[618845, 618833, 53974, 618820, 618830, 159875, 618843, 618846, 618823, 618841, 77406, 618844, 618825, 159878, 159877, 618828, 618831, 618848, 44497, 618838, 26956, 155163, 43525, 618839, 618835, 185979, 38239, 618829, 618837, 618832, 159879, 159876, 180601, 601144, 618847, 618818, 618836]",True,2021-05-12 10:56:10.715000,NM,2,14,mp-1086,,TaC,"{'functional': 'PBE', 'labels': ['Ta_pv', 'C'], 'pot_type': 'paw'}","{'Ta': 1.0, 'C': 1.0}",GGA,mp-1086,"['mp-992237', 'mp-990522', 'mp-1086', 'mp-1059363', 'mp-1059373', 'mp-1059393', 'mp-1237232', 'mp-1440573', 'mp-1686613', 'mp-1792077', 'mp-993854', 'mp-1596236', 'mp-1595188', 'mp-1059385']",0.0001919,"{'Ta': 1.0, 'C': 1.0}",22.51011209588414,[],NM,False,225,0,"[0, 0]",8.525057502271965e-06,0.0001919,0,0.0001919,MP,data/source/MP/cleaned/cifs/MP-mp-1086.cif,False,,data/final/MP/graphs/C1Ta1-MP-mp-1086.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
As1Ge1Mo1,1,0.0,2.0,False,As2Ge2Mo2,As2Ge2Mo2,0.0,Other,True,As33.333Ge33.333Mo33.333,As-Ge-Mo,3,Supercon,As1Ge1Mo1,MP-mp-1224404,Ge2Mo2As2,As-Ge-Mo,As33.333Ge33.333Mo33.333,C 1 2/m 1,monoclinic,3.298143997533032,4.93762316,6.969715440800229,data/final/MP/cifs/As1Ge1Mo1-MP-mp-1224404.cif,data/source/MP/raw/cifs/mp-1224404.cif,mp-1224404,0.0,,2019-01-13 00:39:31.634000,7.839337843688874,,,{'GGA': {'task_id': 'mp-1760923'}},0.0361770245833321,7.04925168,520.0,-41.29452349,-6.882420581666668,{'tags': []},-41.29452349,-6.882420581666668,-0.1731574850000008,['bandstructure'],True,[],True,2021-05-12 10:58:45.495000,NM,6,5,mp-1224404,,GeMoAs,"{'functional': 'PBE', 'labels': ['Ge_d', 'Mo_pv', 'As'], 'pot_type': 'paw'}","{'Ge': 1.0, 'Mo': 1.0, 'As': 1.0}",GGA,mp-1224404,"['mp-1224404', 'mp-1392441', 'mp-1760923', 'mp-1798256', 'mp-1626291']",0.00024605,"{'Ge': 2.0, 'Mo': 2.0, 'As': 2.0}",103.15767164062896,[],NM,False,12,0,"[0, 0, 0, 0, 0, 0]",4.770367459575202e-06,0.00024605,0,0.0004921,MP,data/source/MP/cleaned/cifs/MP-mp-1224404.cif,False,,data/final/MP/graphs/As1Ge1Mo1-MP-mp-1224404.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
B2C1Pd2Y1,1,0.0,1.0,True,B2C1Pd2Y1,B2C1Pd2Y1,22.6,Other,True,B33.333C16.667Pd33.333Y16.667,B-C-Pd-Y,4,Supercon,Y1Pd2B2C1,MP-mp-1024989,Y1B2Pd2C1,B-C-Pd-Y,B33.333C16.667Pd33.333Y16.667,I 4/m m m,tetragonal,3.790340001526312,3.790340001526312,6.01027654,data/final/MP/cifs/B2C1Pd2Y1-MP-mp-1024989.cif,data/source/MP/raw/cifs/mp-1024989.cif,mp-1024989,0.0,,2016-09-26 08:11:01,7.205732549599368,10.17188/1355616,"@article{osti_1355616,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YB2Pd2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1355616"",
    place = ""United States"",
    year = ""2017"",
    month = ""5""
}
",{'GGA': {'task_id': 'mp-1760349'}},0.0658256806481487,5.74454551,520.0,-42.37854949,-7.063091581666666,{'tags': []},-42.37854949,-7.063091581666666,-0.4944584191666656,['bandstructure'],True,[],True,2021-05-12 10:58:09.072000,NM,6,5,mp-1024989,,YB2Pd2C,"{'functional': 'PBE', 'labels': ['Y_sv', 'B', 'Pd', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'B': 2.0, 'Pd': 2.0, 'C': 1.0}",GGA,mp-1024989,"['mp-1024989', 'mp-1397438', 'mp-1760349', 'mp-1783220', 'mp-1626523']",0.0046547,"{'Y': 1.0, 'B': 2.0, 'Pd': 2.0, 'C': 1.0}",77.28696292032446,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",6.0226198884261445e-05,0.0046547,0,0.0046547,MP,data/source/MP/cleaned/cifs/MP-mp-1024989.cif,False,,data/final/MP/graphs/B2C1Pd2Y1-MP-mp-1024989.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
C2La0.8Ni1Th0.2,3,0.0999999999999999,1.0,True,C2La0.8Ni1Th0.2,C2La1Ni1,5.4,Other,True,C50La20Ni25Th5,C-La-Ni-Th,4,Supercon,La0.8Th0.2Ni1C2,MP-mp-1018048,La1Ni1C2,C-La-Ni,C50La25Ni25,A m m 2,orthorhombic,3.82731293,3.82731293,3.977635,data/final/MP/cifs/C2La0.8Ni1Th0.2-MP-mp-1018048-synth_doped.cif,data/source/MP/raw/cifs/mp-1018048.cif,mp-1018048,0.0,,2017-04-06 23:27:44,6.5955568384756855,10.17188/1350127,"@article{osti_1350127,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaNiC2 (SG:38) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1350127"",
    place = ""United States"",
    year = ""2017"",
    month = ""4""
}
",{'GGA': {'task_id': 'mp-1697101'}},0.0,8.87914765,520.0,-30.18892584,-7.54723146,"{'tags': ['LaNiC2', 'Lanthanum nickel carbide (1/1/2)', 'CeNiC2']}",-30.18892584,-7.54723146,-0.2548051637499995,"['bandstructure', 'elasticity']",True,[618179],True,2021-05-12 10:56:08.727000,NM,4,12,mp-1018048,,LaNiC2,"{'functional': 'PBE', 'labels': ['La', 'Ni_pv', 'C'], 'pot_type': 'paw'}","{'La': 1.0, 'Ni': 1.0, 'C': 2.0}",GGA,mp-1018048,"['mp-1018048', 'mp-1018270', 'mp-1018463', 'mp-1067001', 'mp-1067047', 'mp-1067181', 'mp-1115476', 'mp-1412950', 'mp-1697101', 'mp-1783297', 'mp-1594865', 'mp-1067093']",0.005804,"{'La': 1.0, 'Ni': 1.0, 'C': 2.0}",55.79651958097468,[],NM,False,38,0,"[0.0, -0.0, 0.0, 0.0]",0.0001040208250189,0.005804,0,0.005804,MP,data/source/MP/cleaned/cifs/MP-mp-1018048.cif,True,,data/final/MP/graphs/C2La0.8Ni1Th0.2-MP-mp-1018048-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Ca1.8Cl2Cu1O2,2,0.042016806722689,1.0,True,Ca1.8Cl2Cu1O2,Ca2Cl2Cu1O2,41.0,Cuprate,True,Ca26.471Cl29.412Cu14.706O29.411764705882355,Ca-Cl-Cu-O,4,Supercon,Ca1.8Cu1Cl2O2,MP-mp-23143,Ca2Cu1Cl2O2,Ca-Cl-Cu-O,Ca28.571Cl28.571Cu14.286O28.571428571428573,I 4/m m m,tetragonal,3.88024600076171,3.880246000761709,8.12907187,data/final/MP/cifs/Ca1.8Cl2Cu1O2-MP-mp-23143-synth_doped.cif,data/source/MP/raw/cifs/mp-23143.cif,mp-23143,0.0,,2014-02-21 09:50:06,3.554337150605878,10.17188/1199263,"@misc{osti_1199263,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ca2Cu(ClO)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199263"",
    place = ""United States"",
    year = ""2016"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700223'}},0.0191527683333321,4.19679796,520.0,-35.95348475,-5.136212107142858,"{'tags': ['Dicalcium copper dioxide dichloride', 'Dicalcium dichlorodioxocuprate']}",-35.95348475,-5.136212107142858,-2.407440427142858,"['xas', 'elasticity', 'bandstructure']",True,"[1027, 83117, 41581]",True,2021-05-12 10:56:16.728000,NM,7,8,mp-23143,oxide,Ca2Cu(ClO)2,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Cu_pv', 'Cl', 'O'], 'pot_type': 'paw'}","{'Ca': 2.0, 'Cu': 1.0, 'Cl': 2.0, 'O': 2.0}",GGA,mp-23143,"['mp-992231', 'mp-990553', 'mp-23143', 'mp-1436301', 'mp-1700223', 'mp-1803462', 'mp-993865', 'mp-1592909']",0.0134962,"{'Ca': 2.0, 'Cu': 1.0, 'Cl': 2.0, 'O': 2.0}",115.21141865211318,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001171429026557,0.0134962,0,0.0134962,MP,data/source/MP/cleaned/cifs/MP-mp-23143.cif,True,,data/final/MP/graphs/Ca1.8Cl2Cu1O2-MP-mp-23143-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Al1Hf1Ni2,1,0.0,1.0,True,Al1Hf1Ni2,Al1Hf1Ni2,0.37,Other,True,Al25Hf25Ni50,Al-Hf-Ni,3,Supercon,Ni2Hf1Al1,MP-mp-5748,Hf1Al1Ni2,Al-Hf-Ni,Al25Hf25Ni50,F m -3 m,cubic,4.3008186,4.3008186,4.3008186,data/final/MP/cifs/Al1Hf1Ni2-MP-mp-5748.cif,data/source/MP/raw/cifs/mp-5748.cif,mp-5748,0.0,,2011-05-13 01:03:05,9.530654492837588,10.17188/1276596,"@misc{osti_1276596,
    author = ""Persson, Kristin"",
    title = ""Materials Data on HfAlNi2 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1276596"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1690506'}},0.0,7.40266891,520.0,-27.80893289,-6.9522332225,{'tags': ['Aluminium hafnium nickel (1/1/2)']},-27.80893289,-6.9522332225,-0.6364737125000008,"['xas', 'elasticity', 'bandstructure']",True,"[608123, 57901]",True,2021-05-12 10:56:27.046000,NM,4,9,mp-5748,,HfAlNi2,"{'functional': 'PBE', 'labels': ['Hf_pv', 'Al', 'Ni_pv'], 'pot_type': 'paw'}","{'Hf': 1.0, 'Al': 1.0, 'Ni': 2.0}",GGA,mp-5748,"['mp-5748', 'mp-993029', 'mp-991045', 'mp-1260968', 'mp-1437987', 'mp-1690506', 'mp-1794357', 'mp-994356', 'mp-1587847']",0.0043483,"{'Hf': 1.0, 'Al': 1.0, 'Ni': 2.0}",56.252053269350085,[],NM,False,225,0,"[0.0, 0.0, -0.0, -0.0]",7.730028945217628e-05,0.0043483,0,0.0043483,MP,data/source/MP/cleaned/cifs/MP-mp-5748.cif,False,,data/final/MP/graphs/Al1Hf1Ni2-MP-mp-5748.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
B1.89C0.11Mg1,3,0.0733333333333333,1.0,True,B1.89C0.11Mg1,B2Mg1,33.85,Other,True,B63C3.667Mg33.333,B-C-Mg,3,Supercon,Mg1B1.89C0.11,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B1.89C0.11Mg1-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B1.89C0.11Mg1-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ga1Lu3,1,0.0,2.0,False,Ga2Lu6,Ga2Lu6,0.0,Other,True,Ga25Lu75,Ga-Lu,2,Supercon,Ga1Lu3,MP-mp-973300,Lu6Ga2,Ga-Lu,Ga25Lu75,P 63/m m c,hexagonal,5.234625,6.606521998145302,6.6065221,data/final/MP/cifs/Ga1Lu3-MP-mp-973300.cif,data/source/MP/raw/cifs/mp-973300.cif,mp-973300,0.0,,2015-09-16 06:52:46,9.980666418593955,10.17188/1314070,"@misc{osti_1314070,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Lu3Ga (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1314070"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1752971'}},0.1021612809375014,3.36573773,520.0,-35.07360951,-4.38420118875,{'tags': []},-35.07360951,-4.38420118875,-0.2364642931249987,"['xas', 'elasticity', 'bandstructure']",True,[],True,2021-05-12 10:56:35.166000,NM,8,8,mp-973300,,Lu3Ga,"{'functional': 'PBE', 'labels': ['Lu_3', 'Ga_d'], 'pot_type': 'paw'}","{'Lu': 3.0, 'Ga': 1.0}",GGA,mp-973300,"['mp-973349', 'mp-973389', 'mp-973300', 'mp-1445266', 'mp-1752971', 'mp-1787838', 'mp-973427', 'mp-1622493']",0.1098461,"{'Lu': 6.0, 'Ga': 2.0}",197.8618141366676,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0011103314753207,0.1098461,0,0.2196922,MP,data/source/MP/cleaned/cifs/MP-mp-973300.cif,False,,data/final/MP/graphs/Ga1Lu3-MP-mp-973300.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ge0.937Te1,2,0.0325245224574083,1.0,True,Ge0.937Te1,Ge1Te1,0.311,Other,True,Ge48.374Te51.626,Ge-Te,2,Supercon,Ge0.937Te1,MP-mp-938,Ge1Te1,Ge-Te,Ge50Te50,R 3 m,trigonal,4.2306661843580935,4.2306661843580935,4.37516386,data/final/MP/cifs/Ge0.937Te1-MP-mp-938-synth_doped.cif,data/source/MP/raw/cifs/mp-938.cif,mp-938,0.8215000000000003,,2011-05-12 18:44:01,5.9096523360046005,10.17188/1272924,"@misc{osti_1272924,
    author = ""Persson, Kristin"",
    title = ""Materials Data on GeTe (SG:160) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1272924"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668824'}},0.0,5.39520466,520.0,-7.95077254,-3.97538627,"{'tags': ['Germanium telluride', 'Germanium telluride (1/1) - alpha', 'Germanium(II) telluride', 'Germanium telluride (1/1)']}",-7.95077254,-3.97538627,-0.3032218774999995,"['piezo', 'xas', 'bandstructure', 'diel', 'elasticity']",True,"[159907, 188458, 56039, 56040, 56041, 659806, 659808, 43202, 655497, 659805, 165414, 56038]",True,2021-05-12 10:56:35.166000,NM,2,20,mp-938,,GeTe,"{'functional': 'PBE', 'labels': ['Ge_d', 'Te'], 'pot_type': 'paw'}","{'Ge': 1.0, 'Te': 1.0}",GGA,mp-938,"['mp-655245', 'mp-655250', 'mp-655231', 'mp-938', 'mp-1057193', 'mp-1057199', 'mp-1057210', 'mp-1060737', 'mp-1060747', 'mp-1060770', 'mp-1141488', 'mp-1119920', 'mp-1440604', 'mp-1668824', 'mp-1790742', 'mp-1863530', 'mp-1595868', 'mp-1596468', 'mp-1057206', 'mp-1060757']",1.27e-05,"{'Ge': 1.0, 'Te': 1.0}",56.264958374993846,[],NM,False,160,0,"[0, 0]",2.257177534080312e-07,1.27e-05,0,1.27e-05,MP,data/source/MP/cleaned/cifs/MP-mp-938.cif,True,,data/final/MP/graphs/Ge0.937Te1-MP-mp-938-synth_doped.json,0,True,3m,0,0,0,0,0,0,5,1,0,0,0,1.0,False
Ba1Pt1Si3,1,0.0,1.0,True,Ba1Pt1Si3,Ba1Pt1Si3,1.875,Other,True,Ba20Pt20Si60,Ba-Pt-Si,3,Supercon,Ba1Pt1Si3,MP-mp-1069809,Ba1Si3Pt1,Ba-Pt-Si,Ba20Pt20Si60,I 4 m m,tetragonal,4.431989999602879,4.43198999960288,5.9811605000000005,data/final/MP/cifs/Ba1Pt1Si3-MP-mp-1069809.cif,data/source/MP/raw/cifs/mp-1069809.cif,mp-1069809,0.0,,2018-03-22 01:52:10,6.914285155000714,,,{'GGA': {'task_id': 'mp-1694960'}},0.0025208084999999,6.39062665,520.0,-27.24194087,-5.448388174,"{'tags': ['Barium platinum silicide (1/1/3)', 'BaNiSn3', 'BaPtSi3']}",-27.24194087,-5.448388174,-0.5526240540000004,['bandstructure'],True,[174267],True,2021-05-12 10:58:14.654000,NM,5,8,mp-1069809,,BaSi3Pt,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Si', 'Pt'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Si': 3.0, 'Pt': 1.0}",GGA,mp-1069809,"['mp-1069809', 'mp-1069835', 'mp-1069858', 'mp-1415223', 'mp-1694960', 'mp-1783530', 'mp-1592930', 'mp-1069859']",0.0016463,"{'Ba': 1.0, 'Si': 3.0, 'Pt': 1.0}",100.06712856384704,[],NM,False,107,0,"[0, 0, 0, 0, 0]",1.645195603818682e-05,0.0016463,0,0.0016463,MP,data/source/MP/cleaned/cifs/MP-mp-1069809.cif,False,,data/final/MP/graphs/Ba1Pt1Si3-MP-mp-1069809.json,0,True,4mm,0,0,0,0,5,0,0,0,0,1,0,1.0,False
Au2In1Tm1,1,0.0,1.0,True,Au2In1Tm1,Au2In1Tm1,0.0,Other,True,Au50In25Tm25,Au-In-Tm,3,Supercon,Au2In1Tm1,MP-mp-568830,Tm1In1Au2,Au-In-Tm,Au50In25Tm25,F m -3 m,cubic,4.92415869,4.924158689999999,4.924158689999999,data/final/MP/cifs/Au2In1Tm1-MP-mp-568830.cif,data/source/MP/raw/cifs/mp-568830.cif,mp-568830,0.0,,2014-02-16 12:08:10,13.328954043041616,10.17188/1274718,"@misc{osti_1274718,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TmInAu2 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1274718"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699088'}},0.0,5.94524496,520.0,-16.55871757,-4.1396793925,"{'tags': ['Gold indium thulium (2/1/1)', 'Thulium gold indide (1/2/1)']}",-16.55871757,-4.1396793925,-0.6958588341666663,"['xas', 'bandstructure']",True,"[612071, 58511]",True,2021-05-12 10:57:24.969000,NM,4,8,mp-568830,,TmInAu2,"{'functional': 'PBE', 'labels': ['Tm_3', 'In_d', 'Au'], 'pot_type': 'paw'}","{'Tm': 1.0, 'In': 1.0, 'Au': 2.0}",GGA,mp-568830,"['mp-940879', 'mp-941027', 'mp-934482', 'mp-568830', 'mp-1441608', 'mp-1699088', 'mp-1799597', 'mp-1587901']",8.6e-06,"{'Tm': 1.0, 'In': 1.0, 'Au': 2.0}",84.42695440186405,[],NM,False,225,0,"[0, 0, 0, 0]",1.018632030603028e-07,8.6e-06,0,8.6e-06,MP,data/source/MP/cleaned/cifs/MP-mp-568830.cif,False,,data/final/MP/graphs/Au2In1Tm1-MP-mp-568830.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Cu1La1.7Na0.3O4,3,0.0857142857142857,1.0,True,Cu1La1.7Na0.3O4,Cu1La2O4,0.0,Cuprate,True,Cu14.286La24.286Na4.286O57.142857142857146,Cu-La-Na-O,4,Supercon,La1.7Na0.3Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La1.7Na0.3O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La1.7Na0.3O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ba2Cu1Hg1O4.06,2,0.0074441687344912,0.985055418719212,True,Ba1.97Cu0.985Hg0.985O4,Ba2Cu1Hg1O4,73.0,Cuprate,True,Ba24.814Cu12.407Hg12.407O50.37220843672457,Ba-Cu-Hg-O,4,Supercon,Hg1Ba2Cu1O4.06,MP-mp-6562,Ba2Cu1Hg1O4,Ba-Cu-Hg-O,Ba25Cu12.5Hg12.5O50,P 4/m m m,tetragonal,3.933714,3.933714,9.827602,data/final/MP/cifs/Ba2Cu1Hg1O4.06-MP-mp-6562-synth_doped.cif,data/source/MP/raw/cifs/mp-6562.cif,mp-6562,0.0,,2011-05-13 18:18:06,6.582036471328142,10.17188/1281336,"@misc{osti_1281336,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2CuHgO4 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281336"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697135'}},0.0234340381250053,2.58068675,520.0,-40.91481298,-5.1143516225,"{'tags': ['Mercury dibarium copper oxide', 'High pressure experimental phase']}",-40.91481298,-5.1143516225,-1.953767533125,"['xas', 'bandstructure']",True,"[75722, 75720, 75724, 75721, 75723]",True,2021-05-12 10:57:32.679000,NM,8,8,mp-6562,oxide,Ba2CuHgO4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Cu_pv', 'Hg', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",GGA,mp-6562,"['mp-6562', 'mp-990899', 'mp-992892', 'mp-1435690', 'mp-1697135', 'mp-1878488', 'mp-994198', 'mp-1592659']",0.0003984,"{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",152.07335344042525,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0, 0, 0]",2.619788352047311e-06,0.0003984,0,0.0003984,MP,data/source/MP/cleaned/cifs/MP-mp-6562.cif,True,,data/final/MP/graphs/Ba2Cu1Hg1O4.06-MP-mp-6562-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ce0.8Pr0.2Ru2,3,0.1333333333333333,2.0,False,Ce1.6Pr0.4Ru4,Ce2Ru4,5.82,Heavy_fermion,True,Ce26.667Pr6.667Ru66.667,Ce-Pr-Ru,3,Supercon,Ce0.8Pr0.2Ru2,MP-mp-607,Ce2Ru4,Ce-Ru,Ce33.333Ru66.667,F d -3 m,cubic,5.35903077,5.35903077,5.35903077,data/final/MP/cifs/Ce0.8Pr0.2Ru2-MP-mp-607-synth_doped.cif,data/source/MP/raw/cifs/mp-607.cif,mp-607,0.0,,2011-05-13 22:34:26,10.444470046690055,10.17188/1277529,"@misc{osti_1277529,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeRu2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277529"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686879'}},0.0,8.61419203,520.0,-50.66413619,-8.444022698333333,"{'tags': ['Cerium ruthenium (1/2)', 'Cerium ruthenium hydride (1/2/4)']}",-50.66413619,-8.444022698333333,-0.2833998766666663,"['xas', 'elasticity', 'bandstructure']",True,"[621326, 656077, 621978, 621973, 621980, 621984, 102277, 621972, 621976, 621979, 604113, 621977, 621982, 621983, 102276, 656078]",True,2021-05-12 10:56:27.046000,NM,6,14,mp-607,,CeRu2,"{'functional': 'PBE', 'labels': ['Ce', 'Ru_pv'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Ru': 2.0}",GGA,mp-607,"['mp-928203', 'mp-912221', 'mp-928809', 'mp-607', 'mp-1071462', 'mp-1071593', 'mp-1071613', 'mp-1077792', 'mp-1440763', 'mp-1686879', 'mp-1803198', 'mp-1591928', 'mp-1591642', 'mp-1071635']",1.005e-05,"{'Ce': 2.0, 'Ru': 4.0}",108.82877852828122,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",1.846937939745105e-07,1.005e-05,0,2.01e-05,MP,data/source/MP/cleaned/cifs/MP-mp-607.cif,True,,data/final/MP/graphs/Ce0.8Pr0.2Ru2-MP-mp-607-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ag1In2,1,0.0,2.0,False,Ag2In4,Ag2In4,2.35,Other,True,Ag33.333In66.667,Ag-In,2,Supercon,Ag1In2,MP-mp-19974,In4Ag2,Ag-In,Ag33.333In66.667,I 4/m c m,tetragonal,5.715591970804354,5.71559197,5.715591970000001,data/final/MP/cifs/Ag1In2-MP-mp-19974.cif,data/source/MP/raw/cifs/mp-19974.cif,mp-19974,0.0,,2014-02-21 15:10:02,7.942449544823205,10.17188/1195155,"@misc{osti_1195155,
    author = ""Persson, Kristin"",
    title = ""Materials Data on In2Ag (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195155"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700904'}},0.0024523523148145,6.42409176,520.0,-16.75323626,-2.7922060433333336,"{'tags': ['Silver indide (1/2)', 'Silver indium (1/2)']}",-16.75323626,-2.7922060433333336,-0.0135648888888889,"['xas', 'elasticity', 'bandstructure']",True,"[659383, 58282, 605383]",True,2021-05-12 10:56:14.760000,NM,6,9,mp-19974,,In2Ag,"{'functional': 'PBE', 'labels': ['In_d', 'Ag'], 'pot_type': 'paw'}","{'In': 2.0, 'Ag': 1.0}",GGA,mp-19974,"['mp-912000', 'mp-928165', 'mp-19974', 'mp-1076998', 'mp-1425787', 'mp-1700904', 'mp-1925944', 'mp-928644', 'mp-1596923']",8.78e-05,"{'In': 4.0, 'Ag': 2.0}",141.1249529704264,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0]",1.244287394283831e-06,8.78e-05,0,0.0001756,MP,data/source/MP/cleaned/cifs/MP-mp-19974.cif,False,,data/final/MP/graphs/Ag1In2-MP-mp-19974.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Nb3Sb0.7Sn0.3,3,0.15,2.0,False,Nb6Sb1.4Sn0.6,Nb6Sb2,6.8,Other,True,Nb75Sb17.5Sn7.5,Nb-Sb-Sn,3,Supercon,Nb3Sn0.3Sb0.7,MP-mp-2053,Nb6Sb2,Nb-Sb,Nb75Sb25,P m -3 n,cubic,5.311983,5.311983,5.311983,data/final/MP/cifs/Nb3Sb0.7Sn0.3-MP-mp-2053-synth_doped.cif,data/source/MP/raw/cifs/mp-2053.cif,mp-2053,0.0,,2011-05-13 19:35:55,8.87337760679475,10.17188/1195662,"@misc{osti_1195662,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Sb (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195662"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696683'}},0.0,7.01392698,520.0,-71.08518378,-8.8856479725,"{'tags': ['Niobium antimony (3/1)', 'Niobium antimonide (3/1)']}",-71.08518378,-8.8856479725,-0.3254188824999993,"['xas', 'elasticity', 'bandstructure']",True,"[645347, 76572, 645349, 190178, 645357, 645352]",True,2021-05-12 10:56:14.760000,NM,8,8,mp-2053,,Nb3Sb,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Sb'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Sb': 1.0}",GGA,mp-2053,"['mp-910444', 'mp-926252', 'mp-926772', 'mp-2053', 'mp-1413395', 'mp-1696683', 'mp-1877686', 'mp-1592488']",0.00022775,"{'Nb': 6.0, 'Sb': 2.0}",149.88909224806147,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",3.0389135938335167e-06,0.00022775,0,0.0004555,MP,data/source/MP/cleaned/cifs/MP-mp-2053.cif,True,,data/final/MP/graphs/Nb3Sb0.7Sn0.3-MP-mp-2053-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Pb2Pd0.5Rh0.5,1,0.0,2.0,False,Pb4Pd1Rh1,Pb4Pd1Rh1,1.7,Other,True,Pb66.667Pd16.667Rh16.667,Pb-Pd-Rh,3,Supercon,Rh0.5Pd0.5Pb2,MP-mp-1219917,Pd1Rh1Pb4,Pb-Pd-Rh,Pb66.667Pd16.667Rh16.667,I 4 2 2,tetragonal,5.735880430398409,5.73588043,5.735880430000001,data/final/MP/cifs/Pb2Pd0.5Rh0.5-MP-mp-1219917.cif,data/source/MP/raw/cifs/mp-1219917.cif,mp-1219917,0.0,,2019-01-12 20:50:51.507000,12.053292010931765,,,{'GGA': {'task_id': 'mp-1757000'}},0.0053809049999999,7.36236033,520.0,-28.18852531,-4.698087551666666,{'tags': []},-28.18852531,-4.698087551666666,-0.132291225,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,6,5,mp-1219917,,PdRhPb4,"{'functional': 'PBE', 'labels': ['Pd', 'Rh_pv', 'Pb_d'], 'pot_type': 'paw'}","{'Pd': 1.0, 'Rh': 1.0, 'Pb': 4.0}",GGA,mp-1219917,"['mp-1219917', 'mp-1396427', 'mp-1757000', 'mp-1869649', 'mp-1624496']",0.0006295,"{'Pd': 1.0, 'Rh': 1.0, 'Pb': 4.0}",143.018848893747,[],NM,False,97,0,"[0, 0, 0, 0, 0, 0]",4.401517736082986e-06,0.0006295,0,0.0006295,MP,data/source/MP/cleaned/cifs/MP-mp-1219917.cif,False,,data/final/MP/graphs/Pb2Pd0.5Rh0.5-MP-mp-1219917.json,0,True,422,0,0,0,0,4,0,0,0,0,1,0,1.0,False
Nb2.7Sn1Ti0.3,3,0.1499999999999999,2.0,False,Nb5.4Sn2Ti0.6,Nb6Sn2,16.4,Other,True,Nb67.5Sn25Ti7.5,Nb-Sn-Ti,3,Supercon,Nb2.7Ti0.3Sn1,MP-mp-1326,Nb6Sn2,Nb-Sn,Nb75Sn25,P m -3 n,cubic,5.334611,5.334611,5.334611,data/final/MP/cifs/Nb2.7Sn1Ti0.3-MP-mp-1326-synth_doped.cif,data/source/MP/raw/cifs/mp-1326.cif,mp-1326,0.0,,2011-05-14 09:51:48,8.694218121896231,10.17188/1189484,"@misc{osti_1189484,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Sn (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189484"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668415'}},0.0,6.59372491,520.0,-69.93787048,-8.74223381,{'tags': ['Niobium tin (3/1)']},-69.93787048,-8.74223381,-0.163862066250001,"['xas', 'elasticity', 'bandstructure']",True,"[105230, 645503, 645489, 105231, 645498, 645485, 645474, 645496, 645480, 645488, 645482, 645487, 645500, 645493, 645477, 645484, 645502, 645483, 150878, 645479, 645481, 645486, 645473]",True,2021-05-12 10:56:12.755000,NM,8,9,mp-1326,,Nb3Sn,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Sn_d'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Sn': 1.0}",GGA,mp-1326,"['mp-930046', 'mp-913770', 'mp-930577', 'mp-1326', 'mp-1440651', 'mp-1668415', 'mp-1880085', 'mp-1594093', 'mp-1594507']",0.62023085,"{'Nb': 6.0, 'Sn': 2.0}",151.81275738025872,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0081709977567491,0.62023085,0,1.2404617,MP,data/source/MP/cleaned/cifs/MP-mp-1326.cif,True,,data/final/MP/graphs/Nb2.7Sn1Ti0.3-MP-mp-1326-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Sb1,1,0.0,2.0,False,Sb2,Sb2,1.416666667,Other,True,Sb100,Sb,1,Supercon,Sb1,MP-mp-104,Sb2,Sb,Sb100,R -3 m,trigonal,4.385953618290321,4.385953618290321,4.61454262,data/final/MP/cifs/Sb1-MP-mp-104.cif,data/source/MP/raw/cifs/mp-104.cif,mp-104,0.0,,2011-05-12 17:11:09,6.292122136443163,10.17188/1187090,"@misc{osti_1187090,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sb (SG:166) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187090"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668819'}},0.0,6.5274485,520.0,-8.25800248,-4.12900124,"{'tags': ['Antimony - nano-sized', 'High pressure experimental phase', 'Antimony - I', 'Antimony']}",-8.25800248,-4.12900124,0.0,"['surfaces', 'eos', 'bandstructure', 'xas', 'elasticity']",True,"[64695, 651492, 651497, 426972, 161493, 64697, 651506, 409754, 651498, 55402, 53795, 9859, 64696]",True,2021-05-12 10:56:10.715000,NM,2,19,mp-104,,Sb,"{'functional': 'PBE', 'labels': ['Sb'], 'pot_type': 'paw'}",{'Sb': 1.0},GGA,mp-104,"['mp-920016', 'mp-906213', 'mp-919015', 'mp-104', 'mp-567170', 'mp-1059303', 'mp-1059241', 'mp-1059255', 'mp-1059991', 'mp-1060011', 'mp-1060067', 'mp-1172844', 'mp-1440892', 'mp-1668819', 'mp-1792436', 'mp-1595350', 'mp-1587223', 'mp-1060033', 'mp-1059276']",0.00047655,{'Sb': 2.0},64.26678706002018,[],NM,False,166,0,"[0, 0]",1.4830366408544414e-05,0.00047655,0,0.0009531,MP,data/source/MP/cleaned/cifs/MP-mp-104.cif,False,,data/final/MP/graphs/Sb1-MP-mp-104.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
C2Ca0.1Y0.9,3,0.0666666666666666,1.0,True,C2Ca0.1Y0.9,C2Y1,3.15,Carbon,True,C66.667Ca3.333Y30,C-Ca-Y,3,Supercon,Y0.9Ca0.1C2,MP-mp-313,Y1C2,C-Y,C66.667Y33.333,I 4/m m m,tetragonal,3.6847620031018047,4.05388196,3.6847620031018047,data/final/MP/cifs/C2Ca0.1Y0.9-MP-mp-313-synth_doped.cif,data/source/MP/raw/cifs/mp-313.cif,mp-313,0.0,,2011-05-12 18:28:55,4.447058270599283,10.17188/1205571,"@misc{osti_1205571,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YC2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1205571"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686717'}},0.068494783958334,5.01076797,520.0,-25.48704506,-8.495681686666666,{'tags': ['Yttrium carbide (1/2)']},-25.48704506,-8.495681686666666,-0.1890041822222213,"['xas', 'elasticity', 'bandstructure']",True,"[619117, 33607, 619112, 619108, 619126, 74666, 619115, 95963]",True,2021-05-12 10:56:20.740000,NM,3,9,mp-313,,YC2,"{'functional': 'PBE', 'labels': ['Y_sv', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'C': 2.0}",GGA,mp-313,"['mp-1000986', 'mp-313', 'mp-1007425', 'mp-1442291', 'mp-1686717', 'mp-1791028', 'mp-1012183', 'mp-1591717', 'mp-1592070']",0.0001427,"{'Y': 1.0, 'C': 2.0}",42.16722581497335,[],NM,False,139,0,"[0, 0, 0]",3.384144848090244e-06,0.0001427,0,0.0001427,MP,data/source/MP/cleaned/cifs/MP-mp-313.cif,True,,data/final/MP/graphs/C2Ca0.1Y0.9-MP-mp-313-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Au0.293Ga0.707,3,0.0806666666666666,3.0,False,Au0.879Ga2.121,Au1Ga2,1.63,Other,True,Au29.3Ga70.7,Au-Ga,2,Supercon,Au0.293Ga0.707,MP-mp-2776,Ga2Au1,Au-Ga,Au33.333Ga66.667,F m -3 m,cubic,4.40327555,4.40327555,4.40327555,data/final/MP/cifs/Au0.293Ga0.707-MP-mp-2776-synth_doped.cif,data/source/MP/raw/cifs/mp-2776.cif,mp-2776,0.0,,2011-05-12 21:57:19,9.253557284351938,10.17188/1201942,"@misc{osti_1201942,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ga2Au (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201942"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687524'}},0.0,3.58527429,520.0,-10.04441228,-3.3481374266666664,"{'tags': ['Gold gallium (1/2)', 'Gallium gold (2/1)']}",-10.04441228,-3.3481374266666664,-0.2381128983333328,"['xas', 'elasticity', 'bandstructure']",True,"[611874, 611864, 150958, 58458]",True,2021-05-12 10:56:18.721000,NM,3,8,mp-2776,,Ga2Au,"{'functional': 'PBE', 'labels': ['Ga_d', 'Au'], 'pot_type': 'paw'}","{'Ga': 2.0, 'Au': 1.0}",GGA,mp-2776,"['mp-991379', 'mp-2776', 'mp-993315', 'mp-1439079', 'mp-1687524', 'mp-1795480', 'mp-994626', 'mp-1589089']",0.000866,"{'Ga': 2.0, 'Au': 1.0}",60.36880695215696,[],NM,False,225,0,"[0, 0, 0]",1.4345156774198237e-05,0.000866,0,0.000866,MP,data/source/MP/cleaned/cifs/MP-mp-2776.cif,True,,data/final/MP/graphs/Au0.293Ga0.707-MP-mp-2776-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ce0.07Cu1Nd1.93O4,2,0.02,1.0,True,Ce0.07Cu1Nd1.93O4,Cu1Nd2O4,0.0,Cuprate,True,Ce1Cu14.286Nd27.571O57.142857142857146,Ce-Cu-Nd-O,4,Supercon,Nd1.93Ce0.07Cu1O4,MP-mp-4158,Nd2Cu1O4,Cu-Nd-O,Cu14.286Nd28.571O57.142857142857146,I 4/m m m,tetragonal,3.973854000245551,3.973854000245551,6.78296857,data/final/MP/cifs/Ce0.07Cu1Nd1.93O4-MP-mp-4158-synth_doped.cif,data/source/MP/raw/cifs/mp-4158.cif,mp-4158,0.0,,2011-05-13 10:19:33,7.086167303782593,10.17188/1207899,"@misc{osti_1207899,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nd2CuO4 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207899"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-670050'}},0.0009497997619085,3.16510927,520.0,-51.48091453,-7.354416361428571,"{'tags': ['Dineodymium copper tetraoxide', 'Dineodymium copper oxide', 'Dineodymium cuprate', 'High pressure experimental phase']}",-51.48091453,-7.354416361428571,-2.971653917142857,"['xas', 'elasticity', 'bandstructure']",True,"[261376, 203228, 160629, 261375, 69479, 186590, 4203, 75830, 75825, 202885, 203229, 71181, 82067, 75828, 69886, 75826, 75829, 75824, 75827, 69482, 86752]",True,2021-05-12 10:56:20.740000,NM,7,11,mp-4158,oxide,Nd2CuO4,"{'functional': 'PBE', 'labels': ['Nd_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Nd': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-4158,"['mp-670050', 'mp-660368', 'mp-4158', 'mp-1078016', 'mp-1173374', 'mp-1440751', 'mp-1668619', 'mp-1797319', 'mp-1588086', 'mp-1590518', 'mp-688505']",0.0084899,"{'Nd': 2.0, 'Cu': 1.0, 'O': 4.0}",97.4899480873212,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",8.708487558528232e-05,0.0084899,0,0.0084899,MP,data/source/MP/cleaned/cifs/MP-mp-4158.cif,True,,data/final/MP/graphs/Ce0.07Cu1Nd1.93O4-MP-mp-4158-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Al0.188V0.812,3,0.124,8.0,False,Al1.504V6.496,Al2V6,0.0,Other,True,Al18.8V81.2,Al-V,2,Supercon,Al0.188V0.812,MP-mp-1387,Al2V6,Al-V,Al25V75,P m -3 n,cubic,4.809439,4.809439,4.809439,data/final/MP/cifs/Al0.188V0.812-MP-mp-1387-synth_doped.cif,data/source/MP/raw/cifs/mp-1387.cif,mp-1387,0.0,,2011-05-13 16:21:19,5.367846692804527,10.17188/1189788,"@misc{osti_1189788,
    author = ""Persson, Kristin"",
    title = ""Materials Data on AlV3 (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189788"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695894'}},0.0,6.44208835,520.0,-63.0685394,-7.883567425,"{'tags': ['Aluminium vanadium (1/3)', 'Aluminum vanadium (1/3)']}",-63.0685394,-7.883567425,-0.1342439149999998,"['xas', 'elasticity', 'bandstructure']",True,"[609619, 609614, 58200]",True,2021-05-12 10:56:12.755000,FM,8,9,mp-1387,,AlV3,"{'functional': 'PBE', 'labels': ['Al', 'V_pv'], 'pot_type': 'paw'}","{'Al': 1.0, 'V': 3.0}",GGA,mp-1387,"['mp-928632', 'mp-911987', 'mp-928179', 'mp-1387', 'mp-1252991', 'mp-1428170', 'mp-1695894', 'mp-1802978', 'mp-1594038']",0.17173495,"{'Al': 2.0, 'V': 6.0}",111.24570748494747,[],FM,True,131,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.0, 0.0, 0.0]",0.0030874890165669,0.17173495,2,0.3434699,MP,data/source/MP/cleaned/cifs/MP-mp-1387.cif,True,,data/final/MP/graphs/Al0.188V0.812-MP-mp-1387-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
La0.22Sr1.78Ti1O4,3,0.0628571428571428,1.0,True,La0.22Sr1.78Ti1O4,Sr2Ti1O4,0.0,Oxide,True,La3.143Sr25.429Ti14.286O57.142857142857146,La-Sr-Ti-O,4,Supercon,Sr1.78La0.22Ti1O4,MP-mp-5532,Sr2Ti1O4,Sr-Ti-O,Sr28.571Ti14.286O57.142857142857146,I 4/m m m,tetragonal,3.927737999239305,3.927737999239305,6.922928730000001,data/final/MP/cifs/La0.22Sr1.78Ti1O4-MP-mp-5532-synth_doped.cif,data/source/MP/raw/cifs/mp-5532.cif,mp-5532,1.9442,,2011-05-13 05:44:37,4.873252813094423,10.17188/1267604,"@misc{osti_1267604,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr2TiO4 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1267604"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1674272'}},0.0,2.62531806,520.0,-52.42781927,-7.489688467142857,"{'tags': ['Distrontium titanate', 'Distrontium tetraoxotitanate']}",-52.42781927,-7.489688467142857,-3.4442137609523806,"['xas', 'bandstructure', 'diel', 'phonons', 'elasticity']",True,"[194714, 194713, 194717, 194715, 194716, 194718, 194719, 20293, 157402]",True,2021-05-12 10:56:22.739000,NM,7,16,mp-5532,oxide,Sr2TiO4,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ti_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ti': 1.0, 'O': 4.0}",GGA,mp-5532,"['mp-662841', 'mp-658198', 'mp-5532', 'mp-1077849', 'mp-1077882', 'mp-1077884', 'mp-1077886', 'mp-1077888', 'mp-1077892', 'mp-1077899', 'mp-1142130', 'mp-1440013', 'mp-1674272', 'mp-1781691', 'mp-1587222', 'mp-678037']",0.0013715,"{'Sr': 2.0, 'Ti': 1.0, 'O': 4.0}",97.82960638108987,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",1.4019273415630406e-05,0.0013715,0,0.0013715,MP,data/source/MP/cleaned/cifs/MP-mp-5532.cif,True,,data/final/MP/graphs/La0.22Sr1.78Ti1O4-MP-mp-5532-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Sn0.976Te1,2,0.0121457489878542,1.0,True,Sn0.976Te1,Sn1Te1,0.125,Other,True,Sn49.393Te50.607,Sn-Te,2,Supercon,Sn0.976Te1,MP-mp-1883,Sn1Te1,Sn-Te,Sn50Te50,F m -3 m,cubic,4.53766968,4.53766968,4.53766968,data/final/MP/cifs/Sn0.976Te1-MP-mp-1883-synth_doped.cif,data/source/MP/raw/cifs/mp-1883.cif,mp-1883,0.6623999999999999,,2011-05-12 18:43:07,6.19081042904143,10.17188/1193534,"@misc{osti_1193534,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SnTe (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1193534"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686906'}},0.0,6.06645058,520.0,-7.72519638,-3.86259819,"{'tags': ['Tin telluride (1/1)', 'Tin telluride']}",-7.72519638,-3.86259819,-0.4971617975000004,"['eos', 'elasticity', 'bandstructure', 'xas']",True,"[52489, 652760, 652744, 652756, 652761, 600865, 652763, 652745, 652742, 604177, 600813, 652741, 601065, 652750, 652755, 652753, 652751, 652749, 652752, 600136, 652754, 652746, 652759]",True,2021-05-12 10:56:14.760000,NM,2,9,mp-1883,,SnTe,"{'functional': 'PBE', 'labels': ['Sn_d', 'Te'], 'pot_type': 'paw'}","{'Sn': 1.0, 'Te': 1.0}",GGA,mp-1883,"['mp-663289', 'mp-655511', 'mp-657302', 'mp-1883', 'mp-1440781', 'mp-1686906', 'mp-1784332', 'mp-1596407', 'mp-1596974']",0.0,"{'Sn': 1.0, 'Te': 1.0}",66.06685541129963,[],NM,False,225,0,"[0, 0]",0.0,0.0,0,0.0,MP,data/source/MP/cleaned/cifs/MP-mp-1883.cif,True,,data/final/MP/graphs/Sn0.976Te1-MP-mp-1883-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Fe1Sb2,1,0.0,2.0,False,Fe2Sb4,Fe2Sb4,0.0,Ferrite,True,Fe33.333Sb66.667,Fe-Sb,2,Supercon,Fe1Sb2,MP-mp-20714,Fe2Sb4,Fe-Sb,Fe33.333Sb66.667,P n n m,orthorhombic,3.276064,5.779162,6.519539,data/final/MP/cifs/Fe1Sb2-MP-mp-20714.cif,data/source/MP/raw/cifs/mp-20714.cif,mp-20714,0.0,,2014-02-21 08:30:28,8.054637194636882,10.17188/1195876,"@misc{osti_1195876,
    author = ""Persson, Kristin"",
    title = ""Materials Data on FeSb2 (SG:58) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195876"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686930'}},0.0,8.01518293,520.0,-33.62407018,-5.604011696666666,"{'tags': ['High pressure experimental phase', 'Iron antimony (1/2)', 'Seinaejokite', 'Iron antimonide (1/2)']}",-33.62407018,-5.604011696666666,-0.1560080533333329,"['xas', 'elasticity', 'bandstructure']",True,"[186627, 186625, 90398, 15003, 76119, 186621, 186634, 186633, 186630, 633381, 42604, 151397, 186624, 42084, 633380, 42722, 186628, 633384, 186626, 186622, 186632, 186623, 186631, 186629, 41727, 633391, 633394, 186635, 633389]",True,2021-05-12 10:56:14.760000,FM,6,35,mp-20714,,FeSb2,"{'functional': 'PBE', 'labels': ['Fe_pv', 'Sb'], 'pot_type': 'paw'}","{'Fe': 1.0, 'Sb': 2.0}",GGA,mp-20714,"['mp-905533', 'mp-919651', 'mp-918654', 'mp-20714', 'mp-20981', 'mp-1071383', 'mp-1071394', 'mp-1071441', 'mp-1072112', 'mp-1072127', 'mp-1072170', 'mp-1077041', 'mp-1077070', 'mp-1077113', 'mp-1077083', 'mp-1077245', 'mp-1077321', 'mp-1077093', 'mp-1077384', 'mp-1077467', 'mp-1077420', 'mp-1077449', 'mp-1077395', 'mp-1077532', 'mp-1077713', 'mp-1077756', 'mp-1077809', 'mp-1077861', 'mp-1440782', 'mp-1686930', 'mp-1923954', 'mp-1592428', 'mp-1591222', 'mp-1072155', 'mp-1071421']",0.8067986,"{'Fe': 2.0, 'Sb': 4.0}",123.43380978194872,[],FM,True,58,1,"[1.0, 1.0, 0.0, 0.0, 0.0, 0.0]",0.0130725706583187,0.8067986,2,1.6135972,MP,data/source/MP/cleaned/cifs/MP-mp-20714.cif,False,,data/final/MP/graphs/Fe1Sb2-MP-mp-20714.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
O2,1,0.0,4.0,False,O8,O8,0.65,Oxide,True,O100,O,1,Supercon,O2,MP-mp-12957,O8,O,O100,C 1 2/m 1,monoclinic,4.38982817,5.3697897,5.369789699999999,data/final/MP/cifs/O2-MP-mp-12957.cif,data/source/MP/raw/cifs/mp-12957.cif,mp-12957,1.369,,2011-05-28 06:49:49,1.97448449124032,10.17188/1189289,"@misc{osti_1189289,
    author = ""Persson, Kristin"",
    title = ""Materials Data on O2 (SG:12) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189289"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700294'}},0.0,-1.30176261,520.0,-39.58368804,-4.947961005,"{'tags': ['Oxygen - eta phase', 'Oxygen (8) - epsilon', 'High pressure experimental phase']}",-39.58368804,-4.947961005,0.0,"['eos', 'elasticity', 'bandstructure', 'xas']",True,"[236855, 236857, 156481, 236856, 236858]",True,2021-05-12 10:56:12.755000,NM,8,15,mp-12957,,O2,"{'functional': 'PBE', 'labels': ['O'], 'pot_type': 'paw'}",{'O': 2.0},GGA,mp-12957,"['mp-974101', 'mp-973916', 'mp-974167', 'mp-656404', 'mp-659559', 'mp-665062', 'mp-12957', 'mp-1079109', 'mp-1079624', 'mp-1080488', 'mp-1441747', 'mp-1700294', 'mp-1933400', 'mp-974174', 'mp-1589272']",2.15e-06,{'O': 8.0},107.6438082346079,[],NM,False,12,0,"[0, 0, 0, 0, 0, 0, 0, 0]",7.98931228933897e-08,2.15e-06,0,8.6e-06,MP,data/source/MP/cleaned/cifs/MP-mp-12957.cif,False,,data/final/MP/graphs/O2-MP-mp-12957.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
Pd2Sr1,1,0.0,2.0,False,Pd4Sr2,Pd4Sr2,0.0,Other,True,Pd66.667Sr33.333,Pd-Sr,2,Supercon,Pd2Sr1,MP-mp-1558,Sr2Pd4,Pd-Sr,Pd66.667Sr33.333,F d -3 m,cubic,5.61746982,5.61746982,5.617469819999999,data/final/MP/cifs/Pd2Sr1-MP-mp-1558.cif,data/source/MP/raw/cifs/mp-1558.cif,mp-1558,0.0,,2011-05-13 08:22:32,7.960832959085343,10.17188/1191249,"@misc{osti_1191249,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SrPd2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191249"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701799'}},0.0,4.03229489,520.0,-27.91280126,-4.652133543333333,"{'tags': ['Palladium strontium hydride (2/1/1)', 'Palladium strontium (2/1)']}",-27.91280126,-4.652133543333333,-0.6357145188888887,"['xas', 'elasticity', 'bandstructure']",True,"[648962, 105706, 638420]",True,2021-05-12 10:56:12.755000,NM,6,9,mp-1558,,SrPd2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Pd'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Pd': 2.0}",GGA,mp-1558,"['mp-929471', 'mp-912746', 'mp-929082', 'mp-1558', 'mp-1077555', 'mp-1435428', 'mp-1701799', 'mp-1789343', 'mp-1590193']",0.00018555,"{'Sr': 2.0, 'Pd': 4.0}",125.34506640570434,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",2.9606270963937324e-06,0.00018555,0,0.0003711,MP,data/source/MP/cleaned/cifs/MP-mp-1558.cif,False,,data/final/MP/graphs/Pd2Sr1-MP-mp-1558.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ba2Cu3Er0.97Pr0.03O7,2,0.0046153846153846,1.0,True,Ba2Cu3Er0.97Pr0.03O7,Ba2Cu3Er1O7,93.9,Cuprate,True,Ba15.385Cu23.077Er7.462Pr0.231O53.84615384615385,Ba-Cu-Er-Pr-O,5,Supercon,Er0.97Pr0.03Ba2Cu3O7,MP-mp-622110,Ba2Er1Cu3O7,Ba-Cu-Er-O,Ba15.385Cu23.077Er7.692O53.84615384615385,P m m m,orthorhombic,3.834762,3.933125,11.788769,data/final/MP/cifs/Ba2Cu3Er0.97Pr0.03O7-MP-mp-622110-synth_doped.cif,data/source/MP/raw/cifs/mp-622110.cif,mp-622110,0.0,,2014-02-15 20:42:48,6.953388209207566,10.17188/1278094,"@misc{osti_1278094,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2ErCu3O7 (SG:47) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278094"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1676776'}},0.0334336014102625,3.20253361,520.0,-79.04238944,-6.080183803076922,"{'tags': ['Erbium barium copper oxide (1/2/3/7)', 'Erbium dibarium tricopper heptaoxide']}",-79.04238944,-6.080183803076922,-2.1932601480769227,['bandstructure'],True,"[63405, 81176]",True,2021-05-12 10:58:51.532000,NM,13,8,mp-622110,oxide,Ba2ErCu3O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Er_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Er': 1.0, 'Cu': 3.0, 'O': 7.0}",GGA,mp-622110,"['mp-932741', 'mp-622110', 'mp-931664', 'mp-916329', 'mp-1380960', 'mp-1676776', 'mp-1835850', 'mp-1598909']",0.0002229,"{'Ba': 2.0, 'Er': 1.0, 'Cu': 3.0, 'O': 7.0}",177.80526717534096,[],NM,False,47,0,"[0.0, 0.0, 0.0, 0.0, 0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",1.2536186556284031e-06,0.0002229,0,0.0002229,MP,data/source/MP/cleaned/cifs/MP-mp-622110.cif,True,,data/final/MP/graphs/Ba2Cu3Er0.97Pr0.03O7-MP-mp-622110-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
As2Fe2Mg0.9Sr4Ti1.1O6,2,0.0125,1.0,True,As2Fe2Mg0.9Sr4Ti1.1O6,As2Fe2Mg1Sr4Ti1O6,23.5,Ferrite,True,As12.5Fe12.5Mg5.625Sr25Ti6.875O37.5,As-Fe-Mg-Sr-Ti-O,6,Supercon,Fe2As2Sr4Mg0.9Ti1.1O6,MP-mp-1218475,Sr4Mg1Ti1Fe2As2O6,As-Fe-Mg-Sr-Ti-O,As12.5Fe12.5Mg6.25Sr25Ti6.25O37.5,P 4 m m,tetragonal,4.015363,4.015363,16.837343,data/final/MP/cifs/As2Fe2Mg0.9Sr4Ti1.1O6-MP-mp-1218475-synth_doped.cif,data/source/MP/raw/cifs/mp-1218475.cif,mp-1218475,0.0,,2019-01-12 19:38:13.106000,4.772232743847063,,,,0.596506169999997,3.61641349,520.0,-93.06331959,-5.816457474375,{'tags': []},-93.06331959,-5.816457474375,-1.8435971231250008,[],False,[],True,2021-05-12 11:00:42.526000,FM,16,3,mp-1218475,oxide,Sr4MgTiFe2(AsO3)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Mg_pv', 'Ti_pv', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Sr': 4.0, 'Mg': 1.0, 'Ti': 1.0, 'Fe': 2.0, 'As': 2.0, 'O': 6.0}",GGA+U,mp-1218475,"['mp-1218475', 'mp-1332338', 'mp-1770100']",0.1094594,"{'Sr': 4.0, 'Mg': 1.0, 'Ti': 1.0, 'Fe': 2.0, 'As': 2.0, 'O': 6.0}",271.4708387835521,[],FM,True,25,1,"[-0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, 0.1, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0004032086852881,0.1094594,1,0.1094594,MP,data/source/MP/cleaned/cifs/MP-mp-1218475.cif,True,,data/final/MP/graphs/As2Fe2Mg0.9Sr4Ti1.1O6-MP-mp-1218475-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
B12Sc1,1,0.0,1.0,True,B12Sc1,B12Sc1,0.39,Other,True,B92.308Sc7.692,B-Sc,2,Supercon,B12Sc1,MP-mp-8772,Sc1B12,B-Sc,B92.308Sc7.692,F m -3 m,cubic,5.24068655,5.24068655,5.24068655,data/final/MP/cifs/B12Sc1-MP-mp-8772.cif,data/source/MP/raw/cifs/mp-8772.cif,mp-8772,0.0,,2011-05-28 02:53:11,2.8501150631557026,10.17188/1282026,"@misc{osti_1282026,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ScB12 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1282026"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701820'}},0.0,6.33116432,520.0,-89.23006955,-6.863851503846154,{'tags': ['Scandium boride (1/12)']},-89.23006955,-6.863851503846154,-0.2111460919230759,"['xas', 'elasticity', 'bandstructure']",True,"[615424, 68028]",True,2021-05-12 10:56:33.121000,NM,13,10,mp-8772,,ScB12,"{'functional': 'PBE', 'labels': ['Sc_sv', 'B'], 'pot_type': 'paw'}","{'Sc': 1.0, 'B': 12.0}",GGA,mp-8772,"['mp-990668', 'mp-992774', 'mp-8772', 'mp-1104044', 'mp-1140778', 'mp-1415531', 'mp-1701820', 'mp-1797822', 'mp-994155', 'mp-1601494']",4.26e-05,"{'Sc': 1.0, 'B': 12.0}",101.77697949415592,[],NM,False,225,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.185622349152748e-07,4.26e-05,0,4.26e-05,MP,data/source/MP/cleaned/cifs/MP-mp-8772.cif,False,,data/final/MP/graphs/B12Sc1-MP-mp-8772.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ge5La1,1,0.0,1.0,True,Ge5La1,Ge5La1,7.0,Other,True,Ge83.333La16.667,Ge-La,2,Supercon,Ge5La1,MP-mp-1025100,La1Ge5,Ge-La,Ge83.333La16.667,I m m m,orthorhombic,4.052239998698456,6.28016061,6.280160610009147,data/final/MP/cifs/Ge5La1-MP-mp-1025100.cif,data/source/MP/raw/cifs/mp-1025100.cif,mp-1025100,0.0,,2016-10-01 09:33:14,6.452387950060925,10.17188/1355232,"@article{osti_1355232,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaGe5 (SG:71) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1355232"",
    place = ""United States"",
    year = ""2017"",
    month = ""5""
}
",{'GGA': {'task_id': 'mp-1697679'}},0.0540088668750016,5.1462174,520.0,-29.81193223,-4.968655371666666,{'tags': ['Lanthanum germanide (1/5)']},-29.81193223,-4.968655371666666,-0.2934643083333335,['bandstructure'],True,[236950],True,2021-05-12 10:58:09.072000,NM,6,6,mp-1025100,,LaGe5,"{'functional': 'PBE', 'labels': ['La', 'Ge_d'], 'pot_type': 'paw'}","{'La': 1.0, 'Ge': 5.0}",GGA,mp-1025100,"['mp-1025100', 'mp-1077387', 'mp-1418200', 'mp-1697679', 'mp-1930632', 'mp-1586314']",0.0108974,"{'La': 1.0, 'Ge': 5.0}",129.21816774527352,[],NM,False,71,0,"[0, 0, 0, 0, 0, 0]",8.43333425179185e-05,0.0108974,0,0.0108974,MP,data/source/MP/cleaned/cifs/MP-mp-1025100.cif,False,,data/final/MP/graphs/Ge5La1-MP-mp-1025100.json,0,True,mmm,0,0,0,7,0,0,0,0,0,1,0,1.0,False
Ba2Cu1Hg1O4.108,2,0.0133201776023679,0.973802458617332,True,Ba1.947Cu0.974Hg0.974O4,Ba2Cu1Hg1O4,89.1,Cuprate,True,Ba24.667Cu12.333Hg12.333O50.6660088801184,Ba-Cu-Hg-O,4,Supercon,Hg1Ba2Cu1O4.108,MP-mp-6562,Ba2Cu1Hg1O4,Ba-Cu-Hg-O,Ba25Cu12.5Hg12.5O50,P 4/m m m,tetragonal,3.933714,3.933714,9.827602,data/final/MP/cifs/Ba2Cu1Hg1O4.108-MP-mp-6562-synth_doped.cif,data/source/MP/raw/cifs/mp-6562.cif,mp-6562,0.0,,2011-05-13 18:18:06,6.582036471328142,10.17188/1281336,"@misc{osti_1281336,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2CuHgO4 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281336"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697135'}},0.0234340381250053,2.58068675,520.0,-40.91481298,-5.1143516225,"{'tags': ['Mercury dibarium copper oxide', 'High pressure experimental phase']}",-40.91481298,-5.1143516225,-1.953767533125,"['xas', 'bandstructure']",True,"[75722, 75720, 75724, 75721, 75723]",True,2021-05-12 10:57:32.679000,NM,8,8,mp-6562,oxide,Ba2CuHgO4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Cu_pv', 'Hg', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",GGA,mp-6562,"['mp-6562', 'mp-990899', 'mp-992892', 'mp-1435690', 'mp-1697135', 'mp-1878488', 'mp-994198', 'mp-1592659']",0.0003984,"{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",152.07335344042525,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0, 0, 0]",2.619788352047311e-06,0.0003984,0,0.0003984,MP,data/source/MP/cleaned/cifs/MP-mp-6562.cif,True,,data/final/MP/graphs/Ba2Cu1Hg1O4.108-MP-mp-6562-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ba2Ca0.01Cu4Ho0.99O8,2,0.0013333333333333,1.0,True,Ba2Ca0.01Cu4Ho0.99O8,Ba2Cu4Ho1O8,76.8,Cuprate,True,Ba13.333Ca0.067Cu26.667Ho6.6O53.333333333333336,Ba-Ca-Cu-Ho-O,5,Supercon,Ho0.99Ca0.01Ba2Cu4O8,MP-mp-6205,Ba2Ho1Cu4O8,Ba-Cu-Ho-O,Ba13.333Cu26.667Ho6.667O53.333333333333336,C m m m,orthorhombic,3.87946,3.894348001774656,13.87398175,data/final/MP/cifs/Ba2Ca0.01Cu4Ho0.99O8-MP-mp-6205-synth_doped.cif,data/source/MP/raw/cifs/mp-6205.cif,mp-6205,0.0,,2011-05-16 02:52:11,6.575196061130729,10.17188/1278028,"@misc{osti_1278028,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Ho(CuO2)4 (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278028"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678300'}},0.0,3.29099269,520.0,-89.84060384,-5.989373589333334,"{'tags': ['Holmium dibarium tricopper copper(III) oxide', 'Holmium dibarium tetracopper octaoxide', 'Holmium barium copper oxide (1/2/4/8)']}",-89.84060384,-5.989373589333334,-2.0623825726666665,"['xas', 'bandstructure']",True,"[67638, 75688, 74126, 78624, 67639]",True,2021-05-12 10:57:28.836000,NM,15,7,mp-6205,oxide,Ba2Ho(CuO2)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ho_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Ho': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-6205,"['mp-1001291', 'mp-1007620', 'mp-6205', 'mp-1381302', 'mp-1678300', 'mp-1832236', 'mp-1599331']",0.0019325,"{'Ba': 2.0, 'Ho': 1.0, 'Cu': 4.0, 'O': 8.0}",207.53304019835824,[],NM,False,65,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",9.31177030005889e-06,0.0019325,0,0.0019325,MP,data/source/MP/cleaned/cifs/MP-mp-6205.cif,True,,data/final/MP/graphs/Ba2Ca0.01Cu4Ho0.99O8-MP-mp-6205-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
C1Fe0.01Mg1Ni2.99,2,0.0039999999999999,1.0,True,C1Fe0.01Mg1Ni2.99,C1Mg1Ni3,6.25,Other,True,C20Fe0.2Mg20Ni59.8,C-Fe-Mg-Ni,4,Supercon,Mg1C1Ni2.99Fe0.01,MP-mp-10700,Mg1Ni3C1,C-Mg-Ni,C20Mg20Ni60,P m -3 m,cubic,3.810209,3.810209,3.810209,data/final/MP/cifs/C1Fe0.01Mg1Ni2.99-MP-mp-10700-synth_doped.cif,data/source/MP/raw/cifs/mp-10700.cif,mp-10700,0.0,,2011-05-28 10:04:44,6.376007671789427,10.17188/1187303,"@misc{osti_1187303,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MgNi3C (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187303"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678621'}},0.0,6.64260176,520.0,-28.85099542,-5.770199084,{'tags': ['Magnesium nickel carbide (1/3/1)']},-28.85099542,-5.770199084,-0.1367049259999994,"['xas', 'elasticity', 'bandstructure']",True,[77152],True,2021-05-12 10:56:10.715000,NM,5,8,mp-10700,,MgNi3C,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Ni_pv', 'C'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",GGA,mp-10700,"['mp-927245', 'mp-927653', 'mp-911184', 'mp-10700', 'mp-1438083', 'mp-1678621', 'mp-1791467', 'mp-1591421']",0.0387875,"{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",55.31544309398296,[],NM,False,221,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",0.0007012056277683,0.0387875,0,0.0387875,MP,data/source/MP/cleaned/cifs/MP-mp-10700.cif,True,,data/final/MP/graphs/C1Fe0.01Mg1Ni2.99-MP-mp-10700-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
B1C1Lu1Ni0.8V0.2,3,0.0999999999999999,2.0,False,B2C2Lu2Ni1.6V0.4,B2C2Lu2Ni2,2.6,Other,True,B25C25Lu25Ni20V5,B-C-Lu-Ni-V,5,Supercon,Lu1Ni0.8V0.2B1C1,MP-mp-6188,Lu2Ni2B2C2,B-C-Lu-Ni,B25C25Lu25Ni25,P 4/n m m,tetragonal,3.499459,3.499459,7.54108,data/final/MP/cifs/B1C1Lu1Ni0.8V0.2-MP-mp-6188-synth_doped.cif,data/source/MP/raw/cifs/mp-6188.cif,mp-6188,0.0,,2011-05-13 11:39:58,9.22360692471969,10.17188/1277950,"@misc{osti_1277950,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LuNiBC (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277950"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701902'}},0.0,5.56637243,520.0,-56.94584528,-7.11823066,{'tags': []},-56.94584528,-7.11823066,-0.5664157422916656,"['xas', 'bandstructure']",True,"[54041, 75610]",True,2021-05-12 10:57:28.836000,NM,8,8,mp-6188,,LuNiBC,"{'functional': 'PBE', 'labels': ['Lu_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Lu': 1.0, 'Ni': 1.0, 'B': 1.0, 'C': 1.0}",GGA,mp-6188,"['mp-6188', 'mp-1007095', 'mp-1000629', 'mp-1426768', 'mp-1701902', 'mp-1796435', 'mp-1011840', 'mp-1591367']",0.0004347,"{'Lu': 2.0, 'Ni': 2.0, 'B': 2.0, 'C': 2.0}",92.34967413717082,[],NM,False,129,0,"[0, 0, 0, 0, 0, 0, 0, 0]",9.414218383798992e-06,0.0004347,0,0.0008694,MP,data/source/MP/cleaned/cifs/MP-mp-6188.cif,True,,data/final/MP/graphs/B1C1Lu1Ni0.8V0.2-MP-mp-6188-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Al3Ni2U1,1,0.0,1.0,True,Al3Ni2U1,Al3Ni2U1,1.021,Heavy_fermion,True,Al50Ni33.333U16.667,Al-Ni-U,3,Supercon,U1Ni2Al3,MP-mp-2903,U1Al3Ni2,Al-Ni-U,Al50Ni33.333U16.667,P 6/m m m,hexagonal,4.031899,5.147229997095757,5.14723005,data/final/MP/cifs/Al3Ni2U1-MP-mp-2903.cif,data/source/MP/raw/cifs/mp-2903.cif,mp-2903,0.0,,2011-05-13 05:51:52,7.832617582421956,10.17188/1203074,"@misc{osti_1203074,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UAl3Ni2 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1203074"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678525'}},0.1051396383333314,9.05221071,520.0,-36.52297192,-6.087161986666668,"{'tags': ['Uranium nickel aluminium (1/2/3)', 'Aluminum nickel uranium (3/2/1)', 'Aluminium nickel uranium (3/2/1)']}",-36.52297192,-6.087161986666668,-0.4057601766666678,"['xas', 'elasticity', 'bandstructure']",True,"[659220, 602903, 104408, 659142, 370029]",True,2021-05-12 10:56:18.721000,NM,6,9,mp-2903,,UAl3Ni2,"{'functional': 'PBE', 'labels': ['U', 'Al', 'Ni_pv'], 'pot_type': 'paw'}","{'U': 1.0, 'Al': 3.0, 'Ni': 2.0}",GGA,mp-2903,"['mp-991128', 'mp-2903', 'mp-993112', 'mp-1256856', 'mp-1437596', 'mp-1678525', 'mp-1796633', 'mp-994437', 'mp-1589145']",0.0881673,"{'U': 1.0, 'Al': 3.0, 'Ni': 2.0}",92.50973387636644,[],NM,False,191,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0009530597084824,0.0881673,0,0.0881673,MP,data/source/MP/cleaned/cifs/MP-mp-2903.cif,False,,data/final/MP/graphs/Al3Ni2U1-MP-mp-2903.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ge2.3La1Pt1.7,3,0.1199999999999999,1.0,True,Ge2.3La1Pt1.7,Ge2La1Pt2,0.0,Other,True,Ge46La20Pt34,Ge-La-Pt,3,Supercon,La1Pt1.7Ge2.3,MP-mp-21057,La1Ge2Pt2,Ge-La-Pt,Ge40La20Pt40,I 4/m m m,tetragonal,4.458128002603763,4.458128002603763,5.96043246,data/final/MP/cifs/Ge2.3La1Pt1.7-MP-mp-21057-synth_doped.cif,data/source/MP/raw/cifs/mp-21057.cif,mp-21057,0.0,,2014-02-21 09:25:11,11.137876633950224,10.17188/1196317,"@misc{osti_1196317,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La(GePt)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196317"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704515'}},0.0973405535000013,6.85937735,520.0,-30.67754438,-6.135508876,{'tags': ['Lanthanum platinum germanide (1/2/2)']},-30.67754438,-6.135508876,-0.8707332289999996,"['xas', 'bandstructure']",True,[53665],True,2021-05-12 10:56:57.051000,NM,5,8,mp-21057,,La(GePt)2,"{'functional': 'PBE', 'labels': ['La', 'Ge_d', 'Pt'], 'pot_type': 'paw'}","{'La': 1.0, 'Ge': 2.0, 'Pt': 2.0}",GGA,mp-21057,"['mp-993642', 'mp-991893', 'mp-21057', 'mp-1429115', 'mp-1704515', 'mp-1783057', 'mp-994947', 'mp-1591906']",0.003651,"{'La': 1.0, 'Ge': 2.0, 'Pt': 2.0}",100.53893739664449,[],NM,False,139,0,"[0, 0, 0, 0, 0]",3.631428871777447e-05,0.003651,0,0.003651,MP,data/source/MP/cleaned/cifs/MP-mp-21057.cif,True,,data/final/MP/graphs/Ge2.3La1Pt1.7-MP-mp-21057-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Cr2Zr1,1,0.0,2.0,False,Cr4Zr2,Cr4Zr2,0.0,Other,True,Cr66.667Zr33.333,Cr-Zr,2,Supercon,Cr2Zr1,MP-mp-903,Zr2Cr4,Cr-Zr,Cr66.667Zr33.333,F d -3 m,cubic,5.05240665,5.052406649999999,5.052406649999999,data/final/MP/cifs/Cr2Zr1-MP-mp-903.cif,data/source/MP/raw/cifs/mp-903.cif,mp-903,0.0,,2011-05-13 16:29:58,7.10910702958636,10.17188/1312929,"@misc{osti_1312929,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrCr2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1312929"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668413'}},0.0,5.36878789,520.0,-55.90132063,-9.316886771666669,"{'tags': ['Zirconium chromium hydride (1/2/3.7)', 'Zirconium chromium (1/2)', 'Chromium zirconium hydride (2/1/4)', 'Chromium zirconium hydride (4/2/3)', 'Chromium zirconium (2/1)', 'Chromium zirconium hydride (2/1/3)']}",-55.90132063,-9.316886771666669,-0.0322882483333325,"['xas', 'elasticity', 'bandstructure']",True,"[626954, 626932, 626958, 626965, 626942, 626967, 626131, 102861, 102860, 626137, 626938, 626947, 626962, 626960, 601170, 626964, 626936, 626946, 106885, 626132, 167447, 626127, 626952, 626963, 626940, 626961]",True,2021-05-12 10:56:33.121000,NM,6,14,mp-903,,ZrCr2,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Cr_pv'], 'pot_type': 'paw'}","{'Zr': 1.0, 'Cr': 2.0}",GGA,mp-903,"['mp-912346', 'mp-928364', 'mp-928879', 'mp-903', 'mp-1077035', 'mp-1077222', 'mp-1077504', 'mp-1077549', 'mp-1080392', 'mp-1440805', 'mp-1668413', 'mp-1928496', 'mp-1594137', 'mp-1594990']",3.68e-05,"{'Zr': 2.0, 'Cr': 4.0}",91.19686204866724,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",8.070453121591325e-07,3.68e-05,0,7.36e-05,MP,data/source/MP/cleaned/cifs/MP-mp-903.cif,False,,data/final/MP/graphs/Cr2Zr1-MP-mp-903.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
B3Rh7,1,0.0,2.0,False,B6Rh14,B6Rh14,0.0,Other,True,B30Rh70,B-Rh,2,Supercon,B3Rh7,MP-mp-1106065,B6Rh14,B-Rh,B30Rh70,P 63 m c,hexagonal,4.890471,7.516408000597951,7.51640863,data/final/MP/cifs/B3Rh7-MP-mp-1106065.cif,data/source/MP/raw/cifs/mp-1106065.cif,mp-1106065,0.0,,2018-07-19 07:38:44,10.4481692971122,,,{'GGA': {'task_id': 'mp-1670807'}},0.0054004587499996,6.92042238,520.0,-147.8846387,-7.394231935,"{'tags': ['Rhodium boride (7/3)', 'Rh7B3', 'Th7Fe3']}",-147.8846387,-7.394231935,-0.2353988947499999,['bandstructure'],True,[615290],True,2021-05-12 10:58:22.271000,NM,20,5,mp-1106065,,B3Rh7,"{'functional': 'PBE', 'labels': ['B', 'Rh_pv'], 'pot_type': 'paw'}","{'B': 3.0, 'Rh': 7.0}",GGA,mp-1106065,"['mp-1106065', 'mp-1415134', 'mp-1670807', 'mp-1775781', 'mp-1584458']",0.0350158,"{'B': 6.0, 'Rh': 14.0}",239.2776090101401,[],NM,False,186,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0002926792869993,0.0350158,0,0.0700316,MP,data/source/MP/cleaned/cifs/MP-mp-1106065.cif,False,,data/final/MP/graphs/B3Rh7-MP-mp-1106065.json,0,True,6mm,0,5,0,0,0,0,0,1,0,0,0,1.0,False
Cu1La0.125Sr0.875O2,3,0.0625,2.0,False,Cu2La0.25Sr1.75O4,Cu2Sr2O4,36.9,Cuprate,True,Cu25La3.125Sr21.875O50,Cu-La-Sr-O,4,Supercon,Sr0.875La0.125Cu1O2,MP-mp-5787,Sr2Cu2O4,Cu-Sr-O,Cu25Sr25O50,C m c m,orthorhombic,3.644437999912225,3.974263,8.32909336,data/final/MP/cifs/Cu1La0.125Sr0.875O2-MP-mp-5787-synth_doped.cif,data/source/MP/raw/cifs/mp-5787.cif,mp-5787,0.0,,2011-05-13 22:43:08,5.167573150857569,10.17188/1276630,"@misc{osti_1276630,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SrCuO2 (SG:63) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1276630"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703560'}},0.0,3.45760864,520.0,-45.24374469,-5.65546808625,"{'tags': ['Strontium cuprate', 'Strontium copper oxide']}",-45.24374469,-5.65546808625,-2.0778125529166664,"['xas', 'elasticity', 'bandstructure']",True,"[77291, 93653, 202992, 16217, 83051, 77293]",True,2021-05-12 10:56:27.046000,NM,8,8,mp-5787,oxide,SrCuO2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Cu': 1.0, 'O': 2.0}",GGA,mp-5787,"['mp-924142', 'mp-909103', 'mp-5787', 'mp-924940', 'mp-1475985', 'mp-1703560', 'mp-1802910', 'mp-1593696']",4e-07,"{'Sr': 2.0, 'Cu': 2.0, 'O': 4.0}",117.71572347282628,[],NM,False,63,0,"[0, 0, 0, 0, 0, 0, 0, 0]",6.796033498317439e-09,4e-07,0,8e-07,MP,data/source/MP/cleaned/cifs/MP-mp-5787.cif,True,,data/final/MP/graphs/Cu1La0.125Sr0.875O2-MP-mp-5787-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
As1Ge1,1,0.0,6.0,False,As6Ge6,As6Ge6,3.5,Other,True,As50Ge50,As-Ge,2,Supercon,As1Ge1,MP-mp-9548,Ge6As6,As-Ge,As50Ge50,C 1 2/m 1,monoclinic,3.833257999057508,8.54258714,9.90234846,data/final/MP/cifs/As1Ge1-MP-mp-9548.cif,data/source/MP/raw/cifs/mp-9548.cif,mp-9548,0.6389,,2011-06-04 11:56:48,4.812662479027046,10.17188/1313324,"@misc{osti_1313324,
    author = ""Persson, Kristin"",
    title = ""Materials Data on GeAs (SG:12) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1313324"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1676405'}},0.0028481788541689,2.68804246,520.0,-56.02833607,-4.669028005833334,{'tags': ['Germanium arsenide (1/1)']},-56.02833607,-4.669028005833334,-0.0279548758333335,"['diel', 'bandstructure', 'elasticity']",True,"[86361, 610598]",True,2021-05-12 10:56:35.166000,NM,12,6,mp-9548,,GeAs,"{'functional': 'PBE', 'labels': ['Ge_d', 'As'], 'pot_type': 'paw'}","{'Ge': 1.0, 'As': 1.0}",GGA,mp-9548,"['mp-9548', 'mp-1140507', 'mp-1430134', 'mp-1676405', 'mp-1811217', 'mp-1602787']",0.0003816166666666,"{'Ge': 6.0, 'As': 6.0}",305.483880406514,[],NM,False,12,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",7.495321838104998e-06,0.0003816166666666,0,0.0022897,MP,data/source/MP/cleaned/cifs/MP-mp-9548.cif,False,,data/final/MP/graphs/As1Ge1-MP-mp-9548.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
Ba0.25Cu1F2Sr1.75O2,3,0.0714285714285714,1.0,True,Ba0.25Cu1F2Sr1.75O2,Cu1F2Sr2O2,58.0,Cuprate,True,Ba3.571Cu14.286F28.571Sr25O28.571428571428573,Ba-Cu-F-Sr-O,5,Supercon,Sr1.75Ba0.25Cu1F2O2,MP-mp-1025280,Sr2Cu1O2F2,Cu-F-Sr-O,Cu14.286F28.571Sr28.571O28.571428571428573,I 4/m m m,tetragonal,4.005971999505202,4.005971999505202,7.0713802,data/final/MP/cifs/Ba0.25Cu1F2Sr1.75O2-MP-mp-1025280-synth_doped.cif,data/source/MP/raw/cifs/mp-1025280.cif,mp-1025280,0.0,,2016-10-02 06:58:47,4.931293309587092,10.17188/1355558,"@article{osti_1355558,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr2Cu(OF)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1355558"",
    place = ""United States"",
    year = ""2017"",
    month = ""5""
}
",{'GGA': {'task_id': 'mp-1761325'}},0.0271226678571521,2.51271532,520.0,-39.71814041,-5.674020058571428,"{'tags': ['Sr2CuO2F2', '*']}",-39.71814041,-5.674020058571428,-2.9741524126190475,"['bandstructure', 'elasticity']",True,[],True,2021-05-12 10:56:10.715000,NM,7,5,mp-1025280,oxide,Sr2Cu(OF)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Cu_pv', 'O', 'F'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Cu': 1.0, 'O': 2.0, 'F': 2.0}",GGA,mp-1025280,"['mp-1025280', 'mp-1386311', 'mp-1761325', 'mp-1795757', 'mp-1624883']",0.0007221,"{'Sr': 2.0, 'Cu': 1.0, 'O': 2.0, 'F': 2.0}",103.97757510750009,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",6.9447666889080365e-06,0.0007221,0,0.0007221,MP,data/source/MP/cleaned/cifs/MP-mp-1025280.cif,True,,data/final/MP/graphs/Ba0.25Cu1F2Sr1.75O2-MP-mp-1025280-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Cu1La2O4.02,2,0.0024420024420023,0.9950082918739636,True,Cu0.995La1.99O4,Cu1La2O4,0.0,Cuprate,True,Cu14.245La28.49O57.26495726495727,Cu-La-O,3,Supercon,La2Cu1O4.02,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La2O4.02-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La2O4.02-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As2La1Pd2,1,0.0,1.0,True,As2La1Pd2,As2La1Pd2,0.97,Other,True,As40La20Pd40,As-La-Pd,3,Supercon,La1Pd2As2,MP-mp-571434,La1As2Pd2,As-La-Pd,As40La20Pd40,I 4/m m m,tetragonal,4.366942002595537,4.366942002595537,6.08292851,data/final/MP/cifs/As2La1Pd2-MP-mp-571434.cif,data/source/MP/raw/cifs/mp-571434.cif,mp-571434,0.0,,2014-02-16 13:05:22,8.33368197813163,10.17188/1276256,"@misc{osti_1276256,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La(AsPd)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1276256"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695135'}},0.0029070451666637,7.23048398,520.0,-29.19528042,-5.839056084,{'tags': ['Lanthanum palladium arsenide (1/2/2)']},-29.19528042,-5.839056084,-0.916254577,"['xas', 'bandstructure']",True,"[192474, 604343]",True,2021-05-12 10:57:26.891000,NM,5,12,mp-571434,,La(AsPd)2,"{'functional': 'PBE', 'labels': ['La', 'As', 'Pd'], 'pot_type': 'paw'}","{'La': 1.0, 'As': 2.0, 'Pd': 2.0}",GGA,mp-571434,"['mp-1001855', 'mp-571434', 'mp-1008236', 'mp-1069499', 'mp-1069560', 'mp-1069608', 'mp-1441216', 'mp-1695135', 'mp-1928748', 'mp-1012548', 'mp-1596873', 'mp-1069595']",0.0058512,"{'La': 1.0, 'As': 2.0, 'Pd': 2.0}",99.94472840271128,[],NM,False,139,0,"[0, 0, 0, 0, 0]",5.854435840201123e-05,0.0058512,0,0.0058512,MP,data/source/MP/cleaned/cifs/MP-mp-571434.cif,False,,data/final/MP/graphs/As2La1Pd2-MP-mp-571434.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ba1Sb2Ti2O1,1,0.0,1.0,True,Ba1Sb2Ti2O1,Ba1Sb2Ti2O1,0.964,Oxide,True,Ba16.667Sb33.333Ti33.333O16.666666666666668,Ba-Sb-Ti-O,4,Supercon,Ba1Ti2Sb2O1,MP-mp-1070806,Ba1Ti2Sb2O1,Ba-Sb-Ti-O,Ba16.667Sb33.333Ti33.333O16.666666666666668,P 4/m m m,tetragonal,4.113474,4.113474,8.312382,data/final/MP/cifs/Ba1Sb2Ti2O1-MP-mp-1070806.cif,data/source/MP/raw/cifs/mp-1070806.cif,mp-1070806,0.0,,2018-03-22 04:02:04,5.8154485533321445,,,{'GGA': {'task_id': 'mp-1702174'}},0.0,5.89751533,520.0,-39.14932631,-6.524887718333333,{'tags': []},-39.14932631,-6.524887718333333,-1.5507346602777776,['bandstructure'],True,"[430061, 237789, 430060]",True,2021-05-12 10:58:14.654000,NM,6,16,mp-1070806,oxide,BaTi2Sb2O,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ti_pv', 'Sb', 'O'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Ti': 2.0, 'Sb': 2.0, 'O': 1.0}",GGA,mp-1070806,"['mp-1071055', 'mp-1071068', 'mp-1071083', 'mp-1071088', 'mp-1070806', 'mp-1071124', 'mp-1070846', 'mp-1070900', 'mp-1071137', 'mp-1423542', 'mp-1702174', 'mp-1785425', 'mp-1588663', 'mp-1070899', 'mp-1071129', 'mp-1071119']",0.001055,"{'Ba': 1.0, 'Ti': 2.0, 'Sb': 2.0, 'O': 1.0}",140.65105900950408,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0]",7.500832254158225e-06,0.001055,0,0.001055,MP,data/source/MP/cleaned/cifs/MP-mp-1070806.cif,False,,data/final/MP/graphs/Ba1Sb2Ti2O1-MP-mp-1070806.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Nb3Pd0.02Rh0.98,2,0.01,2.0,False,Nb6Pd0.04Rh1.96,Nb6Rh2,2.495,Other,True,Nb75Pd0.5Rh24.5,Nb-Pd-Rh,3,Supercon,Nb3Rh0.98Pd0.02,MP-mp-1545,Nb6Rh2,Nb-Rh,Nb75Rh25,P m -3 n,cubic,5.186072,5.186072,5.186072,data/final/MP/cifs/Nb3Pd0.02Rh0.98-MP-mp-1545-synth_doped.cif,data/source/MP/raw/cifs/mp-1545.cif,mp-1545,0.0,,2011-05-14 11:20:25,9.086567873234834,10.17188/1191190,"@misc{osti_1191190,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Rh (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191190"",
    place = ""United States"",
    year = ""2015"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700041'}},0.0,5.48706495,520.0,-77.37430008,-9.67178751,{'tags': ['Niobium rhodium (3/1)']},-77.37430008,-9.67178751,-0.2547317625000005,"['xas', 'elasticity', 'bandstructure']",True,"[105216, 645269]",True,2021-05-12 10:56:12.755000,NM,8,8,mp-1545,,Nb3Rh,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Rh_pv'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Rh': 1.0}",GGA,mp-1545,"['mp-942004', 'mp-943019', 'mp-935201', 'mp-1545', 'mp-1433570', 'mp-1700041', 'mp-1786474', 'mp-1591392']",0.00021655,"{'Nb': 6.0, 'Rh': 2.0}",139.48118416938905,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",3.1050783127424102e-06,0.00021655,0,0.0004331,MP,data/source/MP/cleaned/cifs/MP-mp-1545.cif,True,,data/final/MP/graphs/Nb3Pd0.02Rh0.98-MP-mp-1545-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Co1Y3,1,0.0,4.0,False,Co4Y12,Co4Y12,0.34,Other,True,Co25Y75,Co-Y,2,Supercon,Co1Y3,MP-mp-1105598,Y12Co4,Co-Y,Co25Y75,P n m a,orthorhombic,6.314404,7.015783,9.482838,data/final/MP/cifs/Co1Y3-MP-mp-1105598.cif,data/source/MP/raw/cifs/mp-1105598.cif,mp-1105598,0.0,,2018-07-19 05:06:19,5.148898383530766,,,{'GGA': {'task_id': 'mp-1671488'}},0.0,3.43760268,520.0,-108.33819804,-6.7711373775,"{'tags': ['Y3Co', 'Fe3C', 'Yttrium cobalt (3/1)', 'Cobalt yttrium (1/3)']}",-108.33819804,-6.7711373775,-0.1442045937499996,['bandstructure'],True,"[656088, 625614, 625576, 192244, 625639, 192245]",True,2021-05-12 10:58:22.271000,NM,16,9,mp-1105598,,Y3Co,"{'functional': 'PBE', 'labels': ['Y_sv', 'Co'], 'pot_type': 'paw'}","{'Y': 3.0, 'Co': 1.0}",GGA,mp-1105598,"['mp-1105598', 'mp-1105899', 'mp-1188516', 'mp-1189262', 'mp-1189530', 'mp-1432636', 'mp-1671488', 'mp-1814670', 'mp-1597984']",0.000242525,"{'Y': 12.0, 'Co': 4.0}",420.0943532850076,[],NM,False,62,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",2.3092431317253343e-06,0.000242525,0,0.0009701,MP,data/source/MP/cleaned/cifs/MP-mp-1105598.cif,False,,data/final/MP/graphs/Co1Y3-MP-mp-1105598.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Nb3Sb0.75Sn0.25,3,0.125,2.0,False,Nb6Sb1.5Sn0.5,Nb6Sb2,0.0,Other,True,Nb75Sb18.75Sn6.25,Nb-Sb-Sn,3,Supercon,Nb3Sn0.25Sb0.75,MP-mp-2053,Nb6Sb2,Nb-Sb,Nb75Sb25,P m -3 n,cubic,5.311983,5.311983,5.311983,data/final/MP/cifs/Nb3Sb0.75Sn0.25-MP-mp-2053-synth_doped.cif,data/source/MP/raw/cifs/mp-2053.cif,mp-2053,0.0,,2011-05-13 19:35:55,8.87337760679475,10.17188/1195662,"@misc{osti_1195662,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Sb (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195662"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696683'}},0.0,7.01392698,520.0,-71.08518378,-8.8856479725,"{'tags': ['Niobium antimony (3/1)', 'Niobium antimonide (3/1)']}",-71.08518378,-8.8856479725,-0.3254188824999993,"['xas', 'elasticity', 'bandstructure']",True,"[645347, 76572, 645349, 190178, 645357, 645352]",True,2021-05-12 10:56:14.760000,NM,8,8,mp-2053,,Nb3Sb,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Sb'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Sb': 1.0}",GGA,mp-2053,"['mp-910444', 'mp-926252', 'mp-926772', 'mp-2053', 'mp-1413395', 'mp-1696683', 'mp-1877686', 'mp-1592488']",0.00022775,"{'Nb': 6.0, 'Sb': 2.0}",149.88909224806147,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",3.0389135938335167e-06,0.00022775,0,0.0004555,MP,data/source/MP/cleaned/cifs/MP-mp-2053.cif,True,,data/final/MP/graphs/Nb3Sb0.75Sn0.25-MP-mp-2053-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
La3Pd5Si1,1,0.0,2.0,False,La6Pd10Si2,La6Pd10Si2,1.4,Other,True,La33.333Pd55.556Si11.111,La-Pd-Si,3,Supercon,La3Pd5Si1,MP-mp-571217,La6Si2Pd10,La-Pd-Si,La33.333Pd55.556Si11.111,I m m a,orthorhombic,7.553192002884813,8.540816960889034,7.70713000333896,data/final/MP/cifs/La3Pd5Si1-MP-mp-571217.cif,data/source/MP/raw/cifs/mp-571217.cif,mp-571217,0.0,,2014-02-24 15:28:46,8.417956408780185,10.17188/1276146,"@misc{osti_1276146,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La3SiPd5 (SG:74) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1276146"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1673864'}},0.0,7.31523694,520.0,-108.53929765,-6.029960980555555,"{'tags': ['Lanthanum palladium silicide hydrogen (3/5/1/1) - beta', 'Lanthanum palladium silicide (3/5/1) - beta']}",-108.53929765,-6.029960980555555,-0.9041004933333328,"['xas', 'bandstructure']",True,"[260033, 260031]",True,2021-05-12 10:57:24.969000,NM,18,10,mp-571217,,La3SiPd5,"{'functional': 'PBE', 'labels': ['La', 'Si', 'Pd'], 'pot_type': 'paw'}","{'La': 3.0, 'Si': 1.0, 'Pd': 5.0}",GGA,mp-571217,"['mp-921625', 'mp-907071', 'mp-920641', 'mp-571217', 'mp-1133365', 'mp-1143704', 'mp-1423155', 'mp-1673864', 'mp-1843946', 'mp-1607540']",0.00228535,"{'La': 6.0, 'Si': 2.0, 'Pd': 10.0}",385.4103554395149,[],NM,False,74,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.1859307710576838e-05,0.00228535,0,0.0045707,MP,data/source/MP/cleaned/cifs/MP-mp-571217.cif,False,,data/final/MP/graphs/La3Pd5Si1-MP-mp-571217.json,0,True,mmm,0,0,0,7,0,0,0,0,0,1,0,1.0,False
Co4Ge13Yb3,1,0.0,2.0,False,Co8Ge26Yb6,Co8Ge26Yb6,0.0,Heavy_fermion,True,Co20Ge65Yb15,Co-Ge-Yb,3,Supercon,Yb3Co4Ge13,MP-mp-1203071,Yb6Co8Ge26,Co-Ge-Yb,Co20Ge65Yb15,P m -3 n,cubic,8.81574,8.81574,8.81574,data/final/MP/cifs/Co4Ge13Yb3-MP-mp-1203071.cif,data/source/MP/raw/cifs/mp-1203071.cif,mp-1203071,0.0,,2019-01-12 06:59:39.092000,8.236454731588116,,,,0.0,4.24093641,520.0,-201.28199366,-5.0320498415,"{'tags': ['Yb3Co4Ge13', 'Ytterbium cobalt germanide (3/4/13)', 'Y3Co4Ge13']}",-201.28199366,-5.0320498415,-0.3744769347499996,[],False,[623672],True,2021-05-12 11:00:12.709000,NM,40,3,mp-1203071,,Yb3Co4Ge13,"{'functional': 'PBE', 'labels': ['Yb_2', 'Co', 'Ge_d'], 'pot_type': 'paw'}","{'Yb': 3.0, 'Co': 4.0, 'Ge': 13.0}",GGA,mp-1203071,"['mp-1203071', 'mp-1375308', 'mp-1936779']",5.44e-05,"{'Yb': 6.0, 'Co': 8.0, 'Ge': 26.0}",685.1352612361871,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.588007597269079e-07,5.44e-05,0,0.0001088,MP,data/source/MP/cleaned/cifs/MP-mp-1203071.cif,False,,data/final/MP/graphs/Co4Ge13Yb3-MP-mp-1203071.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba1Pd0.2Si1.8,3,0.1333333333333333,4.0,False,Ba4Pd0.8Si7.2,Ba4Si8,2.91,Other,True,Ba33.333Pd6.667Si60,Ba-Pd-Si,3,Supercon,Ba1Pd0.2Si1.8,MP-mp-7275,Ba4Si8,Ba-Si,Ba33.333Si66.667,P 43 3 2,cubic,6.771439,6.771439,6.771439,data/final/MP/cifs/Ba1Pd0.2Si1.8-MP-mp-7275-synth_doped.cif,data/source/MP/raw/cifs/mp-7275.cif,mp-7275,0.0153999999999996,,2011-05-29 01:48:04,4.139450158250275,10.17188/1287630,"@misc{osti_1287630,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BaSi2 (SG:212) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1287630"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1670265'}},0.0134410304166667,5.20254346,520.0,-55.23987066,-4.603322555,{'tags': ['Barium silicide (1/2)']},-55.23987066,-4.603322555,-0.2994562650000005,"['bandstructure', 'elasticity']",True,"[2218, 602228]",True,2021-05-12 10:56:29.056000,NM,12,11,mp-7275,,BaSi2,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Si'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Si': 2.0}",GGA,mp-7275,"['mp-908584', 'mp-923646', 'mp-922864', 'mp-7275', 'mp-1125089', 'mp-1145782', 'mp-1255475', 'mp-1432707', 'mp-1670265', 'mp-1808748', 'mp-1599442']",0.0,"{'Ba': 4.0, 'Si': 8.0}",310.48663568862327,[],NM,False,212,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0,0.0,0,0.0,MP,data/source/MP/cleaned/cifs/MP-mp-7275.cif,True,,data/final/MP/graphs/Ba1Pd0.2Si1.8-MP-mp-7275-synth_doped.json,0,True,432,4,0,0,0,0,0,0,1,0,0,0,1.0,False
As2Ba0.812Fe2K0.188,3,0.0581333333333333,3.0,False,As6Ba2.436Fe6K0.564,As6Ba2Fe6K1,13.0,Ferrite,True,As40Ba16.24Fe40K3.76,As-Ba-Fe-K,4,Supercon,Ba0.812K0.188Fe2As2,MP-mp-1223567,K1Ba2Fe6As6,As-Ba-Fe-K,As40Ba13.333Fe40K6.667,C 1 2/m 1,monoclinic,5.48060788,7.102799640000001,8.784942288492543,data/final/MP/cifs/As2Ba0.812Fe2K0.188-MP-mp-1223567-synth_doped.cif,data/source/MP/raw/cifs/mp-1223567.cif,mp-1223567,0.0,,2019-01-12 23:56:38.667000,6.101417464045543,,,,0.0186882046666676,4.38014394,520.0,-90.51509253,-6.034339502,{'tags': []},-90.51509253,-6.034339502,-0.4527993862000007,[],False,[],True,2021-05-12 11:00:52.054000,FM,15,4,mp-1223567,,KBa2(FeAs)6,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 2.0, 'Fe': 6.0, 'As': 6.0}",GGA,mp-1223567,"['mp-1223567', 'mp-1374097', 'mp-1656306', 'mp-1808539']",1.3326448,"{'K': 1.0, 'Ba': 2.0, 'Fe': 6.0, 'As': 6.0}",298.92336486922324,[],FM,True,12,2,"[0.0, 0.0, 0.0, 0.3, 0.3, 0.1, 0.3, 0.1, 0.3, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0044581486649028,1.3326448,6,1.3326448,MP,data/source/MP/cleaned/cifs/MP-mp-1223567.cif,True,,data/final/MP/graphs/As2Ba0.812Fe2K0.188-MP-mp-1223567-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
Au0.28Te0.72,3,0.1066666666666666,3.0,False,Au0.84Te2.16,Au1Te2,1.96,Other,True,Au28Te72,Au-Te,2,Supercon,Au0.28Te0.72,MP-mp-567525,Te2Au1,Au-Te,Au33.333Te66.667,C 1 2/m 1,monoclinic,4.228509889999999,4.228509889999999,5.15701111,data/final/MP/cifs/Au0.28Te0.72-MP-mp-567525-synth_doped.cif,data/source/MP/raw/cifs/mp-567525.cif,mp-567525,0.0,,2014-02-16 11:21:24,9.349466095623004,10.17188/1272560,"@misc{osti_1272560,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Te2Au (SG:12) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1272560"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668681'}},0.0177770462499995,6.52239204,520.0,-9.77688527,-3.2589617566666664,"{'tags': ['Gold telluride (1/2)', 'Gold ditelluride', 'Calaverite, average structure', 'High pressure experimental phase', 'Calaverite']}",-9.77688527,-3.2589617566666664,-0.3534672899999993,"['xas', 'bandstructure']",True,"[64681, 64682, 72435, 659325, 151373, 72434, 72437, 66625, 66626, 612390, 65105, 659328, 65104, 659326, 72438, 72436, 659327, 72439]",True,2021-05-12 10:57:23.123000,NM,3,7,mp-567525,,Te2Au,"{'functional': 'PBE', 'labels': ['Te', 'Au'], 'pot_type': 'paw'}","{'Te': 2.0, 'Au': 1.0}",GGA,mp-567525,"['mp-567525', 'mp-1441005', 'mp-1668681', 'mp-1799624', 'mp-1934226', 'mp-1595493', 'mp-1592789']",0.0002727,"{'Te': 2.0, 'Au': 1.0}",80.30835608746618,[],NM,False,12,0,"[0, 0, 0]",3.3956615884777227e-06,0.0002727,0,0.0002727,MP,data/source/MP/cleaned/cifs/MP-mp-567525.cif,True,,data/final/MP/graphs/Au0.28Te0.72-MP-mp-567525-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
P2Pd2Sm1,1,0.0,1.0,True,P2Pd2Sm1,P2Pd2Sm1,0.0,Other,True,P40Pd40Sm20,P-Pd-Sm,3,Supercon,Sm1Pd2P2,MP-mp-1206125,Sm1P2Pd2,P-Pd-Sm,P40Pd40Sm20,I 4/m m m,tetragonal,4.138835998177842,4.138835998177842,5.78014467,data/final/MP/cifs/P2Pd2Sm1-MP-mp-1206125.cif,data/source/MP/raw/cifs/mp-1206125.cif,mp-1206125,0.0,,2019-01-12 09:29:57.797000,8.26821997158353,,,{'GGA': {'task_id': 'mp-1760175'}},0.0,6.76280058,520.0,-30.69428224,-6.138856448,"{'tags': ['SmPd2P2', 'CeAl2Ga2']}",-30.69428224,-6.138856448,-0.9578654943333332,['bandstructure'],True,[],True,2021-05-12 10:58:37.524000,NM,5,5,mp-1206125,,Sm(PPd)2,"{'functional': 'PBE', 'labels': ['Sm_3', 'P', 'Pd'], 'pot_type': 'paw'}","{'Sm': 1.0, 'P': 2.0, 'Pd': 2.0}",GGA,mp-1206125,"['mp-1206125', 'mp-1410295', 'mp-1760175', 'mp-1800338', 'mp-1584815']",0.0010208,"{'Sm': 1.0, 'P': 2.0, 'Pd': 2.0}",85.3840457917876,[],NM,False,139,0,"[0, 0, 0, 0, 0]",1.1955395068643872e-05,0.0010208,0,0.0010208,MP,data/source/MP/cleaned/cifs/MP-mp-1206125.cif,False,,data/final/MP/graphs/P2Pd2Sm1-MP-mp-1206125.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As1Co0.025Fe0.975Pr1O1,2,0.0125,2.0,False,As2Co0.05Fe1.95Pr2O2,As2Fe2Pr2O2,0.0,Ferrite,True,As25Co0.625Fe24.375Pr25O25,As-Co-Fe-Pr-O,5,Supercon,Pr1Fe0.975Co0.025As1O1,MP-mp-22491,Pr2Fe2As2O2,As-Fe-Pr-O,As25Fe25Pr25O25,P 4/n m m,tetragonal,4.094889,4.094889,9.258722,data/final/MP/cifs/As1Co0.025Fe0.975Pr1O1-MP-mp-22491-synth_doped.cif,data/source/MP/raw/cifs/mp-22491.cif,mp-22491,0.0,,2014-02-25 19:17:30,6.153806906111091,,,{'GGA+U': {'task_id': 'mp-1695715'}},0.3808778432291664,4.12348168,520.0,-51.7633941,-6.4704242625,{'tags': ['Praseodymium iron arsenic oxide (1/1/1/1)']},-51.7633941,-6.4704242625,-1.491677511249999,"['xas', 'bandstructure']",True,"[162830, 162833, 246832, 90316, 422000, 236649, 236648, 602491]",True,2021-05-12 10:57:10.838000,FM,8,8,mp-22491,oxide,PrFeAsO,"{'functional': 'PBE', 'labels': ['Pr_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Pr': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-22491,"['mp-510622', 'mp-1079608', 'mp-1079857', 'mp-22491', 'mp-1476145', 'mp-1695715', 'mp-1778524', 'mp-1596397']",3.7947681,"{'Pr': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",155.25132378854377,[],FM,True,129,1,"[0.0, 0.0, 3.5, 3.5, 0.0, 0.0, 0.0, 0.0]",0.0488854846116297,3.7947681,2,7.5895362,MP,data/source/MP/cleaned/cifs/MP-mp-22491.cif,True,,data/final/MP/graphs/As1Co0.025Fe0.975Pr1O1-MP-mp-22491-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
P1Pb1,1,0.0,4.0,False,P4Pb4,P4Pb4,7.8,Other,True,P50Pb50,P-Pb,2,Supercon,P1Pb1,MP-mp-1179841,P8Pb8,P-Pb,P50Pb50,C 1 2/c 1,monoclinic,4.194457225592902,4.194457225592902,11.759316943779815,data/final/MP/cifs/P1Pb1-MP-mp-1179841.cif,data/source/MP/raw/cifs/mp-1179841.cif,mp-1179841,0.0,,2019-01-11 09:12:29.813000,7.6719002771733615,,,{'GGA': {'task_id': 'mp-1671451'}},0.1435095300000002,6.46408199,520.0,-70.7468428,-4.421677675,"{'tags': ['Pb2[P2O7] ht', 'Dilead diphosphate(V) - HT', '*']}",-70.7468428,-4.421677675,0.1412971133333336,['bandstructure'],True,[40162],True,2021-05-12 10:58:25.879000,NM,16,6,mp-1179841,,PPb,"{'functional': 'PBE', 'labels': ['P', 'Pb_d'], 'pot_type': 'paw'}","{'P': 1.0, 'Pb': 1.0}",GGA,mp-1179841,"['mp-1179841', 'mp-1189545', 'mp-1425538', 'mp-1671451', 'mp-1817713', 'mp-1600253']",0.0001318,"{'P': 8.0, 'Pb': 8.0}",412.4108209454542,[],NM,False,15,0,"[0, 0, 0, 0, 0, 0, 0, 0]",2.556673943672918e-06,0.0001318,0,0.0010544,MP,data/source/MP/cleaned/cifs/MP-mp-1179841.cif,False,,data/final/MP/graphs/P1Pb1-MP-mp-1179841.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
Mo30Re70,3,0.1,0.0666690476190476,False,Mo2Re4.667,Mo2Re6,7.62,Other,True,Mo30Re70,Mo-Re,2,Supercon,Mo30Re70,MP-mp-974589,Re6Mo2,Mo-Re,Mo25Re75,P 63/m m c,hexagonal,4.549566,5.589982002473007,5.589981640000001,data/final/MP/cifs/Mo30Re70-MP-mp-974589-synth_doped.cif,data/source/MP/raw/cifs/mp-974589.cif,mp-974589,0.0,,2015-09-17 00:40:39,17.65663080297061,10.17188/1314573,"@misc{osti_1314573,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Re3Mo (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1314573"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1752979'}},0.1333847256249978,7.30876759,520.0,-95.39162484,-11.923953105,{'tags': []},-95.39162484,-11.923953105,0.1208530412499993,"['xas', 'bandstructure']",True,[],True,2021-05-12 10:57:55.580000,NM,8,8,mp-974589,,Re3Mo,"{'functional': 'PBE', 'labels': ['Re_pv', 'Mo_pv'], 'pot_type': 'paw'}","{'Re': 3.0, 'Mo': 1.0}",GGA,mp-974589,"['mp-974701', 'mp-974589', 'mp-974659', 'mp-1411460', 'mp-1752979', 'mp-1805092', 'mp-974741', 'mp-1618655']",0.00043195,"{'Re': 6.0, 'Mo': 2.0}",123.11795201493304,[],NM,False,187,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, 0.0]",7.016848362578489e-06,0.00043195,0,0.0008639,MP,data/source/MP/cleaned/cifs/MP-mp-974589.cif,True,,data/final/MP/graphs/Mo30Re70-MP-mp-974589-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
As1F0.075Fe1Sm1O0.925,2,0.0374999999999999,2.0,False,As2F0.15Fe2Sm2O1.85,As2Fe2Sm2O2,33.0,Ferrite,True,As25F1.875Fe25Sm25O23.125,As-F-Fe-Sm-O,5,Supercon,Sm1Fe1As1F0.075O0.925,MP-mp-20349,Sm2Fe2As2O2,As-Fe-Sm-O,As25Fe25Sm25O25,P 4/n m m,tetragonal,4.026492,4.026492,9.046755,data/final/MP/cifs/As1F0.075Fe1Sm1O0.925-MP-mp-20349-synth_doped.cif,data/source/MP/raw/cifs/mp-20349.cif,mp-20349,0.0,,2014-02-19 11:24:42,6.727802583283198,,,{'GGA+U': {'task_id': 'mp-1695938'}},0.3015723809374986,3.77685593,520.0,-52.73407138,-6.5917589225,{'tags': ['Samarium iron arsenic oxide (1/1/1/1)']},-52.73407138,-6.5917589225,-1.6285904237499995,"['xas', 'elasticity', 'bandstructure']",True,"[236652, 236653, 422002, 163457, 163458]",True,2021-05-12 10:56:16.728000,FM,8,10,mp-20349,oxide,SmFeAsO,"{'functional': 'PBE', 'labels': ['Sm_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Sm': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-20349,"['mp-24944', 'mp-1078897', 'mp-1079866', 'mp-1173321', 'mp-20349', 'mp-1425472', 'mp-1695938', 'mp-1772503', 'mp-1789694', 'mp-1588381']",3.75729895,"{'Sm': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",146.67176231613362,[],FM,True,129,1,"[0.0, 0.0, 3.5, 3.5, -0.0, -0.0, -0.0, -0.0]",0.0512341147425717,3.75729895,2,7.5145979,MP,data/source/MP/cleaned/cifs/MP-mp-20349.cif,True,,data/final/MP/graphs/As1F0.075Fe1Sm1O0.925-MP-mp-20349-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Br2Ca1.85Cu1Na0.15O2,2,0.0428571428571428,1.0,True,Br2Ca1.85Cu1Na0.15O2,Br2Ca2Cu1O2,10.0,Cuprate,True,Br28.571Ca26.429Cu14.286Na2.143O28.571428571428573,Br-Ca-Cu-Na-O,5,Supercon,Ca1.85Na0.15Cu1Br2O2,MP-mp-545481,Ca2Cu1Br2O2,Br-Ca-Cu-O,Br28.571Ca28.571Cu14.286O28.571428571428573,I 4/m m m,tetragonal,3.8848960001664095,3.8848960001664095,9.26575389,data/final/MP/cifs/Br2Ca1.85Cu1Na0.15O2-MP-mp-545481-synth_doped.cif,data/source/MP/raw/cifs/mp-545481.cif,mp-545481,0.0,,2014-02-21 09:12:30,4.171489837215984,10.17188/1267001,"@misc{osti_1267001,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ca2Cu(BrO)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1267001"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687817'}},0.0,3.0811802,520.0,-34.65890385,-4.9512719785714285,{'tags': ['Dicalcium dibromodioxocuprate']},-34.65890385,-4.9512719785714285,-2.260101375,"['xas', 'elasticity', 'bandstructure']",True,[1028],True,2021-05-12 10:56:22.739000,NM,7,8,mp-545481,oxide,Ca2Cu(BrO)2,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Cu_pv', 'Br', 'O'], 'pot_type': 'paw'}","{'Ca': 2.0, 'Cu': 1.0, 'Br': 2.0, 'O': 2.0}",GGA,mp-545481,"['mp-1000746', 'mp-1007202', 'mp-545481', 'mp-1301034', 'mp-1687817', 'mp-1779505', 'mp-1011944', 'mp-1590430']",0.0093361,"{'Ca': 2.0, 'Cu': 1.0, 'Br': 2.0, 'O': 2.0}",133.55551405583833,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",6.990426464980444e-05,0.0093361,0,0.0093361,MP,data/source/MP/cleaned/cifs/MP-mp-545481.cif,True,,data/final/MP/graphs/Br2Ca1.85Cu1Na0.15O2-MP-mp-545481-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Bi2La4Pb1,1,0.0,2.0,False,Bi4La8Pb2,Bi4La8Pb2,2.3,Other,True,Bi28.571La57.143Pb14.286,Bi-La-Pb,3,Supercon,Bi2La4Pb1,MP-mp-1223111,La8Bi4Pb2,Bi-La-Pb,Bi28.571La57.143Pb14.286,I -4 2 d,tetragonal,8.572186069438922,8.57218607,8.57218607,data/final/MP/cifs/Bi2La4Pb1-MP-mp-1223111.cif,data/source/MP/raw/cifs/mp-1223111.cif,mp-1223111,0.0,,2019-01-12 23:33:05.009000,8.087221036779887,,,,0.0059584495238116,7.48018182,520.0,-73.94113463,-5.281509616428571,{'tags': []},-73.94113463,-5.281509616428571,-0.8191176007142852,[],False,[],True,2021-05-12 11:00:52.054000,NM,14,3,mp-1223111,,La4Bi2Pb,"{'functional': 'PBE', 'labels': ['La', 'Bi', 'Pb_d'], 'pot_type': 'paw'}","{'La': 4.0, 'Bi': 2.0, 'Pb': 1.0}",GGA,mp-1223111,"['mp-1223111', 'mp-1376379', 'mp-1824213']",0.6075135,"{'La': 8.0, 'Bi': 4.0, 'Pb': 2.0}",484.89728681518966,[],NM,False,122,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0025057409745068,0.6075135,0,1.215027,MP,data/source/MP/cleaned/cifs/MP-mp-1223111.cif,False,,data/final/MP/graphs/Bi2La4Pb1-MP-mp-1223111.json,0,True,-42m,0,0,0,0,6,0,0,0,0,1,0,1.0,False
As1Co0.1Fe0.9Sm1O1,2,0.0499999999999999,2.0,False,As2Co0.2Fe1.8Sm2O2,As2Fe2Sm2O2,15.96666667,Ferrite,True,As25Co2.5Fe22.5Sm25O25,As-Co-Fe-Sm-O,5,Supercon,Sm1Fe0.9Co0.1As1O1,MP-mp-20349,Sm2Fe2As2O2,As-Fe-Sm-O,As25Fe25Sm25O25,P 4/n m m,tetragonal,4.026492,4.026492,9.046755,data/final/MP/cifs/As1Co0.1Fe0.9Sm1O1-MP-mp-20349-synth_doped.cif,data/source/MP/raw/cifs/mp-20349.cif,mp-20349,0.0,,2014-02-19 11:24:42,6.727802583283198,,,{'GGA+U': {'task_id': 'mp-1695938'}},0.3015723809374986,3.77685593,520.0,-52.73407138,-6.5917589225,{'tags': ['Samarium iron arsenic oxide (1/1/1/1)']},-52.73407138,-6.5917589225,-1.6285904237499995,"['xas', 'elasticity', 'bandstructure']",True,"[236652, 236653, 422002, 163457, 163458]",True,2021-05-12 10:56:16.728000,FM,8,10,mp-20349,oxide,SmFeAsO,"{'functional': 'PBE', 'labels': ['Sm_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Sm': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-20349,"['mp-24944', 'mp-1078897', 'mp-1079866', 'mp-1173321', 'mp-20349', 'mp-1425472', 'mp-1695938', 'mp-1772503', 'mp-1789694', 'mp-1588381']",3.75729895,"{'Sm': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",146.67176231613362,[],FM,True,129,1,"[0.0, 0.0, 3.5, 3.5, -0.0, -0.0, -0.0, -0.0]",0.0512341147425717,3.75729895,2,7.5145979,MP,data/source/MP/cleaned/cifs/MP-mp-20349.cif,True,,data/final/MP/graphs/As1Co0.1Fe0.9Sm1O1-MP-mp-20349-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ca1Se1,1,0.0,1.0,True,Ca1Se1,Ca1Se1,0.0,Other,True,Ca50Se50,Ca-Se,2,Supercon,Ca1Se1,MP-mp-1415,Ca1Se1,Ca-Se,Ca50Se50,F m -3 m,cubic,4.21765012,4.21765012,4.21765012,data/final/MP/cifs/Ca1Se1-MP-mp-1415.cif,data/source/MP/raw/cifs/mp-1415.cif,mp-1415,2.1362,,2011-05-12 17:45:29,3.725958973280908,10.17188/1190187,"@misc{osti_1190187,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CaSe (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1190187"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668576'}},0.0,2.28957398,520.0,-9.54614691,-4.773073455,{'tags': ['Calcium selenide']},-9.54614691,-4.773073455,-2.2583177761718742,"['xas', 'bandstructure', 'diel', 'phonons', 'elasticity']",True,"[619572, 186789, 619571, 187695, 52788, 619570, 60201, 53948, 41957]",True,2021-05-12 10:56:12.755000,NM,2,18,mp-1415,,CaSe,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Se'], 'pot_type': 'paw'}","{'Ca': 1.0, 'Se': 1.0}",GGA,mp-1415,"['mp-655239', 'mp-655248', 'mp-655243', 'mp-1415', 'mp-1057702', 'mp-1057721', 'mp-1057727', 'mp-1057984', 'mp-1057976', 'mp-1057995', 'mp-1140792', 'mp-1440761', 'mp-1668576', 'mp-1791967', 'mp-1591130', 'mp-1591430', 'mp-1057996', 'mp-1057728']",0.0008723,"{'Ca': 1.0, 'Se': 1.0}",53.05137572029519,[],NM,False,225,0,"[0, 0]",1.6442551925496916e-05,0.0008723,0,0.0008723,MP,data/source/MP/cleaned/cifs/MP-mp-1415.cif,False,,data/final/MP/graphs/Ca1Se1-MP-mp-1415.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Bi2Ca1Cu2Sr2O8.255,2,0.0156014421501147,1.9380438522107808,False,Bi3.876Ca1.938Cu3.876Sr3.876O16,Bi4Ca2Cu4Sr4O16,0.0,Cuprate,True,Bi13.11Ca6.555Cu13.11Sr13.11O54.113405440839074,Bi-Ca-Cu-Sr-O,5,Supercon,Bi2Sr2Ca1Cu2O8.255,MP-mp-1218930,Sr4Ca2Cu4Bi4O16,Bi-Ca-Cu-Sr-O,Bi13.333Ca6.667Cu13.333Sr13.333O53.333333333333336,C c c 2,orthorhombic,5.417115,5.472898000129128,16.11398919,data/final/MP/cifs/Bi2Ca1Cu2Sr2O8.255-MP-mp-1218930-synth_doped.cif,data/source/MP/raw/cifs/mp-1218930.cif,mp-1218930,0.0,,2019-01-12 20:01:06.544000,6.266668983881059,,,,0.039252223722225,4.51768334,520.0,-173.15021002,-5.771673667333333,{'tags': []},-173.15021002,-5.771673667333333,-2.074956548222222,[],False,[],True,2021-05-12 11:00:42.526000,NM,30,3,mp-1218930,oxide,Sr2CaCu2(BiO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",GGA,mp-1218930,"['mp-1218930', 'mp-1359698', 'mp-1817714']",0.00011165,"{'Sr': 4.0, 'Ca': 2.0, 'Cu': 4.0, 'Bi': 4.0, 'O': 16.0}",470.7976286073367,[],NM,False,37,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.743014544498498e-07,0.00011165,0,0.0002233,MP,data/source/MP/cleaned/cifs/MP-mp-1218930.cif,True,,data/final/MP/graphs/Bi2Ca1Cu2Sr2O8.255-MP-mp-1218930-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
B1.87C0.13Mg1,3,0.0866666666666666,1.0,True,B1.87C0.13Mg1,B2Mg1,28.0,Other,True,B62.333C4.333Mg33.333,B-C-Mg,3,Supercon,Mg1B1.87C0.13,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B1.87C0.13Mg1-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B1.87C0.13Mg1-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ba4Pb3O10,1,0.0,1.0,True,Ba4Pb3O10,Ba4Pb3O10,0.0,Oxide,True,Ba23.529Pb17.647O58.82352941176471,Ba-Pb-O,3,Supercon,Ba4Pb3O10,MP-mp-752906,Ba4Pb3O10,Ba-Pb-O,Ba23.529Pb17.647O58.82352941176471,P 1,triclinic,4.382551079999999,4.383057000000001,15.6889008,data/final/MP/cifs/Ba4Pb3O10-MP-mp-752906.cif,data/source/MP/raw/cifs/mp-752906.cif,mp-752906,0.0,,2014-02-14 18:42:27,7.477809732695221,10.17188/1288843,"@misc{osti_1288843,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba4Pb3O10 (SG:1) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1288843"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-890049'}},0.0148559323529484,2.75636684,520.0,-98.84268073,-5.814275337058824,{'tags': []},-98.84268073,-5.814275337058824,-2.2011321264705885,['bandstructure'],True,[],True,2021-05-12 10:58:55.498000,NM,17,6,mp-752906,oxide,Ba4Pb3O10,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Pb_d', 'O'], 'pot_type': 'paw'}","{'Ba': 4.0, 'Pb': 3.0, 'O': 10.0}",GGA,mp-752906,"['mp-752906', 'mp-879193', 'mp-890049', 'mp-1371123', 'mp-1813924', 'mp-893810']",0.0014491,"{'Ba': 4.0, 'Pb': 3.0, 'O': 10.0}",295.543059240091,[],NM,False,1,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.903177234904344e-06,0.0014491,0,0.0014491,MP,data/source/MP/cleaned/cifs/MP-mp-752906.cif,False,,data/final/MP/graphs/Ba4Pb3O10-MP-mp-752906.json,0,True,1,0,0,0,0,0,1,0,1,0,0,0,1.0,False
Pb2S1Te1,1,0.0,1.0,True,Pb2S1Te1,Pb2S1Te1,6.03,Other,True,Pb50S25Te25,Pb-S-Te,3,Supercon,Pb1Te1Pb1S1,MP-mp-1217283,Te1Pb2S1,Pb-S-Te,Pb50S25Te25,R -3 m,trigonal,4.443952295029174,4.443952295029174,7.69993071,data/final/MP/cifs/Pb2S1Te1-MP-mp-1217283.cif,data/source/MP/raw/cifs/mp-1217283.cif,mp-1217283,0.0,,2019-01-12 18:38:46.884000,7.6773376494216174,,,{'GGA': {'task_id': 'mp-1759517'}},0.022539062499999,5.22064128,520.0,-16.49242847,-4.1231071175,{'tags': []},-16.49242847,-4.1231071175,-0.6780958832812498,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,4,5,mp-1217283,,TePb2S,"{'functional': 'PBE', 'labels': ['Te', 'Pb_d', 'S'], 'pot_type': 'paw'}","{'Te': 1.0, 'Pb': 2.0, 'S': 1.0}",GGA,mp-1217283,"['mp-1217283', 'mp-1396692', 'mp-1759517', 'mp-1803651', 'mp-1628100']",0.0014846,"{'Te': 1.0, 'Pb': 2.0, 'S': 1.0}",124.16509508860064,[],NM,False,166,0,"[0, 0, 0, 0]",1.1956661402631972e-05,0.0014846,0,0.0014846,MP,data/source/MP/cleaned/cifs/MP-mp-1217283.cif,False,,data/final/MP/graphs/Pb2S1Te1-MP-mp-1217283.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
B2V3,1,0.0,2.0,False,B4V6,B4V6,0.0,Other,True,B40V60,B-V,2,Supercon,B2V3,MP-mp-2091,V6B4,B-V,B40V60,P 4/m b m,tetragonal,3.017843,5.730474,5.730474,data/final/MP/cifs/B2V3-MP-mp-2091.cif,data/source/MP/raw/cifs/mp-2091.cif,mp-2091,0.0,,2011-05-13 21:22:51,5.846064712021974,10.17188/1196105,"@misc{osti_1196105,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3B2 (SG:127) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196105"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702148'}},0.0,6.90923861,520.0,-88.44793895,-8.844793894999999,{'tags': ['Vanadium boride (3/2)']},-88.44793895,-8.844793894999999,-0.7226935446666658,"['xas', 'elasticity', 'bandstructure']",True,"[615662, 107318, 88317, 88321]",True,2021-05-12 10:56:14.760000,NM,10,8,mp-2091,,V3B2,"{'functional': 'PBE', 'labels': ['V_pv', 'B'], 'pot_type': 'paw'}","{'V': 3.0, 'B': 2.0}",GGA,mp-2091,"['mp-921427', 'mp-920414', 'mp-906784', 'mp-2091', 'mp-1426677', 'mp-1702148', 'mp-1796458', 'mp-1596660']",0.00360755,"{'V': 6.0, 'B': 4.0}",99.1009311566266,[],NM,False,127,0,"[-0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",7.280557221603407e-05,0.00360755,0,0.0072151,MP,data/source/MP/cleaned/cifs/MP-mp-2091.cif,False,,data/final/MP/graphs/B2V3-MP-mp-2091.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Cd1Mo6Se8,1,0.0,1.0,True,Cd1Mo6Se8,Cd1Mo6Se8,2.4,Chevrel,True,Cd6.667Mo40Se53.333,Cd-Mo-Se,3,Supercon,Cd1Mo6Se8,MP-mp-1103966,Cd1Mo6Se8,Cd-Mo-Se,Cd6.667Mo40Se53.333,R -3,trigonal,6.83078904,6.83078904,6.83078917,data/final/MP/cifs/Cd1Mo6Se8-MP-mp-1103966.cif,data/source/MP/raw/cifs/mp-1103966.cif,mp-1103966,0.0,,2018-07-18 20:42:03,6.883085026707372,,,{'GGA': {'task_id': 'mp-1673939'}},0.0669013593333351,4.66242597,520.0,-101.2668197,-6.751121313333333,{'tags': ['Cadmium molybdenum selenide (1/6/8)']},-101.2668197,-6.751121313333333,-0.7385853292499992,['bandstructure'],True,"[620172, 620174]",True,2021-05-12 10:58:20.361000,NM,15,6,mp-1103966,,Cd(Mo3Se4)2,"{'functional': 'PBE', 'labels': ['Cd', 'Mo_pv', 'Se'], 'pot_type': 'paw'}","{'Cd': 1.0, 'Mo': 6.0, 'Se': 8.0}",GGA,mp-1103966,"['mp-1103966', 'mp-1103991', 'mp-1432715', 'mp-1673939', 'mp-1809681', 'mp-1599080']",0.0051499,"{'Cd': 1.0, 'Mo': 6.0, 'Se': 8.0}",318.3841074750466,[],NM,False,148,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.617511640527982e-05,0.0051499,0,0.0051499,MP,data/source/MP/cleaned/cifs/MP-mp-1103966.cif,False,,data/final/MP/graphs/Cd1Mo6Se8-MP-mp-1103966.json,0,True,-3,0,0,0,0,0,0,2,1,0,0,0,1.0,False
Bi3Sr1,1,0.0,1.0,True,Bi3Sr1,Bi3Sr1,5.7,Other,True,Bi75Sr25,Bi-Sr,2,Supercon,Bi3Sr1,MP-mp-23159,Sr1Bi3,Bi-Sr,Bi75Sr25,P m -3 m,cubic,5.076826,5.076826,5.076826,data/final/MP/cifs/Bi3Sr1-MP-mp-23159.cif,data/source/MP/raw/cifs/mp-23159.cif,mp-23159,0.0,,2014-02-21 06:02:52,9.068003757945096,10.17188/1199279,"@misc{osti_1199279,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SrBi3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199279"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703625'}},0.0023887965624997,5.39549679,520.0,-15.11135933,-3.7778398325,{'tags': ['Bismuth strontium (3/1)']},-15.11135933,-3.7778398325,-0.437940736666667,"['xas', 'elasticity', 'bandstructure']",True,"[58858, 617156]",True,2021-05-12 10:56:16.728000,NM,4,8,mp-23159,,SrBi3,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Bi'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Bi': 3.0}",GGA,mp-23159,"['mp-991398', 'mp-993338', 'mp-23159', 'mp-1441895', 'mp-1703625', 'mp-1786092', 'mp-994645', 'mp-1591925']",0.0052381,"{'Sr': 1.0, 'Bi': 3.0}",130.85093695919045,[],NM,False,221,0,"[0, 0, 0, 0]",4.003104694339063e-05,0.0052381,0,0.0052381,MP,data/source/MP/cleaned/cifs/MP-mp-23159.cif,False,,data/final/MP/graphs/Bi3Sr1-MP-mp-23159.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Cu3Pr0.13Y0.87O7,2,0.02,1.0,True,Ba2Cu3Pr0.13Y0.87O7,Ba2Cu3Y1O7,78.35,Cuprate,True,Ba15.385Cu23.077Pr1Y6.692O53.84615384615385,Ba-Cu-Pr-Y-O,5,Supercon,Y0.87Pr0.13Ba2Cu3O7,MP-mp-20674,Ba2Y1Cu3O7,Ba-Cu-Y-O,Ba15.385Cu23.077Y7.692O53.84615384615385,P m m m,orthorhombic,3.844668,3.926152,11.823664,data/final/MP/cifs/Ba2Cu3Pr0.13Y0.87O7-MP-mp-20674-synth_doped.cif,data/source/MP/raw/cifs/mp-20674.cif,mp-20674,0.0,,2014-02-22 18:23:22,6.198285186087997,10.17188/1195834,"@misc{osti_1195834,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2YCu3O7 (SG:47) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195834"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686609'}},0.0313759126602519,3.28295453,520.0,-80.7708035,-6.213138730769231,"{'tags': ['Yttrium barium copper oxide (1/2/3/7)', 'Dibarium yttrium dicopper copper(III) oxide', 'Yttrium barium copper oxide (1/2/3/6.93)', 'Dibarium yttrium copper(III) dicopper oxide', 'High pressure experimental phase', 'Yttrium dibarium dicopper copper(III) oxide']}",-80.7708035,-6.213138730769231,-2.180157206282052,"['xas', 'elasticity', 'bandstructure']",True,"[196266, 196264, 196265, 71423, 66620, 63483, 66621, 164530, 56507, 63487, 66602, 66601, 68394, 63486, 63485, 202774, 62466, 62465, 41646, 65224, 202773, 66600, 63335, 66611, 78598, 66617, 81175, 66610, 66619, 66615, 63484, 86958, 262809, 66609, 184677, 202775, 66616, 63488, 66618, 66623, 202771, 66622, 202772, 77737, 202770, 62928, 77745]",True,2021-05-12 10:56:14.760000,NM,13,14,mp-20674,oxide,Ba2YCu3O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Cu': 3.0, 'O': 7.0}",GGA,mp-20674,"['mp-923155', 'mp-917354', 'mp-922372', 'mp-20674', 'mp-1103385', 'mp-1103741', 'mp-1103748', 'mp-1104329', 'mp-1104589', 'mp-1440689', 'mp-1686609', 'mp-1832558', 'mp-1596594', 'mp-1592890']",0.0001806,"{'Ba': 2.0, 'Y': 1.0, 'Cu': 3.0, 'O': 7.0}",178.47526348558395,[],NM,False,47,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.0119049355799813e-06,0.0001806,0,0.0001806,MP,data/source/MP/cleaned/cifs/MP-mp-20674.cif,True,,data/final/MP/graphs/Ba2Cu3Pr0.13Y0.87O7-MP-mp-20674-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ga1Nb0.186V2.814,3,0.0929999999999999,2.0,False,Ga2Nb0.372V5.628,Ga2V6,13.5,Other,True,Ga25Nb4.65V70.35,Ga-Nb-V,3,Supercon,V2.814Nb0.186Ga1,MP-mp-22568,V6Ga2,Ga-V,Ga25V75,P m -3 n,cubic,4.789645,4.789645,4.789645,data/final/MP/cifs/Ga1Nb0.186V2.814-MP-mp-22568-synth_doped.cif,data/source/MP/raw/cifs/mp-22568.cif,mp-22568,0.0,,2014-02-22 11:36:40,6.726541666276222,10.17188/1198793,"@misc{osti_1198793,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Ga (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198793"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686867'}},0.0,5.67452231,520.0,-61.95244347,-7.74405543375,{'tags': ['Gallium vanadium (1/3)']},-61.95244347,-7.74405543375,-0.1741018756249994,"['xas', 'elasticity', 'bandstructure']",True,"[635643, 635628, 635619, 635634, 104021, 635646, 635604, 635610, 635617, 635624, 635626, 635605, 635631, 635625, 635636, 635603, 104020, 635616, 635607]",True,2021-05-12 10:56:16.728000,FM,8,9,mp-22568,,V3Ga,"{'functional': 'PBE', 'labels': ['V_pv', 'Ga_d'], 'pot_type': 'paw'}","{'V': 3.0, 'Ga': 1.0}",GGA,mp-22568,"['mp-941343', 'mp-941663', 'mp-934924', 'mp-22568', 'mp-1440749', 'mp-1686867', 'mp-1804076', 'mp-1593784', 'mp-1595713']",0.09063635,"{'V': 6.0, 'Ga': 2.0}",109.87780534443452,[],FM,True,131,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.0, -0.0, -0.0]",0.0016497662965852,0.09063635,2,0.1812727,MP,data/source/MP/cleaned/cifs/MP-mp-22568.cif,True,,data/final/MP/graphs/Ga1Nb0.186V2.814-MP-mp-22568-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ce1Co0.2In5Rh0.8,3,0.0571428571428571,1.0,True,Ce1Co0.2In5Rh0.8,Ce1In5Rh1,0.0,Heavy_fermion,True,Ce14.286Co2.857In71.429Rh11.429,Ce-Co-In-Rh,4,Supercon,Ce1Rh0.8Co0.2In5,MP-mp-20294,Ce1In5Rh1,Ce-In-Rh,Ce14.286In71.429Rh14.286,P 4/m m m,tetragonal,4.709358,4.709358,7.592679,data/final/MP/cifs/Ce1Co0.2In5Rh0.8-MP-mp-20294-synth_doped.cif,data/source/MP/raw/cifs/mp-20294.cif,mp-20294,0.0,,2015-11-23 15:12:00,8.05771622389016,10.17188/1195421,"@misc{osti_1195421,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeIn5Rh (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195421"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701496'}},0.0,7.74909127,520.0,-30.04466451,-4.29209493,"{'tags': ['High pressure experimental phase', 'Cerium rhodium indium (1/1/5) - HP', 'Cerium rhodium indide (1/1/5)']}",-30.04466451,-4.29209493,-0.4269784049999998,"['xas', 'bandstructure']",True,"[150226, 110780, 110777, 110779, 110778]",True,2021-05-12 10:56:57.051000,FM,7,8,mp-20294,,CeIn5Rh,"{'functional': 'PBE', 'labels': ['Ce', 'In_d', 'Rh_pv'], 'pot_type': 'paw'}","{'Ce': 1.0, 'In': 5.0, 'Rh': 1.0}",GGA,mp-20294,"['mp-986842', 'mp-988024', 'mp-1430916', 'mp-1701496', 'mp-1780117', 'mp-988278', 'mp-1588425', 'mp-20294']",0.0607598,"{'Ce': 1.0, 'In': 5.0, 'Rh': 1.0}",168.39083554410138,[],FM,True,123,1,"[0.1, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0003608260497293,0.0607598,1,0.0607598,MP,data/source/MP/cleaned/cifs/MP-mp-20294.cif,True,,data/final/MP/graphs/Ce1Co0.2In5Rh0.8-MP-mp-20294-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B2Fe0.012Mg0.988,2,0.008,1.0,True,B2Fe0.012Mg0.988,B2Mg1,33.45,Other,True,B66.667Fe0.4Mg32.933,B-Fe-Mg,3,Supercon,Mg0.988Fe0.012B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B2Fe0.012Mg0.988-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B2Fe0.012Mg0.988-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ge2La1,1,0.0,2.0,False,Ge4La2,Ge4La2,1.976666667,Other,True,Ge66.667La33.333,Ge-La,2,Supercon,Ge2La1,MP-mp-19761,La2Ge4,Ge-La,Ge66.667La33.333,I 41/a m d,tetragonal,4.320984000934922,4.320984000934921,8.41484573,data/final/MP/cifs/Ge2La1-MP-mp-19761.cif,data/source/MP/raw/cifs/mp-19761.cif,mp-19761,0.0,,2014-02-21 13:34:05,6.447172399329149,10.17188/1194966,"@misc{osti_1194966,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaGe2 (SG:141) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1194966"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703381'}},0.0059020154166642,6.2456377,520.0,-32.49839164,-5.416398606666667,"{'tags': ['Lanthanum germanide (1/2)', 'Germanium lanthanum (2/1)']}",-32.49839164,-5.416398606666667,-0.6890443350000002,"['xas', 'elasticity', 'bandstructure']",True,"[636796, 636784, 57072]",True,2021-05-12 10:56:14.760000,NM,6,6,mp-19761,,LaGe2,"{'functional': 'PBE', 'labels': ['La', 'Ge_d'], 'pot_type': 'paw'}","{'La': 1.0, 'Ge': 2.0}",GGA,mp-19761,"['mp-19761', 'mp-20013', 'mp-1438339', 'mp-1703381', 'mp-1780058', 'mp-1596448']",0.0002277,"{'La': 2.0, 'Ge': 4.0}",146.3900903733194,[],NM,False,141,0,"[0, 0, 0, 0, 0, 0]",3.110866308222457e-06,0.0002277,0,0.0004554,MP,data/source/MP/cleaned/cifs/MP-mp-19761.cif,False,,data/final/MP/graphs/Ge2La1-MP-mp-19761.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
C1Fe0.2Mg1Ni2.8,3,0.08,1.0,True,C1Fe0.2Mg1Ni2.8,C1Mg1Ni3,8.0,Other,True,C20Fe4Mg20Ni56,C-Fe-Mg-Ni,4,Supercon,Mg1C1Ni2.8Fe0.2,MP-mp-10700,Mg1Ni3C1,C-Mg-Ni,C20Mg20Ni60,P m -3 m,cubic,3.810209,3.810209,3.810209,data/final/MP/cifs/C1Fe0.2Mg1Ni2.8-MP-mp-10700-synth_doped.cif,data/source/MP/raw/cifs/mp-10700.cif,mp-10700,0.0,,2011-05-28 10:04:44,6.376007671789427,10.17188/1187303,"@misc{osti_1187303,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MgNi3C (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187303"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678621'}},0.0,6.64260176,520.0,-28.85099542,-5.770199084,{'tags': ['Magnesium nickel carbide (1/3/1)']},-28.85099542,-5.770199084,-0.1367049259999994,"['xas', 'elasticity', 'bandstructure']",True,[77152],True,2021-05-12 10:56:10.715000,NM,5,8,mp-10700,,MgNi3C,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Ni_pv', 'C'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",GGA,mp-10700,"['mp-927245', 'mp-927653', 'mp-911184', 'mp-10700', 'mp-1438083', 'mp-1678621', 'mp-1791467', 'mp-1591421']",0.0387875,"{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",55.31544309398296,[],NM,False,221,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",0.0007012056277683,0.0387875,0,0.0387875,MP,data/source/MP/cleaned/cifs/MP-mp-10700.cif,True,,data/final/MP/graphs/C1Fe0.2Mg1Ni2.8-MP-mp-10700-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ce1Pt0.1Ru1.9,3,0.0666666666666667,2.0,False,Ce2Pt0.2Ru3.8,Ce2Ru4,4.08,Heavy_fermion,True,Ce33.333Pt3.333Ru63.333,Ce-Pt-Ru,3,Supercon,Ce1Pt0.1Ru1.9,MP-mp-607,Ce2Ru4,Ce-Ru,Ce33.333Ru66.667,F d -3 m,cubic,5.35903077,5.35903077,5.35903077,data/final/MP/cifs/Ce1Pt0.1Ru1.9-MP-mp-607-synth_doped.cif,data/source/MP/raw/cifs/mp-607.cif,mp-607,0.0,,2011-05-13 22:34:26,10.444470046690055,10.17188/1277529,"@misc{osti_1277529,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeRu2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277529"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686879'}},0.0,8.61419203,520.0,-50.66413619,-8.444022698333333,"{'tags': ['Cerium ruthenium (1/2)', 'Cerium ruthenium hydride (1/2/4)']}",-50.66413619,-8.444022698333333,-0.2833998766666663,"['xas', 'elasticity', 'bandstructure']",True,"[621326, 656077, 621978, 621973, 621980, 621984, 102277, 621972, 621976, 621979, 604113, 621977, 621982, 621983, 102276, 656078]",True,2021-05-12 10:56:27.046000,NM,6,14,mp-607,,CeRu2,"{'functional': 'PBE', 'labels': ['Ce', 'Ru_pv'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Ru': 2.0}",GGA,mp-607,"['mp-928203', 'mp-912221', 'mp-928809', 'mp-607', 'mp-1071462', 'mp-1071593', 'mp-1071613', 'mp-1077792', 'mp-1440763', 'mp-1686879', 'mp-1803198', 'mp-1591928', 'mp-1591642', 'mp-1071635']",1.005e-05,"{'Ce': 2.0, 'Ru': 4.0}",108.82877852828122,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",1.846937939745105e-07,1.005e-05,0,2.01e-05,MP,data/source/MP/cleaned/cifs/MP-mp-607.cif,True,,data/final/MP/graphs/Ce1Pt0.1Ru1.9-MP-mp-607-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Hg8K1,3,0.0634920634920633,3.0,False,Hg24K3,Hg24K4,3.42,Other,True,Hg88.889K11.111,Hg-K,2,Supercon,Hg8K1,MP-mp-1193208,K4Hg24,Hg-K,Hg85.714K14.286,P n m a,orthorhombic,5.719973,10.951154,14.062645,data/final/MP/cifs/Hg8K1-MP-mp-1193208-synth_doped.cif,data/source/MP/raw/cifs/mp-1193208.cif,mp-1193208,0.0,,2019-01-11 23:04:01.385000,9.36985662229539,,,{'GGA': {'task_id': 'mp-1737668'}},0.0,1.4456974,520.0,-16.0126232,-0.5718794,{'tags': ['Potassium mercuride (1/6)']},-16.0126232,-0.5718794,-0.1529535232857143,[],False,[427001],True,2021-05-12 10:59:56.869000,NM,28,4,mp-1193208,,KHg6,"{'functional': 'PBE', 'labels': ['K_sv', 'Hg'], 'pot_type': 'paw'}","{'K': 1.0, 'Hg': 6.0}",GGA,mp-1193208,"['mp-1193208', 'mp-1386980', 'mp-1737668', 'mp-1897725']",0.0010525,"{'K': 4.0, 'Hg': 24.0}",880.8883747029696,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.779266160050742e-06,0.0010525,0,0.00421,MP,data/source/MP/cleaned/cifs/MP-mp-1193208.cif,True,,data/final/MP/graphs/Hg8K1-MP-mp-1193208-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
B2Mg0.95Zn0.05,2,0.0333333333333333,1.0,True,B2Mg0.95Zn0.05,B2Mg1,38.3,Other,True,B66.667Mg31.667Zn1.667,B-Mg-Zn,3,Supercon,Mg0.95Zn0.05B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B2Mg0.95Zn0.05-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B2Mg0.95Zn0.05-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Sb3Zr5,1,0.0,4.0,False,Sb12Zr20,Sb12Zr20,1.5,Other,True,Sb37.5Zr62.5,Sb-Zr,2,Supercon,Sb3Zr5,MP-mp-505759,Zr20Sb12,Sb-Zr,Sb37.5Zr62.5,P n m a,orthorhombic,7.614874,8.889167,10.866969,data/final/MP/cifs/Sb3Zr5-MP-mp-505759.cif,data/source/MP/raw/cifs/mp-505759.cif,mp-505759,0.0,,2014-03-10 16:04:59,7.41705624172307,10.17188/1262736,"@misc{osti_1262736,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Zr5Sb3 (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1262736"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1731692'}},0.0,6.87269776,520.0,-242.11521115,-7.5661003484375,{'tags': ['Zirconium antimonide (5/3)']},-242.11521115,-7.5661003484375,-0.7474119896875004,"['xas', 'bandstructure']",True,"[52408, 651780]",True,2021-05-12 10:57:08.928000,NM,32,9,mp-505759,,Zr5Sb3,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Sb'], 'pot_type': 'paw'}","{'Zr': 5.0, 'Sb': 3.0}",GGA,mp-505759,"['mp-911074', 'mp-927801', 'mp-927177', 'mp-505759', 'mp-1204977', 'mp-1237917', 'mp-1405806', 'mp-1731692', 'mp-1873864']",0.000388025,"{'Zr': 20.0, 'Sb': 12.0}",735.583900055947,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.110024430771188e-06,0.000388025,0,0.0015521,MP,data/source/MP/cleaned/cifs/MP-mp-505759.cif,False,,data/final/MP/graphs/Sb3Zr5-MP-mp-505759.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Si1Zr4,3,0.1,6.0,False,Si6Zr24,Si8Zr24,0.0,Other,True,Si20Zr80,Si-Zr,2,Supercon,Si1Zr4,MP-mp-1200912,Zr24Si8,Si-Zr,Si25Zr75,P 42/n,tetragonal,5.451209,11.043208,11.043208,data/final/MP/cifs/Si1Zr4-MP-mp-1200912-synth_doped.cif,data/source/MP/raw/cifs/mp-1200912.cif,mp-1200912,0.0,,2019-01-12 05:13:48.195000,6.029951510287509,,,{'GGA': {'task_id': 'mp-1737254'}},0.0154733418749994,4.98298702,520.0,-266.69048942,-8.334077794375,{'tags': ['Zirconium silicide (3/1)']},-266.69048942,-8.334077794375,-0.549223816875001,[],False,[652620],True,2021-05-12 11:00:10.451000,NM,32,4,mp-1200912,,Zr3Si,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Si'], 'pot_type': 'paw'}","{'Zr': 3.0, 'Si': 1.0}",GGA,mp-1200912,"['mp-1200912', 'mp-1393266', 'mp-1737254', 'mp-1865039']",0.0018773125,"{'Zr': 24.0, 'Si': 8.0}",664.7882544788928,[],NM,False,86,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.259140395278576e-05,0.0018773125,0,0.0150185,MP,data/source/MP/cleaned/cifs/MP-mp-1200912.cif,True,,data/final/MP/graphs/Si1Zr4-MP-mp-1200912-synth_doped.json,0,True,4/m,0,0,0,0,3,0,0,1,0,0,0,1.0,False
B2C1Gd0.23Ni2Y0.77,3,0.0766666666666666,1.0,True,B2C1Gd0.23Ni2Y0.77,B2C1Ni2Y1,4.2,Other,True,B33.333C16.667Gd3.833Ni33.333Y12.833,B-C-Gd-Ni-Y,5,Supercon,Y0.77Gd0.23Ni2B2C1,MP-mp-6576,Y1Ni2B2C1,B-C-Ni-Y,B33.333C16.667Ni33.333Y16.667,I 4/m m m,tetragonal,3.548790000501972,3.548790000501972,5.76144136,data/final/MP/cifs/B2C1Gd0.23Ni2Y0.77-MP-mp-6576-synth_doped.cif,data/source/MP/raw/cifs/mp-6576.cif,mp-6576,0.0,,2011-05-13 05:21:43,6.099730998852292,10.17188/1281366,"@misc{osti_1281366,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281366"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688230'}},0.0,6.81083016,520.0,-43.677878,-7.279646333333333,{'tags': []},-43.677878,-7.279646333333333,-0.5109282141666659,"['xas', 'bandstructure']",True,"[75816, 89142, 83231, 79574, 41549]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6576,,YNi2B2C,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6576,"['mp-6576', 'mp-1007054', 'mp-1000583', 'mp-1439516', 'mp-1688230', 'mp-1794280', 'mp-1011792', 'mp-1597064']",0.0006603,"{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.3152437079014,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",1.010943177297096e-05,0.0006603,0,0.0006603,MP,data/source/MP/cleaned/cifs/MP-mp-6576.cif,True,,data/final/MP/graphs/B2C1Gd0.23Ni2Y0.77-MP-mp-6576-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ga1Y1,1,0.0,2.0,False,Ga2Y2,Ga2Y2,0.0,Other,True,Ga50Y50,Ga-Y,2,Supercon,Ga1Y1,MP-mp-11420,Y2Ga2,Ga-Y,Ga50Y50,C m c m,orthorhombic,4.087425,4.338353996692706,5.87750224,data/final/MP/cifs/Ga1Y1-MP-mp-11420.cif,data/source/MP/raw/cifs/mp-11420.cif,mp-11420,0.0,,2011-05-28 04:15:39,5.438626464468515,10.17188/1187818,"@misc{osti_1187818,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YGa (SG:63) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187818"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701188'}},0.0,3.1973208,520.0,-21.66101601,-5.4152540025,"{'tags': ['Yttrium gallide (1/1)', 'Gallium yttrium (1/1)']}",-21.66101601,-5.4152540025,-0.6679704345833333,"['xas', 'bandstructure']",True,"[635654, 104030]",True,2021-05-12 10:56:51.169000,NM,4,8,mp-11420,,YGa,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ga_d'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ga': 1.0}",GGA,mp-11420,"['mp-11420', 'mp-912488', 'mp-928950', 'mp-929321', 'mp-1412884', 'mp-1701188', 'mp-1923692', 'mp-1592980']",0.00437905,"{'Y': 2.0, 'Ga': 2.0}",96.8661496558848,[],NM,False,63,0,"[0, 0, 0, 0]",9.041445366738524e-05,0.00437905,0,0.0087581,MP,data/source/MP/cleaned/cifs/MP-mp-11420.cif,False,,data/final/MP/graphs/Ga1Y1-MP-mp-11420.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Tm1,1,0.0,3.0,False,Tm3,Tm3,0.0,Other,True,Tm100,Tm,1,Supercon,Tm1,MP-mp-1018122,Tm3,Tm,Tm100,R -3 m,trigonal,3.511634444884811,3.511634444884811,8.65745361,data/final/MP/cifs/Tm1-MP-mp-1018122.cif,data/source/MP/raw/cifs/mp-1018122.cif,mp-1018122,0.0,,2017-04-07 02:36:33,9.362600091003332,10.17188/1350213,"@article{osti_1350213,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Tm (SG:166) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1350213"",
    place = ""United States"",
    year = ""2017"",
    month = ""4""
}
",{'GGA': {'task_id': 'mp-1678269'}},0.0,2.96577091,520.0,-13.42750627,-4.475835423333334,"{'tags': ['Thulium - HP', 'High pressure experimental phase']}",-13.42750627,-4.475835423333334,5.921189464667501e-16,"['bandstructure', 'elasticity']",True,[653347],True,2021-05-12 10:56:08.727000,NM,3,12,mp-1018122,,Tm,"{'functional': 'PBE', 'labels': ['Tm_3'], 'pot_type': 'paw'}",{'Tm': 1.0},GGA,mp-1018122,"['mp-1018233', 'mp-1018122', 'mp-1018561', 'mp-1018378', 'mp-1062606', 'mp-1062645', 'mp-1062710', 'mp-1441686', 'mp-1678269', 'mp-1782083', 'mp-1591551', 'mp-1062677']",0.0016828666666666,{'Tm': 3.0},89.88588191215158,[],NM,False,166,0,"[-0.0, 0.0, 0.0]",5.6166773831447336e-05,0.0016828666666666,0,0.0050486,MP,data/source/MP/cleaned/cifs/MP-mp-1018122.cif,False,,data/final/MP/graphs/Tm1-MP-mp-1018122.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ba6Ge25,1,0.0,4.0,False,Ba24Ge100,Ba24Ge100,0.24,Other,True,Ba19.355Ge80.645,Ba-Ge,2,Supercon,Ba6Ge25,MP-mp-569965,Ba24Ge100,Ba-Ge,Ba19.355Ge80.645,P 41 3 2,cubic,14.827302,14.827302,14.827302,data/final/MP/cifs/Ba6Ge25-MP-mp-569965.cif,data/source/MP/raw/cifs/mp-569965.cif,mp-569965,0.0823,,2014-02-22 21:42:35,5.37923310545349,10.17188/1275392,"@misc{osti_1275392,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba6Ge25 (SG:213) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1275392"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",,0.1183408012096771,4.864015,520.0,-531.86239256,-4.289212843225807,"{'tags': ['Barium germanide (6/25)', 'Barium germanide (24/100)', 'Barium germanium (24/100) - III']}",-531.86239256,-4.289212843225807,-0.1895508640322579,['xas'],False,"[159766, 91052, 92576]",True,2021-05-12 10:57:24.969000,NM,124,2,mp-569965,,Ba6Ge25,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ge_d'], 'pot_type': 'paw'}","{'Ba': 6.0, 'Ge': 25.0}",GGA,mp-569965,"['mp-569965', 'mp-1365637']",0.199553375,"{'Ba': 24.0, 'Ge': 100.0}",3259.7658063155463,[],NM,False,213,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0002448683578597,0.199553375,0,0.7982135,MP,data/source/MP/cleaned/cifs/MP-mp-569965.cif,False,,data/final/MP/graphs/Ba6Ge25-MP-mp-569965.json,0,True,432,4,0,0,0,0,0,0,1,0,0,0,1.0,False
Ce1Pt3,1,0.0,1.0,True,Ce1Pt3,Ce1Pt3,0.0,Heavy_fermion,True,Ce25Pt75,Ce-Pt,2,Supercon,Ce1Pt3,MP-mp-11318,Ce1Pt3,Ce-Pt,Ce25Pt75,P m -3 m,cubic,4.173339,4.173339,4.173339,data/final/MP/cifs/Ce1Pt3-MP-mp-11318.cif,data/source/MP/raw/cifs/mp-11318.cif,mp-11318,0.0,,2011-05-28 00:50:08,16.57129690049868,10.17188/1187735,"@misc{osti_1187735,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CePt3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187735"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698440'}},0.0,8.33537087,520.0,-28.0076101,-7.001902525,{'tags': ['Cerium platinum (1/3)']},-28.0076101,-7.001902525,-0.9654494537499998,"['xas', 'elasticity']",False,[102258],True,2021-05-12 10:56:10.715000,NM,4,8,mp-11318,,CePt3,"{'functional': 'PBE', 'labels': ['Ce', 'Pt'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Pt': 3.0}",GGA,mp-11318,"['mp-11318', 'mp-912234', 'mp-928232', 'mp-928798', 'mp-1441624', 'mp-1698440', 'mp-1799514', 'mp-1593986']",0.0002916,"{'Ce': 1.0, 'Pt': 3.0}",72.68603712152797,[],NM,False,221,0,"[0, 0, 0, 0]",4.011774634410969e-06,0.0002916,0,0.0002916,MP,data/source/MP/cleaned/cifs/MP-mp-11318.cif,False,,data/final/MP/graphs/Ce1Pt3-MP-mp-11318.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Fe0.15Ni0.85Zr2,3,0.1,2.0,False,Fe0.3Ni1.7Zr4,Ni2Zr4,2.31,Other,True,Fe5Ni28.333Zr66.667,Fe-Ni-Zr,3,Supercon,Fe0.15Ni0.85Zr2,MP-mp-328,Zr4Ni2,Ni-Zr,Ni33.333Zr66.667,I 4/m c m,tetragonal,5.262569995425936,5.300086679397286,5.30008668,data/final/MP/cifs/Fe0.15Ni0.85Zr2-MP-mp-328-synth_doped.cif,data/source/MP/raw/cifs/mp-328.cif,mp-328,0.0,,2011-05-13 23:00:52,7.189329355994663,10.17188/1206385,"@misc{osti_1206385,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Zr2Ni (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1206385"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704571'}},0.0,5.05377097,520.0,-47.68946569,-7.948244281666667,{'tags': ['Nickel zirconium (1/2)']},-47.68946569,-7.948244281666667,-0.3230649683333328,"['xas', 'elasticity', 'bandstructure']",True,"[656070, 647167, 102805, 105479]",True,2021-05-12 10:56:20.740000,NM,6,11,mp-328,,Zr2Ni,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Ni_pv'], 'pot_type': 'paw'}","{'Zr': 2.0, 'Ni': 1.0}",GGA,mp-328,"['mp-918996', 'mp-919988', 'mp-906163', 'mp-604722', 'mp-328', 'mp-1076983', 'mp-1205320', 'mp-1413019', 'mp-1704571', 'mp-1802467', 'mp-1592827']",0.00134705,"{'Zr': 4.0, 'Ni': 2.0}",111.39417752247834,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0]",2.4185285621920005e-05,0.00134705,0,0.0026941,MP,data/source/MP/cleaned/cifs/MP-mp-328.cif,True,,data/final/MP/graphs/Fe0.15Ni0.85Zr2-MP-mp-328-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
C1Nb1,1,0.0,1.0,True,C1Nb1,C1Nb1,10.025,Other,True,C50Nb50,C-Nb,2,Supercon,C1Nb1,MP-mp-910,Nb1C1,C-Nb,C50Nb50,F m -3 m,cubic,3.18634336,3.1863433599999995,3.1863433599999995,data/final/MP/cifs/C1Nb1-MP-mp-910.cif,data/source/MP/raw/cifs/mp-910.cif,mp-910,0.0,,2011-05-12 17:28:40,7.616098778357742,10.17188/1282001,"@misc{osti_1282001,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbC (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1282001"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686610'}},0.0408750508333302,7.39992982,520.0,-20.24633413,-10.123167065,"{'tags': ['Niobium carbide (1/1)', 'Niobium carbide (1/1) - RS-type']}",-20.24633413,-10.123167065,-0.4591241950000011,"['xas', 'elasticity', 'bandstructure']",True,"[618465, 77214, 187077, 618456, 181792, 618453, 94449, 618472, 183163, 237582, 618457, 159872, 618480, 618475, 618482, 618469, 155164, 618466, 44355, 618450, 618458, 618449, 44496, 618463, 618462, 618460, 618481, 618471, 618476, 181052, 601142, 618448, 189089, 618478, 26955, 618473, 618484, 618483]",True,2021-05-12 10:56:35.166000,NM,2,25,mp-910,,NbC,"{'functional': 'PBE', 'labels': ['Nb_pv', 'C'], 'pot_type': 'paw'}","{'Nb': 1.0, 'C': 1.0}",GGA,mp-910,"['mp-1000444', 'mp-1001333', 'mp-910', 'mp-1057158', 'mp-1057178', 'mp-1057130', 'mp-1057651', 'mp-1057669', 'mp-1057682', 'mp-1057771', 'mp-1057779', 'mp-1057802', 'mp-1060960', 'mp-1060978', 'mp-1061015', 'mp-1440938', 'mp-1686610', 'mp-1805660', 'mp-1007673', 'mp-1593845', 'mp-1596940', 'mp-1061007', 'mp-1057677', 'mp-1057792', 'mp-1057174']",3.33e-05,"{'Nb': 1.0, 'C': 1.0}",22.87508541625878,[],NM,False,225,0,"[0, 0]",1.4557322691495426e-06,3.33e-05,0,3.33e-05,MP,data/source/MP/cleaned/cifs/MP-mp-910.cif,False,,data/final/MP/graphs/C1Nb1-MP-mp-910.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ba0.218Cu1La1.782O4,3,0.0622857142857142,1.0,True,Ba0.218Cu1La1.782O4,Cu1La2O4,21.6,Cuprate,True,Ba3.114Cu14.286La25.457O57.142857142857146,Ba-Cu-La-O,4,Supercon,La1.782Ba0.218Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ba0.218Cu1La1.782O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ba0.218Cu1La1.782O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ge2La1Ni2,1,0.0,1.0,True,Ge2La1Ni2,Ge2La1Ni2,0.345,Other,True,Ge40La20Ni40,Ge-La-Ni,3,Supercon,La1Ni2Ge2,MP-mp-19979,La1Ni2Ge2,Ge-La-Ni,Ge40La20Ni40,I 4/m m m,tetragonal,4.202429998532099,4.202429998532098,5.781361549999999,data/final/MP/cifs/Ge2La1Ni2-MP-mp-19979.cif,data/source/MP/raw/cifs/mp-19979.cif,mp-19979,0.0,,2014-02-21 14:58:48,7.613736614664866,10.17188/1195159,"@misc{osti_1195159,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La(NiGe)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195159"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1674220'}},0.0,8.03656273,520.0,-29.19737105,-5.8394742100000006,{'tags': ['Lanthanum nickel germanide (1/2/2)']},-29.19737105,-5.8394742100000006,-0.6910069750000005,"['xas', 'bandstructure']",True,"[247666, 636821, 81754, 185092]",True,2021-05-12 10:56:57.051000,NM,5,16,mp-19979,,La(NiGe)2,"{'functional': 'PBE', 'labels': ['La', 'Ni_pv', 'Ge_d'], 'pot_type': 'paw'}","{'La': 1.0, 'Ni': 2.0, 'Ge': 2.0}",GGA,mp-19979,"['mp-992632', 'mp-990572', 'mp-19979', 'mp-1068714', 'mp-1068551', 'mp-1068875', 'mp-1070143', 'mp-1070252', 'mp-1070352', 'mp-1437975', 'mp-1674220', 'mp-1784287', 'mp-994085', 'mp-1593486', 'mp-1070306', 'mp-1068835']",0.0001168,"{'La': 1.0, 'Ni': 2.0, 'Ge': 2.0}",87.58202130526351,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",1.3336070378291276e-06,0.0001168,0,0.0001168,MP,data/source/MP/cleaned/cifs/MP-mp-19979.cif,False,,data/final/MP/graphs/Ge2La1Ni2-MP-mp-19979.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Re0.01Ru1.99Si2U1,2,0.004,1.0,True,Re0.01Ru1.99Si2U1,Ru2Si2U1,0.23,Heavy_fermion,True,Re0.2Ru39.8Si40U20,Re-Ru-Si-U,4,Supercon,U1Ru1.99Re0.01Si2,MP-mp-3388,U1Si2Ru2,Ru-Si-U,Ru40Si40U20,I 4/m m m,tetragonal,4.158676000898558,4.158676000898558,5.61744113,data/final/MP/cifs/Re0.01Ru1.99Si2U1-MP-mp-3388-synth_doped.cif,data/source/MP/raw/cifs/mp-3388.cif,mp-3388,0.0,,2011-05-13 04:30:05,9.956832496604427,10.17188/1206675,"@misc{osti_1206675,
    author = ""Persson, Kristin"",
    title = ""Materials Data on U(SiRu)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1206675"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686680'}},0.0,9.49980175,520.0,-43.93435978,-8.786871956,"{'tags': ['Uranium ruthenium germanide (1/2/2)', 'Uranium ruthenium silicide (1/2/2)', 'Ruthenium uranium silicide (2/1/2)']}",-43.93435978,-8.786871956,-0.6203084840000003,"['xas', 'elasticity', 'bandstructure']",True,"[604007, 40549, 603775, 657192, 650657, 650659, 656244, 650651, 659029, 650655, 657104, 650654]",True,2021-05-12 10:56:20.740000,NM,5,10,mp-3388,,U(SiRu)2,"{'functional': 'PBE', 'labels': ['U', 'Si', 'Ru_pv'], 'pot_type': 'paw'}","{'U': 1.0, 'Si': 2.0, 'Ru': 2.0}",GGA,mp-3388,"['mp-908075', 'mp-923326', 'mp-922549', 'mp-3388', 'mp-1143681', 'mp-1441027', 'mp-1686680', 'mp-1864234', 'mp-1588085', 'mp-1586352']",0.00906,"{'U': 1.0, 'Si': 2.0, 'Ru': 2.0}",82.7765065997446,[],NM,False,139,0,"[0.0, 0.0, 0.0, -0.0, -0.0]",0.0001094513452205,0.00906,0,0.00906,MP,data/source/MP/cleaned/cifs/MP-mp-3388.cif,True,,data/final/MP/graphs/Re0.01Ru1.99Si2U1-MP-mp-3388-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Co0.02Cu0.98Rh2S4,2,0.0057142857142857,2.0,False,Co0.04Cu1.96Rh4S8,Cu2Rh4S8,1.0,Other,True,Co0.286Cu14Rh28.571S57.143,Co-Cu-Rh-S,4,Supercon,Cu0.98Co0.02Rh2S4,MP-mp-15613,Cu2Rh4S8,Cu-Rh-S,Cu14.286Rh28.571S57.143,F d -3 m,cubic,6.98743829,6.987438289999999,6.987438289999999,data/final/MP/cifs/Co0.02Cu0.98Rh2S4-MP-mp-15613-synth_doped.cif,data/source/MP/raw/cifs/mp-15613.cif,mp-15613,0.0,,2011-06-05 06:28:04,5.474003596961352,10.17188/1191271,"@misc{osti_1191271,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Cu(RhS2)2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191271"",
    place = ""United States"",
    year = ""2015"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1676515'}},0.0,5.28884909,520.0,-76.75879515,-5.482771082142857,"{'tags': ['Copper rhodium sulfide (1/2/4)', 'Copper dirhodium sulfide', 'Cuprorhodsite']}",-76.75879515,-5.482771082142857,-0.716825099642857,"['xas', 'bandstructure']",True,"[628767, 41900]",True,2021-05-12 10:56:53.126000,NM,14,8,mp-15613,,Cu(RhS2)2,"{'functional': 'PBE', 'labels': ['Cu_pv', 'Rh_pv', 'S'], 'pot_type': 'paw'}","{'Cu': 1.0, 'Rh': 2.0, 'S': 4.0}",GGA,mp-15613,"['mp-920968', 'mp-942816', 'mp-942447', 'mp-15613', 'mp-1475540', 'mp-1676515', 'mp-1774816', 'mp-1603317']",0.0083359,"{'Cu': 2.0, 'Rh': 4.0, 'S': 8.0}",241.23424486268337,[],NM,False,227,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",6.91104200794129e-05,0.0083359,0,0.0166718,MP,data/source/MP/cleaned/cifs/MP-mp-15613.cif,True,,data/final/MP/graphs/Co0.02Cu0.98Rh2S4-MP-mp-15613-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ge6Pt4Y3,1,0.0,2.0,False,Ge12Pt8Y6,Ge12Pt8Y6,2.6,Other,True,Ge46.154Pt30.769Y23.077,Ge-Pt-Y,3,Supercon,Y3Pt4Ge6,MP-mp-570801,Y6Ge12Pt8,Ge-Pt-Y,Ge46.154Pt30.769Y23.077,P 1 21/m 1,monoclinic,4.361515,8.805894,13.37570614,data/final/MP/cifs/Ge6Pt4Y3-MP-mp-570801.cif,data/source/MP/raw/cifs/mp-570801.cif,mp-570801,0.0,,2014-02-23 19:49:30,9.718672188792874,10.17188/1275914,"@misc{osti_1275914,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Y3(Ge3Pt2)2 (SG:11) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1275914"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1716799'}},0.0,6.42980672,520.0,-165.60842985,-6.369554994230769,{'tags': ['Yttrium platinum germanide (3/4/6)']},-165.60842985,-6.369554994230769,-0.8756156626923072,"['xas', 'bandstructure']",True,[76293],True,2021-05-12 10:57:24.969000,NM,26,8,mp-570801,,Y3(Ge3Pt2)2,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ge_d', 'Pt'], 'pot_type': 'paw'}","{'Y': 3.0, 'Ge': 6.0, 'Pt': 4.0}",GGA,mp-570801,"['mp-922124', 'mp-940025', 'mp-570801', 'mp-940452', 'mp-1401278', 'mp-1716799', 'mp-1826435', 'mp-1627497']",0.0021804,"{'Y': 6.0, 'Ge': 12.0, 'Pt': 8.0}",506.7364396185087,[],NM,False,11,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",8.605657022184911e-06,0.0021804,0,0.0043608,MP,data/source/MP/cleaned/cifs/MP-mp-570801.cif,False,,data/final/MP/graphs/Ge6Pt4Y3-MP-mp-570801.json,0,True,2/m,0,0,3,0,0,0,0,1,0,0,0,1.0,False
Bi1La2,1,0.0,2.0,False,Bi2La4,Bi2La4,0.76,Other,True,Bi33.333La66.667,Bi-La,2,Supercon,Bi1La2,MP-mp-1077063,La4Bi2,Bi-La,Bi33.333La66.667,I 4/m m m,tetragonal,4.732333999705861,4.732333999705861,9.8471129,data/final/MP/cifs/Bi1La2-MP-mp-1077063.cif,data/source/MP/raw/cifs/mp-1077063.cif,mp-1077063,0.0,,2018-04-07 21:31:03,7.794857198810527,,,{'GGA': {'task_id': 'mp-1700000'}},0.0,7.61236603,520.0,-32.08617206,-5.347695343333334,"{'tags': ['La2Sb', 'Lanthanum bismuthide (2/1)', 'La2Bi']}",-32.08617206,-5.347695343333334,-0.760345836666667,['bandstructure'],True,[616761],True,2021-05-12 10:58:14.654000,NM,6,5,mp-1077063,,La2Bi,"{'functional': 'PBE', 'labels': ['La', 'Bi'], 'pot_type': 'paw'}","{'La': 2.0, 'Bi': 1.0}",GGA,mp-1077063,"['mp-1077063', 'mp-1425278', 'mp-1700000', 'mp-1789612', 'mp-1600518']",0.01425825,"{'La': 4.0, 'Bi': 2.0}",207.40239794923065,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",0.0001374935887046,0.01425825,0,0.0285165,MP,data/source/MP/cleaned/cifs/MP-mp-1077063.cif,False,,data/final/MP/graphs/Bi1La2-MP-mp-1077063.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Bi2Cu1Sr2O6.36,2,0.028809218950064,1.886948113207547,False,Bi3.774Cu1.887Sr3.774O12,Bi4Cu2Sr4O12,8.0,Cuprate,True,Bi17.606Cu8.803Sr17.606O55.98591549295776,Bi-Cu-Sr-O,4,Supercon,Bi2Sr2Cu1O6.36,MP-mp-555827,Sr4Cu2Bi4O12,Bi-Cu-Sr-O,Bi18.182Cu9.091Sr18.182O54.54545454545455,C c c m,orthorhombic,5.133052,5.52519599964684,13.01880065,data/final/MP/cifs/Bi2Cu1Sr2O6.36-MP-mp-555827-synth_doped.cif,data/source/MP/raw/cifs/mp-555827.cif,mp-555827,0.0,,2014-02-22 10:13:35,6.928457216674172,10.17188/1269010,"@misc{osti_1269010,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr2Cu(BiO3)2 (SG:66) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1269010"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1707731'}},0.0585641377272736,4.75363105,520.0,-126.5422218,-5.7519191727272725,{'tags': ['Dibismuth distrontium copper hexaoxide']},-126.5422218,-5.7519191727272725,-2.0406438793939388,"['xas', 'bandstructure']",True,[67426],True,2021-05-12 10:57:17.297000,NM,22,8,mp-555827,oxide,Sr2Cu(BiO3)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Cu': 1.0, 'Bi': 2.0, 'O': 6.0}",GGA,mp-555827,"['mp-932594', 'mp-931549', 'mp-918058', 'mp-555827', 'mp-1418436', 'mp-1707731', 'mp-1837530', 'mp-1605675']",0.00627605,"{'Sr': 4.0, 'Cu': 2.0, 'Bi': 4.0, 'O': 12.0}",360.8189966762927,[],NM,False,66,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",3.478780251490214e-05,0.00627605,0,0.0125521,MP,data/source/MP/cleaned/cifs/MP-mp-555827.cif,True,,data/final/MP/graphs/Bi2Cu1Sr2O6.36-MP-mp-555827-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ba2Cu3Gd0.85Pr0.15O7,2,0.023076923076923,1.0,True,Ba2Cu3Gd0.85Pr0.15O7,Ba2Cu3Gd1O7,67.9,Cuprate,True,Ba15.385Cu23.077Gd6.538Pr1.154O53.84615384615385,Ba-Cu-Gd-Pr-O,5,Supercon,Gd0.85Pr0.15Ba2Cu3O7,MP-mp-19813,Ba2Gd1Cu3O7,Ba-Cu-Gd-O,Ba15.385Cu23.077Gd7.692O53.84615384615385,P m m m,orthorhombic,3.866027,3.930015,11.83802,data/final/MP/cifs/Ba2Cu3Gd0.85Pr0.15O7-MP-mp-19813-synth_doped.cif,data/source/MP/raw/cifs/mp-19813.cif,mp-19813,0.0,,2014-02-22 19:20:06,6.781489399734723,10.17188/1195011,"@misc{osti_1195011,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2GdCu3O7 (SG:47) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195011"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702590'}},0.0282650169230738,3.15888808,520.0,-88.25301217,-6.788693243846154,"{'tags': ['Gadolinium dibarium tricopper heptaoxide', 'Gadolinium barium copper oxide (1/2/3/7)', 'Dibarium gadolinium dicopper copper(III) oxide']}",-88.25301217,-6.788693243846154,-2.170353940384615,['bandstructure'],True,"[56514, 86959, 81172]",True,2021-05-12 10:58:49.477000,FM,13,5,mp-19813,oxide,Ba2GdCu3O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Gd', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Gd': 1.0, 'Cu': 3.0, 'O': 7.0}",GGA,mp-19813,"['mp-19813', 'mp-1432948', 'mp-1702590', 'mp-1829895', 'mp-1597575']",6.9263247,"{'Ba': 2.0, 'Gd': 1.0, 'Cu': 3.0, 'O': 7.0}",179.8614789314764,[],FM,True,47,1,"[0.0, 0.0, 6.9, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0385092168770545,6.9263247,1,6.9263247,MP,data/source/MP/cleaned/cifs/MP-mp-19813.cif,True,,data/final/MP/graphs/Ba2Cu3Gd0.85Pr0.15O7-MP-mp-19813-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Nb1Se2,1,0.0,4.0,False,Nb4Se8,Nb4Se8,6.814619048,Other,True,Nb33.333Se66.667,Nb-Se,2,Supercon,Nb1Se2,MP-mp-571133,Nb4Se8,Nb-Se,Nb33.333Se66.667,P -6 m 2,hexagonal,3.4931739969551345,3.49317363,28.215334,data/final/MP/cifs/Nb1Se2-MP-mp-571133.cif,data/source/MP/raw/cifs/mp-571133.cif,mp-571133,0.0,,2014-02-16 10:50:21,5.587610112255524,10.17188/1276101,"@misc{osti_1276101,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbSe2 (SG:187) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1276101"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1676508'}},0.0,2.69103125,520.0,-78.46856377,-6.539046980833334,"{'tags': ['Niobium(IV) selenide', 'Niobium selenide (1/2)']}",-78.46856377,-6.539046980833334,-1.1560043157291666,"['xas', 'elasticity', 'bandstructure']",True,"[645390, 18132]",True,2021-05-12 10:56:27.046000,NM,12,9,mp-571133,,NbSe2,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Se'], 'pot_type': 'paw'}","{'Nb': 1.0, 'Se': 2.0}",GGA,mp-571133,"['mp-909606', 'mp-925310', 'mp-571133', 'mp-924714', 'mp-1102173', 'mp-1381009', 'mp-1676508', 'mp-1813091', 'mp-1603942']",0.001887425,"{'Nb': 4.0, 'Se': 8.0}",298.1646854781909,[],NM,False,187,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.5320570703710044e-05,0.001887425,0,0.0075497,MP,data/source/MP/cleaned/cifs/MP-mp-571133.cif,False,,data/final/MP/graphs/Nb1Se2-MP-mp-571133.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
As1F0.13Fe1Sm1O0.87,3,0.065,2.0,False,As2F0.26Fe2Sm2O1.74,As2Fe2Sm2O2,24.7,Ferrite,True,As25F3.25Fe25Sm25O21.75,As-F-Fe-Sm-O,5,Supercon,Sm1Fe1As1F0.13O0.87,MP-mp-20349,Sm2Fe2As2O2,As-Fe-Sm-O,As25Fe25Sm25O25,P 4/n m m,tetragonal,4.026492,4.026492,9.046755,data/final/MP/cifs/As1F0.13Fe1Sm1O0.87-MP-mp-20349-synth_doped.cif,data/source/MP/raw/cifs/mp-20349.cif,mp-20349,0.0,,2014-02-19 11:24:42,6.727802583283198,,,{'GGA+U': {'task_id': 'mp-1695938'}},0.3015723809374986,3.77685593,520.0,-52.73407138,-6.5917589225,{'tags': ['Samarium iron arsenic oxide (1/1/1/1)']},-52.73407138,-6.5917589225,-1.6285904237499995,"['xas', 'elasticity', 'bandstructure']",True,"[236652, 236653, 422002, 163457, 163458]",True,2021-05-12 10:56:16.728000,FM,8,10,mp-20349,oxide,SmFeAsO,"{'functional': 'PBE', 'labels': ['Sm_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Sm': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-20349,"['mp-24944', 'mp-1078897', 'mp-1079866', 'mp-1173321', 'mp-20349', 'mp-1425472', 'mp-1695938', 'mp-1772503', 'mp-1789694', 'mp-1588381']",3.75729895,"{'Sm': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",146.67176231613362,[],FM,True,129,1,"[0.0, 0.0, 3.5, 3.5, -0.0, -0.0, -0.0, -0.0]",0.0512341147425717,3.75729895,2,7.5145979,MP,data/source/MP/cleaned/cifs/MP-mp-20349.cif,True,,data/final/MP/graphs/As1F0.13Fe1Sm1O0.87-MP-mp-20349-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ba2Cu3Nd0.97Pr0.03O7,2,0.0046153846153846,1.0,True,Ba2Cu3Nd0.97Pr0.03O7,Ba2Cu3Nd1O7,85.1,Cuprate,True,Ba15.385Cu23.077Nd7.462Pr0.231O53.84615384615385,Ba-Cu-Nd-Pr-O,5,Supercon,Nd0.97Pr0.03Ba2Cu3O7,MP-mp-22719,Ba2Nd1Cu3O7,Ba-Cu-Nd-O,Ba15.385Cu23.077Nd7.692O53.84615384615385,P m m m,orthorhombic,3.893817,3.958458,11.89947,data/final/MP/cifs/Ba2Cu3Nd0.97Pr0.03O7-MP-mp-22719-synth_doped.cif,data/source/MP/raw/cifs/mp-22719.cif,mp-22719,0.0,,2015-01-22 21:32:23,6.532421108031168,10.17188/1198922,"@misc{osti_1198922,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2NdCu3O7 (SG:47) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198922"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704234'}},0.0180149053205083,3.13221275,520.0,-78.75337907,-6.057952236153846,"{'tags': ['Neodymium barium copper oxide (1/2/3/7)', 'Neodymium dibarium tricopper heptaoxide']}",-78.75337907,-6.057952236153846,-2.155611319615384,"['bandstructure', 'elasticity']",True,"[86960, 81169]",True,2021-05-12 10:56:16.728000,NM,13,8,mp-22719,oxide,Ba2NdCu3O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Nd_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Nd': 1.0, 'Cu': 3.0, 'O': 7.0}",GGA,mp-22719,"['mp-926068', 'mp-925655', 'mp-917559', 'mp-1427130', 'mp-1704234', 'mp-1829984', 'mp-1600543', 'mp-22719']",0.0444215,"{'Ba': 2.0, 'Nd': 1.0, 'Cu': 3.0, 'O': 7.0}",183.4126123839547,[],NM,False,47,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0002421943585155,0.0444215,0,0.0444215,MP,data/source/MP/cleaned/cifs/MP-mp-22719.cif,True,,data/final/MP/graphs/Ba2Cu3Nd0.97Pr0.03O7-MP-mp-22719-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Bi1La0.7S2Th0.3O1,3,0.12,2.0,False,Bi2La1.4S4Th0.6O2,Bi2La2S4O2,2.04,Oxide,True,Bi20La14S40Th6O20,Bi-La-S-Th-O,5,Supercon,La0.7Th0.3Bi1S2O1,MP-mp-1078397,La2Bi2S4O2,Bi-La-S-O,Bi20La20S40O20,P 4/n m m,tetragonal,4.055497,4.055497,14.173265,data/final/MP/cifs/Bi1La0.7S2Th0.3O1-MP-mp-1078397-synth_doped.cif,data/source/MP/raw/cifs/mp-1078397.cif,mp-1078397,1.0743999999999998,,2018-04-11 10:57:38,6.097899749460756,,,{'GGA': {'task_id': 'mp-1676377'}},0.0053330699999989,4.69184382,520.0,-61.66700475,-6.166700475,{'tags': ['Lanthanum bismuth oxodisulphate']},-61.66700475,-6.166700475,-2.09592004425,['bandstructure'],True,[196231],True,2021-05-12 10:58:14.654000,NM,10,5,mp-1078397,oxide,LaBiS2O,"{'functional': 'PBE', 'labels': ['La', 'Bi', 'S', 'O'], 'pot_type': 'paw'}","{'La': 1.0, 'Bi': 1.0, 'S': 2.0, 'O': 1.0}",GGA,mp-1078397,"['mp-1078397', 'mp-1380859', 'mp-1676377', 'mp-1776923', 'mp-1600973']",6.57e-05,"{'La': 2.0, 'Bi': 2.0, 'S': 4.0, 'O': 2.0}",233.1084819815865,[],NM,False,129,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.636860524465146e-07,6.57e-05,0,0.0001314,MP,data/source/MP/cleaned/cifs/MP-mp-1078397.cif,True,,data/final/MP/graphs/Bi1La0.7S2Th0.3O1-MP-mp-1078397-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B1Ir1,1,0.0,1.0,True,B1Ir1,B1Ir1,0.0,Other,True,B50Ir50,B-Ir,2,Supercon,B1Ir1,MP-mp-1183252,B1Ir1,B-Ir,B50Ir50,P -6 m 2,hexagonal,2.719451,3.050359997160068,3.05035978,data/final/MP/cifs/B1Ir1-MP-mp-1183252.cif,data/source/MP/raw/cifs/mp-1183252.cif,mp-1183252,0.0,,2019-01-11 11:52:15.503000,15.38477010210741,,,{'GGA': {'task_id': 'mp-1675852'}},0.0,9.10150342,520.0,-15.91883799,-7.959418995,{'tags': []},-15.91883799,-7.959418995,-0.2005078995833331,['bandstructure'],True,[],True,2021-05-12 10:58:25.879000,NM,2,5,mp-1183252,,BIr,"{'functional': 'PBE', 'labels': ['B', 'Ir'], 'pot_type': 'paw'}","{'B': 1.0, 'Ir': 1.0}",GGA,mp-1183252,"['mp-1183252', 'mp-1428380', 'mp-1675852', 'mp-1794360', 'mp-1611115']",0.0002282,"{'B': 1.0, 'Ir': 1.0}",21.913614787619338,[],NM,False,187,0,"[0, 0]",1.041361738862579e-05,0.0002282,0,0.0002282,MP,data/source/MP/cleaned/cifs/MP-mp-1183252.cif,False,,data/final/MP/graphs/B1Ir1-MP-mp-1183252.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Cr0.7Ir0.3,3,0.1,8.0,False,Cr5.6Ir2.4,Cr6Ir2,0.76,Other,True,Cr70Ir30,Cr-Ir,2,Supercon,Cr0.7Ir0.3,MP-mp-1609,Cr6Ir2,Cr-Ir,Cr75Ir25,P m -3 n,cubic,4.649853,4.649853,4.649853,data/final/MP/cifs/Cr0.7Ir0.3-MP-mp-1609-synth_doped.cif,data/source/MP/raw/cifs/mp-1609.cif,mp-1609,0.0,,2011-05-14 06:37:35,11.502620729111474,10.17188/1191557,"@misc{osti_1191557,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Cr3Ir (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191557"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700096'}},0.0183214725000002,7.78335882,520.0,-76.09006936,-9.51125867,{'tags': ['Chromium iridium (3/1)']},-76.09006936,-9.51125867,-0.0618654625000001,"['xas', 'elasticity', 'bandstructure']",True,"[102780, 102779]",True,2021-05-12 10:56:12.755000,NM,8,8,mp-1609,,Cr3Ir,"{'functional': 'PBE', 'labels': ['Cr_pv', 'Ir'], 'pot_type': 'paw'}","{'Cr': 3.0, 'Ir': 1.0}",GGA,mp-1609,"['mp-912358', 'mp-928869', 'mp-928340', 'mp-1609', 'mp-1414364', 'mp-1700096', 'mp-1797142', 'mp-1590447']",0.005854,"{'Cr': 6.0, 'Ir': 2.0}",100.5350897789424,[],NM,False,223,0,"[-0.0, -0.0, -0.0, -0.0, -0.0, -0.0, 0.0, 0.0]",0.0001164568512918,0.005854,0,0.011708,MP,data/source/MP/cleaned/cifs/MP-mp-1609.cif,True,,data/final/MP/graphs/Cr0.7Ir0.3-MP-mp-1609-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Os0.7Re0.3,3,0.1,8.0,False,Os5.6Re2.4,Os6Re2,0.8,Other,True,Os70Re30,Os-Re,2,Supercon,Os0.7Re0.3,MP-mp-867141,Re2Os6,Os-Re,Os75Re25,P 63/m m c,hexagonal,4.369407,5.537107995712844,5.53710783,data/final/MP/cifs/Os0.7Re0.3-MP-mp-867141-synth_doped.cif,data/source/MP/raw/cifs/mp-867141.cif,mp-867141,0.0,,2014-10-15 17:46:38,21.66689974227436,10.17188/1311788,"@misc{osti_1311788,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ReOs3 (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1311788"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1754864'}},0.0,8.29738654,520.0,-92.93589693,-11.61698711625,{'tags': []},-92.93589693,-11.61698711625,-0.0853306287500004,"['xas', 'bandstructure']",True,[],True,2021-05-12 10:57:53.781000,NM,8,8,mp-867141,,ReOs3,"{'functional': 'PBE', 'labels': ['Re_pv', 'Os_pv'], 'pot_type': 'paw'}","{'Re': 1.0, 'Os': 3.0}",GGA,mp-867141,"['mp-867141', 'mp-1054734', 'mp-1054761', 'mp-1397001', 'mp-1754864', 'mp-1802803', 'mp-1619968', 'mp-1054762']",0.00038735,"{'Re': 2.0, 'Os': 6.0}",116.0163247019676,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",6.677508548819435e-06,0.00038735,0,0.0007747,MP,data/source/MP/cleaned/cifs/MP-mp-867141.cif,True,,data/final/MP/graphs/Os0.7Re0.3-MP-mp-867141-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
N1V1,1,0.0,1.0,True,N1V1,N1V1,8.528333333500001,Other,True,N50V50,N-V,2,Supercon,V1N1,MP-mp-1018027,V1N1,N-V,N50V50,P -6 m 2,hexagonal,2.650884,2.7441139966135384,2.74411362,data/final/MP/cifs/N1V1-MP-mp-1018027.cif,data/source/MP/raw/cifs/mp-1018027.cif,mp-1018027,0.0,,2017-04-06 22:50:08,6.238650289574885,10.17188/1350109,"@article{osti_1350109,
    author = ""Persson, Kristin"",
    title = ""Materials Data on VN (SG:187) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1350109"",
    place = ""United States"",
    year = ""2017"",
    month = ""4""
}
",{'GGA': {'task_id': 'mp-1708543'}},0.0,8.01774245,520.0,-19.7434431,-9.87172155,"{'tags': ['Tantalum nitride', 'Vanadium nitride', 'Niobium nitride']}",-19.7434431,-9.87172155,-1.3420210524999998,"['xas', 'bandstructure']",True,"[169820, 236426, 236427, 236425, 191061]",True,2021-05-12 10:56:51.169000,NM,2,29,mp-1018027,,VN,"{'functional': 'PBE', 'labels': ['V_pv', 'N'], 'pot_type': 'paw'}","{'V': 1.0, 'N': 1.0}",GGA,mp-1018027,"['mp-1018027', 'mp-1018232', 'mp-1018180', 'mp-1018364', 'mp-1057791', 'mp-1057832', 'mp-1057871', 'mp-1058279', 'mp-1058305', 'mp-1058336', 'mp-1058343', 'mp-1058365', 'mp-1058410', 'mp-1059217', 'mp-1059301', 'mp-1059342', 'mp-1059261', 'mp-1059121', 'mp-1059171', 'mp-1115473', 'mp-1423003', 'mp-1708543', 'mp-1790797', 'mp-1607807', 'mp-1059185', 'mp-1058318', 'mp-1058380', 'mp-1057845', 'mp-1059319']",0.0042068,"{'V': 1.0, 'N': 1.0}",17.287236565507055,[],NM,False,187,0,"[0, 0]",0.0002433471644851,0.0042068,0,0.0042068,MP,data/source/MP/cleaned/cifs/MP-mp-1018027.cif,False,,data/final/MP/graphs/N1V1-MP-mp-1018027.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
La0.87Sn3Th0.13,3,0.065,1.0,True,La0.87Sn3Th0.13,La1Sn3,6.26,Other,True,La21.75Sn75Th3.25,La-Sn-Th,3,Supercon,La0.87Th0.13Sn3,MP-mp-633,La1Sn3,La-Sn,La25Sn75,P m -3 m,cubic,4.820061,4.820061,4.820061,data/final/MP/cifs/La0.87Sn3Th0.13-MP-mp-633-synth_doped.cif,data/source/MP/raw/cifs/mp-633.cif,mp-633,0.0,,2011-05-13 04:30:54,7.340536659909055,10.17188/1279358,"@misc{osti_1279358,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaSn3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1279358"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688008'}},0.0,8.68748013,520.0,-19.26482408,-4.81620602,"{'tags': ['Lanthanum stannide (1/3)', 'Lanthanum tin (1/3)']}",-19.26482408,-4.81620602,-0.5750253525,"['xas', 'bandstructure']",True,"[641991, 104721, 641986, 261870, 104720, 151359, 642000, 641998, 191074]",True,2021-05-12 10:57:30.779000,NM,4,12,mp-633,,LaSn3,"{'functional': 'PBE', 'labels': ['La', 'Sn_d'], 'pot_type': 'paw'}","{'La': 1.0, 'Sn': 3.0}",GGA,mp-633,"['mp-991111', 'mp-993073', 'mp-633', 'mp-1066557', 'mp-1066573', 'mp-1066594', 'mp-1442023', 'mp-1688008', 'mp-1787436', 'mp-994393', 'mp-1590336', 'mp-1066601']",0.0055557,"{'La': 1.0, 'Sn': 3.0}",111.98441958300587,[],NM,False,221,0,"[0, 0, 0, 0]",4.961136576577034e-05,0.0055557,0,0.0055557,MP,data/source/MP/cleaned/cifs/MP-mp-633.cif,True,,data/final/MP/graphs/La0.87Sn3Th0.13-MP-mp-633-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Nb0.75Si0.25,1,0.0,32.0,False,Nb24Si8,Nb24Si8,9.0,Other,True,Nb75Si25,Nb-Si,2,Supercon,Nb0.75Si0.25,MP-mp-17848,Nb24Si8,Nb-Si,Nb75Si25,P 42/n,tetragonal,5.218918,10.274403,10.274403,data/final/MP/cifs/Nb0.75Si0.25-MP-mp-17848.cif,data/source/MP/raw/cifs/mp-17848.cif,mp-17848,0.0,,2014-02-15 01:14:13,7.397881014118987,10.17188/1192729,"@misc{osti_1192729,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Si (SG:86) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1192729"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1752550'}},0.0141137388541672,6.01680926,520.0,-299.87221821,-9.3710068190625,{'tags': ['Niobium silicide (3/1)']},-299.87221821,-9.3710068190625,-0.4209495340625011,"['xas', 'elasticity', 'bandstructure']",True,"[645418, 645451, 1997]",True,2021-05-12 10:56:14.760000,NM,32,12,mp-17848,,Nb3Si,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Si'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Si': 1.0}",GGA,mp-17848,"['mp-920748', 'mp-921771', 'mp-907248', 'mp-17848', 'mp-1138644', 'mp-1146511', 'mp-1200832', 'mp-1202953', 'mp-1405797', 'mp-1752550', 'mp-1933831', 'mp-1655011']",2.97625e-05,"{'Nb': 24.0, 'Si': 8.0}",550.9265040211741,[],NM,False,86,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.321810591106522e-07,2.97625e-05,0,0.0002381,MP,data/source/MP/cleaned/cifs/MP-mp-17848.cif,False,,data/final/MP/graphs/Nb0.75Si0.25-MP-mp-17848.json,0,True,4/m,0,0,0,0,3,0,0,1,0,0,0,1.0,False
Er1Ga6,1,0.0,2.0,False,Er2Ga12,Er2Ga12,0.0,Other,True,Er14.286Ga85.714,Er-Ga,2,Supercon,Er1Ga6,MP-mp-1103883,Er2Ga12,Er-Ga,Er14.286Ga85.714,P 4/n b m,tetragonal,5.990683,5.990683,7.545942,data/final/MP/cifs/Er1Ga6-MP-mp-1103883.cif,data/source/MP/raw/cifs/mp-1103883.cif,mp-1103883,0.0,,2018-07-18 19:53:09,7.181444276092567,,,{'GGA': {'task_id': 'mp-1670014'}},0.0212312389285718,3.86109552,520.0,-49.38859693,-3.5277569235714283,{'tags': ['Erbium gallium (1/6)']},-49.38859693,-3.5277569235714283,-0.2797147885714283,['bandstructure'],True,[630541],True,2021-05-12 10:58:20.361000,NM,14,4,mp-1103883,,ErGa6,"{'functional': 'PBE', 'labels': ['Er_3', 'Ga_d'], 'pot_type': 'paw'}","{'Er': 1.0, 'Ga': 6.0}",GGA,mp-1103883,"['mp-1103883', 'mp-1425766', 'mp-1670014', 'mp-1604189']",2.435e-05,"{'Er': 2.0, 'Ga': 12.0}",270.8109005373632,[],NM,False,111,0,"[0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",1.798302797389833e-07,2.435e-05,0,4.87e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1103883.cif,False,,data/final/MP/graphs/Er1Ga6-MP-mp-1103883.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
K0.3Mo1O3,2,1.290957005378089e-16,10.0,False,K3Mo10O30,K3Mo10O30,0.0,Oxide,True,K6.977Mo23.256O69.76744186046513,K-Mo-O,3,Supercon,K0.3Mo1O3,MP-mp-541614,K3Mo10O30,K-Mo-O,K6.977Mo23.256O69.76744186046513,C 1 2/m 1,monoclinic,7.696573999178661,10.23248438,10.25319979,data/final/MP/cifs/K0.3Mo1O3-MP-mp-541614.cif,data/source/MP/raw/cifs/mp-541614.cif,mp-541614,0.0515000000000003,,2013-06-09 00:46:52,3.9543657920070814,,,{'GGA+U': {'task_id': 'mp-1678984'}},0.0203101256021565,2.06199772,520.0,-293.95204321,-6.836094028139535,{'tags': ['Potassium molybdenum oxide (0.3/1/3)']},-293.95204321,-6.836094028139535,-2.0082694399767447,"['xas', 'bandstructure']",True,"[100327, 73508, 62828, 73509]",True,2021-05-12 10:57:21.195000,FM,43,10,mp-541614,oxide,K3(MoO3)10,"{'functional': 'PBE', 'labels': ['K_sv', 'Mo_pv', 'O'], 'pot_type': 'paw'}","{'K': 3.0, 'Mo': 10.0, 'O': 30.0}",GGA+U,mp-541614,"['mp-922513', 'mp-923231', 'mp-615973', 'mp-561164', 'mp-907830', 'mp-541614', 'mp-1375704', 'mp-1655950', 'mp-1678984', 'mp-1887601']",2.9835081,"{'K': 3.0, 'Mo': 10.0, 'O': 30.0}",653.6883390374909,[],FM,True,12,3,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.6, 0.6, 0.6, 0.6, 0.4, 0.4, 0.4, 0.4, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0045641140002481,2.9835081,8,2.9835081,MP,data/source/MP/cleaned/cifs/MP-mp-541614.cif,False,,data/final/MP/graphs/K0.3Mo1O3-MP-mp-541614.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
K2Mo6Se6,1,0.0,1.0,True,K2Mo6Se6,K2Mo6Se6,0.0,Chevrel,True,K14.286Mo42.857Se42.857,K-Mo-Se,3,Supercon,K2Mo6Se6,MP-mp-1104242,K2Mo6Se6,K-Mo-Se,K14.286Mo42.857Se42.857,P 63/m,hexagonal,4.530113,9.210482001080134,9.21048166,data/final/MP/cifs/K2Mo6Se6-MP-mp-1104242.cif,data/source/MP/raw/cifs/mp-1104242.cif,mp-1104242,0.4801999999999999,,2018-07-18 21:30:24,5.625984007329605,,,{'GGA': {'task_id': 'mp-1672519'}},0.0,4.27550267,520.0,-98.17477063,-7.012483616428571,"{'tags': ['Potassium molybdenum selenide (1/3/3)', 'TlFe3Te3', 'Potassium molybdenum(I/II) selenide (1/3/3)', 'KMo3Se3', 'Chevrel phase']}",-98.17477063,-7.012483616428571,-0.9097604064330348,['bandstructure'],True,"[603628, 641256, 604517]",True,2021-05-12 10:58:20.361000,NM,14,8,mp-1104242,,K(MoSe)3,"{'functional': 'PBE', 'labels': ['K_sv', 'Mo_pv', 'Se'], 'pot_type': 'paw'}","{'K': 1.0, 'Mo': 3.0, 'Se': 3.0}",GGA,mp-1104242,"['mp-1104242', 'mp-1104446', 'mp-1104900', 'mp-1184800', 'mp-1421602', 'mp-1672519', 'mp-1809488', 'mp-1604216']",0.0002601,"{'K': 2.0, 'Mo': 6.0, 'Se': 6.0}",332.8161266057498,[],NM,False,176,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.5630252214797963e-06,0.0002601,0,0.0005202,MP,data/source/MP/cleaned/cifs/MP-mp-1104242.cif,False,,data/final/MP/graphs/K2Mo6Se6-MP-mp-1104242.json,0,True,6/m,0,3,0,0,0,0,0,1,0,0,0,1.0,False
As1Ce1Fe1O1,1,0.0,2.0,False,As2Ce2Fe2O2,As2Ce2Fe2O2,0.0,Ferrite,True,As25Ce25Fe25O25,As-Ce-Fe-O,4,Supercon,Ce1Fe1As1O1,MP-mp-605060,Ce2Fe2As2O2,As-Ce-Fe-O,As25Ce25Fe25O25,P 4 m m,tetragonal,3.992256,3.992256,9.041971,data/final/MP/cifs/As1Ce1Fe1O1-MP-mp-605060.cif,data/source/MP/raw/cifs/mp-605060.cif,mp-605060,0.0,,2014-02-14 20:12:08,6.611233843492404,10.17188/1277425,"@misc{osti_1277425,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeFeAsO (SG:99) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277425"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-1751604'}},0.2072581873958352,6.30288445,520.0,-55.74271596,-6.967839495,{'tags': []},-55.74271596,-6.967839495,-1.7010452412499992,['bandstructure'],True,[],True,2021-05-12 10:58:51.532000,FiM,8,10,mp-605060,oxide,CeFeAsO,"{'functional': 'PBE', 'labels': ['Ce', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-605060,"['mp-605060', 'mp-917114', 'mp-918266', 'mp-919274', 'mp-1443189', 'mp-1751604', 'mp-1770633', 'mp-1779614', 'mp-1873964', 'mp-1622328']",2.99945325,"{'Ce': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",144.11191005541338,[],FiM,True,99,3,"[-0.5, -0.5, 3.5, 3.5, 0.0, 0.0, 0.0, 0.0]",0.0416267225775671,2.99945325,4,5.9989065,MP,data/source/MP/cleaned/cifs/MP-mp-605060.cif,False,,data/final/MP/graphs/As1Ce1Fe1O1-MP-mp-605060.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
Mn1Ni1Zr1,1,0.0,4.0,False,Mn4Ni4Zr4,Mn4Ni4Zr4,0.0,Other,True,Mn33.333Ni33.333Zr33.333,Mn-Ni-Zr,3,Supercon,Mn1Ni1Zr1,MP-mp-1215315,Zr4Mn4Ni4,Mn-Ni-Zr,Mn33.333Ni33.333Zr33.333,A m m 2,orthorhombic,4.866293997301916,5.0038858,8.054999,data/final/MP/cifs/Mn1Ni1Zr1-MP-mp-1215315.cif,data/source/MP/raw/cifs/mp-1215315.cif,mp-1215315,0.0,,2019-01-12 17:01:31.061000,7.938965988349907,,,{'GGA': {'task_id': 'mp-1742370'}},0.0427260795833337,6.06209534,520.0,-97.31647838,-8.109706531666667,{'tags': []},-97.31647838,-8.109706531666667,-0.2797556643103457,[],False,[],True,2021-05-12 11:00:37.845000,FiM,12,5,mp-1215315,,ZrMnNi,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Mn_pv', 'Ni_pv'], 'pot_type': 'paw'}","{'Zr': 1.0, 'Mn': 1.0, 'Ni': 1.0}",GGA,mp-1215315,"['mp-1215315', 'mp-1384269', 'mp-1655659', 'mp-1742370', 'mp-1833977']",0.122933125,"{'Zr': 4.0, 'Mn': 4.0, 'Ni': 4.0}",171.39283374052147,[],FiM,True,38,2,"[0.0, 0.0, 0.0, 0.0, 0.5, 0.5, -0.1, -0.1, 0.0, 0.0, 0.0, -0.0]",0.0028690376911817,0.122933125,4,0.4917325,MP,data/source/MP/cleaned/cifs/MP-mp-1215315.cif,False,,data/final/MP/graphs/Mn1Ni1Zr1-MP-mp-1215315.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
In2Mo15Se19,1,0.0,2.0,False,In4Mo30Se38,In4Mo30Se38,1.5,Chevrel,True,In5.556Mo41.667Se52.778,In-Mo-Se,3,Supercon,In2Mo15Se19,MP-mp-1199774,In4Mo30Se38,In-Mo-Se,In5.556Mo41.667Se52.778,R -3 c,trigonal,9.792137947069463,9.792137947069463,20.38791292,data/final/MP/cifs/In2Mo15Se19-MP-mp-1199774.cif,data/source/MP/raw/cifs/mp-1199774.cif,mp-1199774,0.0,,2019-01-12 04:18:23.028000,6.470139237994234,,,,0.041628213472225,4.43981731,520.0,-504.62875925,-7.008732767361111,{'tags': ['Indium molybdenum selenide (2/15/19)']},-504.62875925,-7.008732767361111,-0.7408902399869786,[],False,"[26546, 640011, 640010]",True,2021-05-12 11:00:08.243000,NM,72,2,mp-1199774,,In2Mo15Se19,"{'functional': 'PBE', 'labels': ['In_d', 'Mo_pv', 'Se'], 'pot_type': 'paw'}","{'In': 2.0, 'Mo': 15.0, 'Se': 19.0}",GGA,mp-1199774,"['mp-1199774', 'mp-1330948']",0.11847395,"{'In': 4.0, 'Mo': 30.0, 'Se': 38.0}",1626.6136648858592,[],NM,False,167,0,"[0.0, 0.0, 0.0, 0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001456694389793,0.11847395,0,0.2369479,MP,data/source/MP/cleaned/cifs/MP-mp-1199774.cif,False,,data/final/MP/graphs/In2Mo15Se19-MP-mp-1199774.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Cu1La1.983Sr0.017O4,2,0.0048571428571428,1.0,True,Cu1La1.983Sr0.017O4,Cu1La2O4,0.0,Cuprate,True,Cu14.286La28.329Sr0.243O57.142857142857146,Cu-La-Sr-O,4,Supercon,La1.983Sr0.017Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La1.983Sr0.017O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La1.983Sr0.017O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ba2Ca0.8Cu2Gd0.2Tl1O7,3,0.0307692307692307,1.0,True,Ba2Ca0.8Cu2Gd0.2Tl1O7,Ba2Ca1Cu2Tl1O7,93.6,Cuprate,True,Ba15.385Ca6.154Cu15.385Gd1.538Tl7.692O53.84615384615385,Ba-Ca-Cu-Gd-Tl-O,6,Supercon,Tl1Ba2Ca0.8Gd0.2Cu2O7,MP-mp-632802,Ba2Ca1Tl1Cu2O7,Ba-Ca-Cu-Tl-O,Ba15.385Ca7.692Cu15.385Tl7.692O53.84615384615385,P 4/m m m,tetragonal,3.840502,3.840502,13.048748,data/final/MP/cifs/Ba2Ca0.8Cu2Gd0.2Tl1O7-MP-mp-632802-synth_doped.cif,data/source/MP/raw/cifs/mp-632802.cif,mp-632802,0.0,,2013-06-21 12:28:47,6.541687864051921,10.17188/1279349,"@misc{osti_1279349,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2CaTlCu2O7 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1279349"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1742071'}},0.0444125982158123,2.89241018,520.0,-71.95529719,-5.535022860769231,{'tags': ['Thallium(III) calcium barium copper oxide (1/1/2/2/7)']},-71.95529719,-5.535022860769231,-1.978767086794871,"['xas', 'bandstructure']",True,[67128],True,2021-05-12 10:57:30.779000,NM,13,10,mp-632802,oxide,Ba2CaTlCu2O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ca_sv', 'Tl_d', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Ca': 1.0, 'Tl': 1.0, 'Cu': 2.0, 'O': 7.0}",GGA,mp-632802,"['mp-699409', 'mp-632802', 'mp-732256', 'mp-743134', 'mp-1182322', 'mp-1394572', 'mp-1742071', 'mp-1785618', 'mp-1654627', 'mp-749845']",0.0282595,"{'Ba': 2.0, 'Ca': 1.0, 'Tl': 1.0, 'Cu': 2.0, 'O': 7.0}",192.461929418226,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.000146831636186,0.0282595,0,0.0282595,MP,data/source/MP/cleaned/cifs/MP-mp-632802.cif,True,,data/final/MP/graphs/Ba2Ca0.8Cu2Gd0.2Tl1O7-MP-mp-632802-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B6Dy1,1,0.0,1.0,True,B6Dy1,B6Dy1,0.0,Other,True,B85.714Dy14.286,B-Dy,2,Supercon,B6Dy1,MP-mp-568319,Dy1B6,B-Dy,B85.714Dy14.286,P m -3 m,cubic,4.094934,4.094934,4.094934,data/final/MP/cifs/B6Dy1-MP-mp-568319.cif,data/source/MP/raw/cifs/mp-568319.cif,mp-568319,0.0,,2014-02-16 09:28:48,5.498369218571405,10.17188/1274357,"@misc{osti_1274357,
    author = ""Persson, Kristin"",
    title = ""Materials Data on DyB6 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1274357"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704333'}},0.0355234426785715,6.58964197,520.0,-47.48385594,-6.783407991428571,"{'tags': ['Dysprosium boride (1/6)', 'Dysprosium octahedro-hexaboride']}",-47.48385594,-6.783407991428571,-0.4001026392857137,"['xas', 'elasticity', 'bandstructure']",True,"[613601, 613595, 150623]",True,2021-05-12 10:56:22.739000,NM,7,8,mp-568319,,DyB6,"{'functional': 'PBE', 'labels': ['Dy_3', 'B'], 'pot_type': 'paw'}","{'Dy': 1.0, 'B': 6.0}",GGA,mp-568319,"['mp-1001184', 'mp-1007546', 'mp-568319', 'mp-1441135', 'mp-1704333', 'mp-1781564', 'mp-1012302', 'mp-1592401']",6.72e-05,"{'Dy': 1.0, 'B': 6.0}",68.66583716156319,[],NM,False,221,0,"[0, 0, 0, 0, 0, 0, 0]",9.786525989901756e-07,6.72e-05,0,6.72e-05,MP,data/source/MP/cleaned/cifs/MP-mp-568319.cif,False,,data/final/MP/graphs/B6Dy1-MP-mp-568319.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Cu3La0.5Pr0.5O7,1,0.0,2.0,False,Ba4Cu6La1Pr1O14,Ba4Cu6La1Pr1O14,51.7,Cuprate,True,Ba15.385Cu23.077La3.846Pr3.846O53.84615384615385,Ba-Cu-La-Pr-O,5,Supercon,La0.5Pr0.5Ba2Cu3O7,MP-mp-1228253,Ba4La1Pr1Cu6O14,Ba-Cu-La-Pr-O,Ba15.385Cu23.077La3.846Pr3.846O53.84615384615385,P m m m,orthorhombic,3.905432,3.977981,23.854019,data/final/MP/cifs/Ba2Cu3La0.5Pr0.5O7-MP-mp-1228253.cif,data/source/MP/raw/cifs/mp-1228253.cif,mp-1228253,0.0,,2019-01-13 03:59:16.220000,6.427211818969123,,,{'GGA': {'task_id': 'mp-1681296'}},0.0269668878044804,3.53296398,520.0,-157.72373695,-6.066297574999999,{'tags': []},-157.72373695,-6.066297574999999,-2.1570097419230763,[],False,[],True,2021-05-12 11:00:59.151000,NM,26,4,mp-1228253,oxide,Ba4LaPr(Cu3O7)2,"{'functional': 'PBE', 'labels': ['Ba_sv', 'La', 'Pr_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 4.0, 'La': 1.0, 'Pr': 1.0, 'Cu': 6.0, 'O': 14.0}",GGA,mp-1228253,"['mp-1228253', 'mp-1346084', 'mp-1681296', 'mp-1844089']",0.0009849,"{'Ba': 4.0, 'La': 1.0, 'Pr': 1.0, 'Cu': 6.0, 'O': 14.0}",370.589700999212,[],NM,False,47,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.657656155431298e-06,0.0009849,0,0.0009849,MP,data/source/MP/cleaned/cifs/MP-mp-1228253.cif,False,,data/final/MP/graphs/Ba2Cu3La0.5Pr0.5O7-MP-mp-1228253.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Si0.45Zr0.55,3,0.1,8.0,False,Si3.6Zr4.4,Si4Zr4,0.0,Other,True,Si45Zr55,Si-Zr,2,Supercon,Si0.45Zr0.55,MP-mp-893,Zr4Si4,Si-Zr,Si50Zr50,P n m a,orthorhombic,3.803331,5.328118,7.030146,data/final/MP/cifs/Si0.45Zr0.55-MP-mp-893-synth_doped.cif,data/source/MP/raw/cifs/mp-893.cif,mp-893,0.0,,2011-05-13 11:07:54,5.5626509889834965,10.17188/1312835,"@misc{osti_1312835,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrSi (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1312835"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698212'}},0.0,6.90800899,520.0,-63.35876587,-7.91984573375,"{'tags': ['Zirconium silicide', 'Zirconium silicide (1/1)']}",-63.35876587,-7.91984573375,-0.8978384087500002,"['xas', 'elasticity', 'bandstructure']",True,"[652609, 16771, 652613, 43245]",True,2021-05-12 10:56:33.121000,NM,8,10,mp-893,,ZrSi,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Si'], 'pot_type': 'paw'}","{'Zr': 1.0, 'Si': 1.0}",GGA,mp-893,"['mp-912244', 'mp-928807', 'mp-928271', 'mp-893', 'mp-1125250', 'mp-1138328', 'mp-1431730', 'mp-1698212', 'mp-1780493', 'mp-1588280']",0.0008038,"{'Zr': 4.0, 'Si': 4.0}",142.46307104930645,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0]",2.256865569665573e-05,0.0008038,0,0.0032152,MP,data/source/MP/cleaned/cifs/MP-mp-893.cif,True,,data/final/MP/graphs/Si0.45Zr0.55-MP-mp-893-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
C1Mo0.05Nb0.95,2,0.05,1.0,True,C1Mo0.05Nb0.95,C1Nb1,12.1,Other,True,C50Mo2.5Nb47.5,C-Mo-Nb,3,Supercon,Nb0.95Mo0.05C1,MP-mp-910,Nb1C1,C-Nb,C50Nb50,F m -3 m,cubic,3.18634336,3.1863433599999995,3.1863433599999995,data/final/MP/cifs/C1Mo0.05Nb0.95-MP-mp-910-synth_doped.cif,data/source/MP/raw/cifs/mp-910.cif,mp-910,0.0,,2011-05-12 17:28:40,7.616098778357742,10.17188/1282001,"@misc{osti_1282001,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbC (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1282001"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686610'}},0.0408750508333302,7.39992982,520.0,-20.24633413,-10.123167065,"{'tags': ['Niobium carbide (1/1)', 'Niobium carbide (1/1) - RS-type']}",-20.24633413,-10.123167065,-0.4591241950000011,"['xas', 'elasticity', 'bandstructure']",True,"[618465, 77214, 187077, 618456, 181792, 618453, 94449, 618472, 183163, 237582, 618457, 159872, 618480, 618475, 618482, 618469, 155164, 618466, 44355, 618450, 618458, 618449, 44496, 618463, 618462, 618460, 618481, 618471, 618476, 181052, 601142, 618448, 189089, 618478, 26955, 618473, 618484, 618483]",True,2021-05-12 10:56:35.166000,NM,2,25,mp-910,,NbC,"{'functional': 'PBE', 'labels': ['Nb_pv', 'C'], 'pot_type': 'paw'}","{'Nb': 1.0, 'C': 1.0}",GGA,mp-910,"['mp-1000444', 'mp-1001333', 'mp-910', 'mp-1057158', 'mp-1057178', 'mp-1057130', 'mp-1057651', 'mp-1057669', 'mp-1057682', 'mp-1057771', 'mp-1057779', 'mp-1057802', 'mp-1060960', 'mp-1060978', 'mp-1061015', 'mp-1440938', 'mp-1686610', 'mp-1805660', 'mp-1007673', 'mp-1593845', 'mp-1596940', 'mp-1061007', 'mp-1057677', 'mp-1057792', 'mp-1057174']",3.33e-05,"{'Nb': 1.0, 'C': 1.0}",22.87508541625878,[],NM,False,225,0,"[0, 0]",1.4557322691495426e-06,3.33e-05,0,3.33e-05,MP,data/source/MP/cleaned/cifs/MP-mp-910.cif,True,,data/final/MP/graphs/C1Mo0.05Nb0.95-MP-mp-910-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ag0.85Se2Sn1.15,3,0.0749999999999999,1.0,True,Ag0.85Se2Sn1.15,Ag1Se2Sn1,6.175,Other,True,Ag21.25Se50Sn28.75,Ag-Se-Sn,3,Supercon,Ag0.85Sn1.15Se2,MP-mp-1229011,Ag1Sn1Se2,Ag-Se-Sn,Ag25Se50Sn25,R -3 m,trigonal,4.0598026973764,4.0598026973764,7.0325229,data/final/MP/cifs/Ag0.85Se2Sn1.15-MP-mp-1229011-synth_doped.cif,data/source/MP/raw/cifs/mp-1229011.cif,mp-1229011,0.0,,2019-01-13 04:39:21.201000,6.746249424080593,,,{'GGA': {'task_id': 'mp-1766738'}},0.0,4.6965768,520.0,-14.98910359,-3.7472758975,{'tags': []},-14.98910359,-3.7472758975,-0.5247881940885413,['bandstructure'],True,[],True,2021-05-12 10:58:49.477000,NM,4,5,mp-1229011,,AgSnSe2,"{'functional': 'PBE', 'labels': ['Ag', 'Sn_d', 'Se'], 'pot_type': 'paw'}","{'Ag': 1.0, 'Sn': 1.0, 'Se': 2.0}",GGA,mp-1229011,"['mp-1229011', 'mp-1422543', 'mp-1766738', 'mp-1796245', 'mp-1612963']",0.0080447,"{'Ag': 1.0, 'Sn': 1.0, 'Se': 2.0}",94.64136915222257,[],NM,False,166,0,"[0, 0, 0, 0]",8.50019401881305e-05,0.0080447,0,0.0080447,MP,data/source/MP/cleaned/cifs/MP-mp-1229011.cif,True,,data/final/MP/graphs/Ag0.85Se2Sn1.15-MP-mp-1229011-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
C0.85Nb2S1,3,0.0584415584415584,2.0,False,C1.7Nb4S2,C2Nb4S2,4.68,Other,True,C22.078Nb51.948S25.974,C-Nb-S,3,Supercon,Nb2S1C0.85,MP-mp-9988,Nb4C2S2,C-Nb-S,C25Nb50S25,P 63/m m c,hexagonal,3.343598003728437,3.34359817,11.580941,data/final/MP/cifs/C0.85Nb2S1-MP-mp-9988-synth_doped.cif,data/source/MP/raw/cifs/mp-9988.cif,mp-9988,0.0,,2011-05-28 14:17:21,6.80916159531999,10.17188/1317400,"@misc{osti_1317400,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb2CS (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1317400"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703916'}},0.0247363409375012,7.73433733,520.0,-73.20869059,-9.15108632375,"{'tags': ['Niobium sulfide carbide (2/1/1)', 'Diniobium sulfide carbide']}",-73.20869059,-9.15108632375,-0.8853761620312515,"['xas', 'elasticity', 'bandstructure']",True,"[43010, 180619]",True,2021-05-12 10:56:37.246000,NM,8,8,mp-9988,,Nb2CS,"{'functional': 'PBE', 'labels': ['Nb_pv', 'C', 'S'], 'pot_type': 'paw'}","{'Nb': 2.0, 'C': 1.0, 'S': 1.0}",GGA,mp-9988,"['mp-909913', 'mp-925443', 'mp-9988', 'mp-925879', 'mp-1415588', 'mp-1703916', 'mp-1802770', 'mp-1593375']",0.00040745,"{'Nb': 4.0, 'C': 2.0, 'S': 2.0}",112.12504313391082,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",7.267778697991365e-06,0.00040745,0,0.0008149,MP,data/source/MP/cleaned/cifs/MP-mp-9988.cif,True,,data/final/MP/graphs/C0.85Nb2S1-MP-mp-9988-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Bi0.5Pb0.5,1,0.0,2.0,False,Bi1Pb1,Bi1Pb1,8.4,Other,True,Bi50Pb50,Bi-Pb,2,Supercon,Bi0.5Pb0.5,MP-mp-1227326,Bi1Pb1,Bi-Pb,Bi50Pb50,P -6 m 2,hexagonal,3.516368000693316,3.5163671200000004,5.970432,data/final/MP/cifs/Bi0.5Pb0.5-MP-mp-1227326.cif,data/source/MP/raw/cifs/mp-1227326.cif,mp-1227326,0.0,,2019-01-13 03:10:32.704000,10.809505812237871,,,{'GGA': {'task_id': 'mp-1734205'}},0.051447295,6.6014312,520.0,-7.49978679,-3.749893395,{'tags': []},-7.49978679,-3.749893395,0.051447295,['bandstructure'],True,[],True,2021-05-12 10:58:49.477000,NM,2,5,mp-1227326,,BiPb,"{'functional': 'PBE', 'labels': ['Bi', 'Pb_d'], 'pot_type': 'paw'}","{'Bi': 1.0, 'Pb': 1.0}",GGA,mp-1227326,"['mp-1227326', 'mp-1415472', 'mp-1734205', 'mp-1793117', 'mp-1609931']",0.0053651,"{'Bi': 1.0, 'Pb': 1.0}",63.93297019839806,[],NM,False,187,0,"[0, 0]",8.391757779047205e-05,0.0053651,0,0.0053651,MP,data/source/MP/cleaned/cifs/MP-mp-1227326.cif,False,,data/final/MP/graphs/Bi0.5Pb0.5-MP-mp-1227326.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
B2Lu1Rh3,1,0.0,1.0,True,B2Lu1Rh3,B2Lu1Rh3,0.0,Other,True,B33.333Lu16.667Rh50,B-Lu-Rh,3,Supercon,Lu1Rh3B2,MP-mp-1025024,Lu1B2Rh3,B-Lu-Rh,B33.333Lu16.667Rh50,P 6/m m m,hexagonal,3.118804,5.403813998181986,5.40381469,data/final/MP/cifs/B2Lu1Rh3-MP-mp-1025024.cif,data/source/MP/raw/cifs/mp-1025024.cif,mp-1025024,0.0,,2016-09-27 05:43:15,10.63857721824372,10.17188/1355488,"@article{osti_1355488,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LuB2Rh3 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1355488"",
    place = ""United States"",
    year = ""2017"",
    month = ""5""
}
",{'GGA': {'task_id': 'mp-1700098'}},0.024255737333334,6.3093766,520.0,-44.20958464,-7.368264106666667,"{'tags': ['LuRh3B2', 'Lutetium rhodium boride (1/3/2)', 'ErIr3B2']}",-44.20958464,-7.368264106666667,-0.7061544947222226,['bandstructure'],True,[614701],True,2021-05-12 10:58:09.072000,NM,6,5,mp-1025024,,LuB2Rh3,"{'functional': 'PBE', 'labels': ['Lu_3', 'B', 'Rh_pv'], 'pot_type': 'paw'}","{'Lu': 1.0, 'B': 2.0, 'Rh': 3.0}",GGA,mp-1025024,"['mp-1025024', 'mp-1504055', 'mp-1700098', 'mp-1800238', 'mp-1596029']",0.000749,"{'Lu': 1.0, 'B': 2.0, 'Rh': 3.0}",78.87140414593583,[],NM,False,191,0,"[0, 0, 0, 0, 0, 0]",9.496470972091794e-06,0.000749,0,0.000749,MP,data/source/MP/cleaned/cifs/MP-mp-1025024.cif,False,,data/final/MP/graphs/B2Lu1Rh3-MP-mp-1025024.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
B2Ho1Ir3,1,0.0,1.0,True,B2Ho1Ir3,B2Ho1Ir3,0.0,Other,True,B33.333Ho16.667Ir50,B-Ho-Ir,3,Supercon,Ho1Ir3B2,MP-mp-1072182,Ho1B2Ir3,B-Ho-Ir,B33.333Ho16.667Ir50,P 6/m m m,hexagonal,3.146189,5.468428000972193,5.46842751,data/final/MP/cifs/B2Ho1Ir3-MP-mp-1072182.cif,data/source/MP/raw/cifs/mp-1072182.cif,mp-1072182,0.0,,2018-03-22 08:28:47,15.554246012221014,,,{'GGA': {'task_id': 'mp-1688076'}},0.0,7.77628827,520.0,-48.62921153,-8.104868588333334,"{'tags': ['HoIr3B2', 'Holmium iridium boride (1/3/2)', 'ErIr3B2']}",-48.62921153,-8.104868588333334,-0.6954546430555553,['bandstructure'],True,[614472],True,2021-05-12 10:58:14.654000,NM,6,8,mp-1072182,,HoB2Ir3,"{'functional': 'PBE', 'labels': ['Ho_3', 'B', 'Ir'], 'pot_type': 'paw'}","{'Ho': 1.0, 'B': 2.0, 'Ir': 3.0}",GGA,mp-1072182,"['mp-1072209', 'mp-1072182', 'mp-1072234', 'mp-1299924', 'mp-1688076', 'mp-1798526', 'mp-1597181', 'mp-1072229']",8.02e-05,"{'Ho': 1.0, 'B': 2.0, 'Ir': 3.0}",81.47800463121628,[],NM,False,191,0,"[0, 0, 0, 0, 0, 0]",9.843147284104371e-07,8.02e-05,0,8.02e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1072182.cif,False,,data/final/MP/graphs/B2Ho1Ir3-MP-mp-1072182.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Al3La0.3Pd2U0.7,3,0.1,1.0,True,Al3La0.3Pd2U0.7,Al3Pd2U1,1.2,Heavy_fermion,True,Al50La5Pd33.333U11.667,Al-La-Pd-U,4,Supercon,U0.7La0.3Pd2Al3,MP-mp-4561,U1Al3Pd2,Al-Pd-U,Al50Pd33.333U16.667,P 6/m m m,hexagonal,4.239652,5.384229999094356,5.3842309,data/final/MP/cifs/Al3La0.3Pd2U0.7-MP-mp-4561-synth_doped.cif,data/source/MP/raw/cifs/mp-4561.cif,mp-4561,0.0,,2011-05-12 23:59:10,8.296603403902926,10.17188/1208253,"@misc{osti_1208253,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UAl3Pd2 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208253"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700804'}},0.0796314472916668,8.0468212,520.0,-36.36476907,-6.060794845,"{'tags': ['Aluminium palladium uranium (3/2/1)', 'Aluminum palladium uranium (3/2/1)']}",-36.36476907,-6.060794845,-0.5794779916666665,"['xas', 'elasticity', 'bandstructure']",True,"[657574, 106242, 659234]",True,2021-05-12 10:56:20.740000,FM,6,9,mp-4561,,UAl3Pd2,"{'functional': 'PBE', 'labels': ['U', 'Al', 'Pd'], 'pot_type': 'paw'}","{'U': 1.0, 'Al': 3.0, 'Pd': 2.0}",GGA,mp-4561,"['mp-4561', 'mp-991619', 'mp-993538', 'mp-1251974', 'mp-1441898', 'mp-1700804', 'mp-1933710', 'mp-994863', 'mp-1593816']",2.2050571,"{'U': 1.0, 'Al': 3.0, 'Pd': 2.0}",106.4408038742404,[],FM,True,191,1,"[2.2, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0207162762750765,2.2050571,1,2.2050571,MP,data/source/MP/cleaned/cifs/MP-mp-4561.cif,True,,data/final/MP/graphs/Al3La0.3Pd2U0.7-MP-mp-4561-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ce0.805Ru0.195,2,0.01,10.0,False,Ce8.05Ru1.95,Ce8Ru2,0.0,Heavy_fermion,True,Ce80.5Ru19.5,Ce-Ru,2,Supercon,Ce0.805Ru0.195,MP-mp-1214027,Ce8Ru2,Ce-Ru,Ce80Ru20,F d -3 m,cubic,7.387851650000001,7.38785165,7.38785165,data/final/MP/cifs/Ce0.805Ru0.195-MP-mp-1214027-synth_doped.cif,data/source/MP/raw/cifs/mp-1214027.cif,mp-1214027,0.0,,2019-01-12 15:56:35.950000,7.7053392158128675,,,,0.4235548595555549,7.46950524,520.0,-63.61565687,-6.361565687000001,"{'tags': ['MgCu2', 'Friauf-Laves phase, Frank-Kasper phase', 'CeRu2 rt']}",-63.61565687,-6.361565687000001,0.2397835679999992,[],False,[],True,2021-05-12 11:00:35.508000,FM,10,2,mp-1214027,,Ce4Ru,"{'functional': 'PBE', 'labels': ['Ce', 'Ru_pv'], 'pot_type': 'paw'}","{'Ce': 4.0, 'Ru': 1.0}",GGA,mp-1214027,"['mp-1214027', 'mp-1929148']",2.28937645,"{'Ce': 8.0, 'Ru': 2.0}",285.12775884800004,[],FM,True,227,1,"[0.5, 0.5, 0.5, 0.5, 0.5, 0.5, 0.5, 0.5, -0.0, -0.0]",0.0160586009531288,2.28937645,8,4.5787529,MP,data/source/MP/cleaned/cifs/MP-mp-1214027.cif,True,,data/final/MP/graphs/Ce0.805Ru0.195-MP-mp-1214027-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Bi0.26Tl0.74,2,0.02,8.0,False,Bi2.08Tl5.92,Bi2Tl6,4.275,Other,True,Bi26Tl74,Bi-Tl,2,Supercon,Bi0.26Tl0.74,MP-mp-1006059,Tl6Bi2,Bi-Tl,Bi25Tl75,P 63/m m c,hexagonal,5.389167,7.458110001013889,7.45811024,data/final/MP/cifs/Bi0.26Tl0.74-MP-mp-1006059-synth_doped.cif,data/source/MP/raw/cifs/mp-1006059.cif,mp-1006059,0.0,,2016-09-01 15:25:17,10.517436213013116,10.17188/1314959,"@misc{osti_1314959,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Tl3Bi (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1314959"",
    place = ""United States"",
    year = ""2016"",
    month = ""9"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1733020'}},0.0,5.46670911,520.0,-22.24317093,-2.78039636625,{'tags': []},-22.24317093,-2.78039636625,-0.03590542875,['bandstructure'],True,[],True,2021-05-12 10:58:09.072000,NM,8,8,mp-1006059,,Tl3Bi,"{'functional': 'PBE', 'labels': ['Tl_d', 'Bi'], 'pot_type': 'paw'}","{'Tl': 3.0, 'Bi': 1.0}",GGA,mp-1006059,"['mp-1011187', 'mp-1006059', 'mp-1012882', 'mp-1444057', 'mp-1733020', 'mp-1775716', 'mp-1655074', 'mp-1012938']",0.0010191,"{'Tl': 6.0, 'Bi': 2.0}",259.6030921103102,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",7.851216190960973e-06,0.0010191,0,0.0020382,MP,data/source/MP/cleaned/cifs/MP-mp-1006059.cif,True,,data/final/MP/graphs/Bi0.26Tl0.74-MP-mp-1006059-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ba0.119Cu1La1.881O4,2,0.0339999999999999,1.0,True,Ba0.119Cu1La1.881O4,Cu1La2O4,9.3,Cuprate,True,Ba1.7Cu14.286La26.871O57.142857142857146,Ba-Cu-La-O,4,Supercon,La1.881Ba0.119Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ba0.119Cu1La1.881O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ba0.119Cu1La1.881O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ni25Th75,3,0.1,0.1866733333333333,False,Ni4.667Th14,Ni6Th14,3.7,Other,True,Ni25Th75,Ni-Th,2,Supercon,Ni25Th75,MP-mp-30809,Th14Ni6,Ni-Th,Ni30Th70,P 63 m c,hexagonal,6.214559,9.826367997383215,9.82636859,data/final/MP/cifs/Ni25Th75-MP-mp-30809-synth_doped.cif,data/source/MP/raw/cifs/mp-30809.cif,mp-30809,0.0,,2014-02-20 07:42:51,11.50557133965162,10.17188/1205171,"@misc{osti_1205171,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Th7Ni3 (SG:186) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1205171"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1711551'}},0.0,7.74894139,520.0,-144.03656432,-7.201828216,"{'tags': ['Nickel thorium (3/7)', 'Thorium nickel (7/3)']}",-144.03656432,-7.201828216,-0.2780864370000003,"['xas', 'bandstructure']",True,"[646939, 646929, 105406]",True,2021-05-12 10:57:04.957000,NM,20,10,mp-30809,,Th7Ni3,"{'functional': 'PBE', 'labels': ['Th', 'Ni_pv'], 'pot_type': 'paw'}","{'Th': 7.0, 'Ni': 3.0}",GGA,mp-30809,"['mp-912715', 'mp-929098', 'mp-929549', 'mp-30809', 'mp-1189629', 'mp-1190345', 'mp-1475800', 'mp-1711551', 'mp-1928461', 'mp-1584243']",0.00847395,"{'Th': 14.0, 'Ni': 6.0}",519.6692641639447,[],NM,False,156,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, 0.0, 0.0, -0.0, -0.0, 0.0]",3.261285815559277e-05,0.00847395,0,0.0169479,MP,data/source/MP/cleaned/cifs/MP-mp-30809.cif,True,,data/final/MP/graphs/Ni25Th75-MP-mp-30809-synth_doped.json,0,True,6mm,0,5,0,0,0,0,0,1,0,0,0,1.0,False
Ba0.123Cu1La1.877O4,2,0.0351428571428571,1.0,True,Ba0.123Cu1La1.877O4,Cu1La2O4,23.6,Cuprate,True,Ba1.757Cu14.286La26.814O57.142857142857146,Ba-Cu-La-O,4,Supercon,La1.877Ba0.123Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ba0.123Cu1La1.877O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ba0.123Cu1La1.877O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ce0.17Cu1Nd1.83O4,3,0.0485714285714285,1.0,True,Ce0.17Cu1Nd1.83O4,Cu1Nd2O4,12.8,Cuprate,True,Ce2.429Cu14.286Nd26.143O57.142857142857146,Ce-Cu-Nd-O,4,Supercon,Nd1.83Ce0.17Cu1O4,MP-mp-4158,Nd2Cu1O4,Cu-Nd-O,Cu14.286Nd28.571O57.142857142857146,I 4/m m m,tetragonal,3.973854000245551,3.973854000245551,6.78296857,data/final/MP/cifs/Ce0.17Cu1Nd1.83O4-MP-mp-4158-synth_doped.cif,data/source/MP/raw/cifs/mp-4158.cif,mp-4158,0.0,,2011-05-13 10:19:33,7.086167303782593,10.17188/1207899,"@misc{osti_1207899,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nd2CuO4 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207899"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-670050'}},0.0009497997619085,3.16510927,520.0,-51.48091453,-7.354416361428571,"{'tags': ['Dineodymium copper tetraoxide', 'Dineodymium copper oxide', 'Dineodymium cuprate', 'High pressure experimental phase']}",-51.48091453,-7.354416361428571,-2.971653917142857,"['xas', 'elasticity', 'bandstructure']",True,"[261376, 203228, 160629, 261375, 69479, 186590, 4203, 75830, 75825, 202885, 203229, 71181, 82067, 75828, 69886, 75826, 75829, 75824, 75827, 69482, 86752]",True,2021-05-12 10:56:20.740000,NM,7,11,mp-4158,oxide,Nd2CuO4,"{'functional': 'PBE', 'labels': ['Nd_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Nd': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-4158,"['mp-670050', 'mp-660368', 'mp-4158', 'mp-1078016', 'mp-1173374', 'mp-1440751', 'mp-1668619', 'mp-1797319', 'mp-1588086', 'mp-1590518', 'mp-688505']",0.0084899,"{'Nd': 2.0, 'Cu': 1.0, 'O': 4.0}",97.4899480873212,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",8.708487558528232e-05,0.0084899,0,0.0084899,MP,data/source/MP/cleaned/cifs/MP-mp-4158.cif,True,,data/final/MP/graphs/Ce0.17Cu1Nd1.83O4-MP-mp-4158-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
C0.965Mg1Ni3,2,0.0112789526686807,1.0,True,C0.965Mg1Ni3,C1Mg1Ni3,6.3,Other,True,C19.436Mg20.141Ni60.423,C-Mg-Ni,3,Supercon,Mg1C0.965Ni3,MP-mp-10700,Mg1Ni3C1,C-Mg-Ni,C20Mg20Ni60,P m -3 m,cubic,3.810209,3.810209,3.810209,data/final/MP/cifs/C0.965Mg1Ni3-MP-mp-10700-synth_doped.cif,data/source/MP/raw/cifs/mp-10700.cif,mp-10700,0.0,,2011-05-28 10:04:44,6.376007671789427,10.17188/1187303,"@misc{osti_1187303,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MgNi3C (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187303"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678621'}},0.0,6.64260176,520.0,-28.85099542,-5.770199084,{'tags': ['Magnesium nickel carbide (1/3/1)']},-28.85099542,-5.770199084,-0.1367049259999994,"['xas', 'elasticity', 'bandstructure']",True,[77152],True,2021-05-12 10:56:10.715000,NM,5,8,mp-10700,,MgNi3C,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Ni_pv', 'C'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",GGA,mp-10700,"['mp-927245', 'mp-927653', 'mp-911184', 'mp-10700', 'mp-1438083', 'mp-1678621', 'mp-1791467', 'mp-1591421']",0.0387875,"{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",55.31544309398296,[],NM,False,221,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",0.0007012056277683,0.0387875,0,0.0387875,MP,data/source/MP/cleaned/cifs/MP-mp-10700.cif,True,,data/final/MP/graphs/C0.965Mg1Ni3-MP-mp-10700-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
C6Yb1,1,0.0,2.0,False,C12Yb2,C12Yb2,6.496666667,Carbon,True,C85.714Yb14.286,C-Yb,2,Supercon,C6Yb1,MP-mp-1103975,Yb2C12,C-Yb,C85.714Yb14.286,P 63/m m c,hexagonal,4.342169996797804,4.34216954,8.76562,data/final/MP/cifs/C6Yb1-MP-mp-1103975.cif,data/source/MP/raw/cifs/mp-1103975.cif,mp-1103975,0.0,,2018-07-18 20:46:13,5.687258795714467,,,{'GGA': {'task_id': 'mp-1696153'}},0.0,5.90455479,520.0,-114.97808161,-8.212720115,"{'tags': ['YbC6', 'Ytterbium carbide (1/6)', 'BaC6', 'graphite intercalation compound']}",-114.97808161,-8.212720115,-0.0841069035714271,['bandstructure'],True,[601565],True,2021-05-12 10:58:20.361000,NM,14,5,mp-1103975,,YbC6,"{'functional': 'PBE', 'labels': ['Yb_2', 'C'], 'pot_type': 'paw'}","{'Yb': 1.0, 'C': 6.0}",GGA,mp-1103975,"['mp-1103975', 'mp-1432797', 'mp-1696153', 'mp-1939460', 'mp-1597943']",0.00075505,"{'Yb': 2.0, 'C': 12.0}",143.12874237213583,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.0550641156852535e-05,0.00075505,0,0.0015101,MP,data/source/MP/cleaned/cifs/MP-mp-1103975.cif,False,,data/final/MP/graphs/C6Yb1-MP-mp-1103975.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ru0.8Sr2Ti0.2O4,3,0.0571428571428571,1.0,True,Ru0.8Sr2Ti0.2O4,Ru1Sr2O4,0.0,Oxide,True,Ru11.429Sr28.571Ti2.857O57.142857142857146,Ru-Sr-Ti-O,4,Supercon,Sr2Ru0.8Ti0.2O4,MP-mp-4596,Sr2Ru1O4,Ru-Sr-O,Ru14.286Sr28.571O57.142857142857146,I 4/m m m,tetragonal,3.90349200031108,3.90349200031108,7.01667232,data/final/MP/cifs/Ru0.8Sr2Ti0.2O4-MP-mp-4596-synth_doped.cif,data/source/MP/raw/cifs/mp-4596.cif,mp-4596,0.0,,2011-05-13 08:08:22,5.748954439320184,10.17188/1208277,"@misc{osti_1208277,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr2RuO4 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208277"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668168'}},0.0,4.0615071,520.0,-47.01379905,-6.716257007142858,"{'tags': ['Distrontium ruthenium(IV) oxide', 'Distrontium ruthenate(IV)']}",-47.01379905,-6.716257007142858,-2.473796924047619,"['xas', 'bandstructure']",True,"[84484, 94191, 41609, 41610, 78630, 78285, 94194, 78631, 94193, 41607, 33802, 78629, 94184, 75151, 82898, 41604, 94200, 78286, 157401, 94189, 83110, 75152, 94188, 94197, 94199, 94185, 188554, 83109, 94198, 90737, 94192, 94195, 83111, 41606, 94186, 41608, 41605, 73395, 94187, 94196, 73394, 94190]",True,2021-05-12 10:57:08.928000,FM,7,10,mp-4596,oxide,Sr2RuO4,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ru_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ru': 1.0, 'O': 4.0}",GGA,mp-4596,"['mp-921970', 'mp-922219', 'mp-907609', 'mp-4596', 'mp-1078075', 'mp-1440912', 'mp-1668168', 'mp-1797475', 'mp-1594347', 'mp-1595037']",1.6420578,"{'Sr': 2.0, 'Ru': 1.0, 'O': 4.0}",98.29510225301225,[],FM,True,139,1,"[0.0, 0.0, 1.1, 0.0, 0.0, 0.0, 0.0]",0.0167053877798848,1.6420578,1,1.6420578,MP,data/source/MP/cleaned/cifs/MP-mp-4596.cif,True,,data/final/MP/graphs/Ru0.8Sr2Ti0.2O4-MP-mp-4596-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ba3Ge16Ir4,1,0.0,1.0,True,Ba3Ge16Ir4,Ba3Ge16Ir4,6.1,Other,True,Ba13.043Ge69.565Ir17.391,Ba-Ge-Ir,3,Supercon,Ba3Ir4Ge16,MP-mp-1190530,Ba3Ge16Ir4,Ba-Ge-Ir,Ba13.043Ge69.565Ir17.391,I 4/m m m,tetragonal,6.597008000198571,6.597008000198572,12.27346793,data/final/MP/cifs/Ba3Ge16Ir4-MP-mp-1190530.cif,data/source/MP/raw/cifs/mp-1190530.cif,mp-1190530,0.0,,2019-01-11 21:01:02.854000,7.875078207255153,,,{'GGA': {'task_id': 'mp-1735720'}},0.0,5.69279497,520.0,-123.87378138,-5.38581658173913,"{'tags': ['Barium iridium germanide (3/4/16)', 'Barium germanium iridium (3/16/4)']}",-123.87378138,-5.38581658173913,-0.3823783273913042,[],False,"[194235, 189363, 427108]",True,2021-05-12 10:59:54.607000,NM,23,6,mp-1190530,,Ba3(Ge4Ir)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ge_d', 'Ir'], 'pot_type': 'paw'}","{'Ba': 3.0, 'Ge': 16.0, 'Ir': 4.0}",GGA,mp-1190530,"['mp-1190530', 'mp-1190926', 'mp-1192053', 'mp-1382307', 'mp-1735720', 'mp-1825774']",0.0055143,"{'Ba': 3.0, 'Ge': 16.0, 'Ir': 4.0}",494.0637690983461,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.1161109850381172e-05,0.0055143,0,0.0055143,MP,data/source/MP/cleaned/cifs/MP-mp-1190530.cif,False,,data/final/MP/graphs/Ba3Ge16Ir4-MP-mp-1190530.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ce0.15Cu1Gd1.85O4,2,0.0428571428571428,2.0,False,Ce0.3Cu2Gd3.7O8,Cu2Gd4O8,0.0,Cuprate,True,Ce2.143Cu14.286Gd26.429O57.142857142857146,Ce-Cu-Gd-O,4,Supercon,Gd1.85Ce0.15Cu1O4,MP-mp-676060,Gd4Cu2O8,Cu-Gd-O,Cu14.286Gd28.571O57.142857142857146,P 1 21/c 1,monoclinic,5.519437,5.523854,6.55743089,data/final/MP/cifs/Ce0.15Cu1Gd1.85O4-MP-mp-676060-synth_doped.cif,data/source/MP/raw/cifs/mp-676060.cif,mp-676060,0.0,,2013-11-12 10:16:06,8.010608105035294,10.17188/1282923,"@misc{osti_1282923,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Gd2CuO4 (SG:14) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1282923"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1737410'}},0.0288958435714299,3.06952935,520.0,-141.01354869,-10.072396335,{'tags': []},-141.01354869,-10.072396335,-3.030211310714286,"['xas', 'bandstructure']",True,[],True,2021-05-12 10:57:34.594000,FM,14,7,mp-676060,oxide,Gd2CuO4,"{'functional': 'PBE', 'labels': ['Gd', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Gd': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-676060,"['mp-948100', 'mp-948292', 'mp-676060', 'mp-937756', 'mp-1400979', 'mp-1737410', 'mp-1831011']",13.9831661,"{'Gd': 4.0, 'Cu': 2.0, 'O': 8.0}",183.26465539591385,[],FM,True,14,1,"[6.9, 6.9, 6.9, 6.9, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.1526007954975455,13.9831661,4,27.9663322,MP,data/source/MP/cleaned/cifs/MP-mp-676060.cif,True,,data/final/MP/graphs/Ce0.15Cu1Gd1.85O4-MP-mp-676060-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,1,0,0,0,1.0,False
Co0.94Rh0.06U6,2,0.0171428571428571,2.0,False,Co1.88Rh0.12U12,Co2U12,2.0,Heavy_fermion,True,Co13.429Rh0.857U85.714,Co-Rh-U,3,Supercon,Co0.94Rh0.06U6,MP-mp-582635,U12Co2,Co-U,Co14.286U85.714,I 4/m c m,tetragonal,5.159668002407489,7.66916902998628,7.66916903,data/final/MP/cifs/Co0.94Rh0.06U6-MP-mp-582635-synth_doped.cif,data/source/MP/raw/cifs/mp-582635.cif,mp-582635,0.0,,2015-02-18 18:20:36,18.350875555967026,10.17188/1276991,"@misc{osti_1276991,
    author = ""Persson, Kristin"",
    title = ""Materials Data on U6Co (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1276991"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1708365'}},0.0407774460714254,13.89719457,520.0,-150.2155255,-10.729680392857144,"{'tags': ['Cobalt uranium (1/6)', 'Uranium cobalt (6/1)']}",-150.2155255,-10.729680392857144,-0.0358549850000002,"['xas', 'bandstructure']",True,"[625513, 108323]",True,2021-05-12 10:57:26.891000,NM,14,8,mp-582635,,U6Co,"{'functional': 'PBE', 'labels': ['U', 'Co'], 'pot_type': 'paw'}","{'U': 6.0, 'Co': 1.0}",GGA,mp-582635,"['mp-934080', 'mp-944771', 'mp-944132', 'mp-1426228', 'mp-1708365', 'mp-1868026', 'mp-1603208', 'mp-582635']",0.027408,"{'U': 12.0, 'Co': 2.0}",269.13143073714446,[],NM,False,140,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0]",0.0002036774368934,0.027408,0,0.054816,MP,data/source/MP/cleaned/cifs/MP-mp-582635.cif,True,,data/final/MP/graphs/Co0.94Rh0.06U6-MP-mp-582635-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Mo3Te3Tl1,1,0.0,2.0,False,Mo6Te6Tl2,Mo6Te6Tl2,5.84,Chevrel,True,Mo42.857Te42.857Tl14.286,Mo-Te-Tl,3,Supercon,Tl1Mo3Te3,MP-mp-16096,Tl2Te6Mo6,Mo-Te-Tl,Mo42.857Te42.857Tl14.286,P 63/m,hexagonal,4.620138,9.738717996380732,9.7387187,data/final/MP/cifs/Mo3Te3Tl1-MP-mp-16096.cif,data/source/MP/raw/cifs/mp-16096.cif,mp-16096,0.2122999999999999,,2011-06-04 22:28:20,7.657721754902118,10.17188/1191561,"@misc{osti_1191561,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Tl(TeMo)3 (SG:176) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191561"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1676242'}},0.1145066927597406,6.22715222,520.0,-92.70182363,-6.621558830714286,"{'tags': ['Thallium molybdenum telluride (1/3/3)', 'Thallium(I) molybdenum(I/II) telluride (1/3/3)']}",-92.70182363,-6.621558830714286,-0.2887766840476189,"['xas', 'bandstructure']",True,"[644485, 90811]",True,2021-05-12 10:56:53.126000,NM,14,7,mp-16096,,Tl(TeMo)3,"{'functional': 'PBE', 'labels': ['Tl_d', 'Te', 'Mo_pv'], 'pot_type': 'paw'}","{'Tl': 1.0, 'Te': 3.0, 'Mo': 3.0}",GGA,mp-16096,"['mp-996617', 'mp-16096', 'mp-1105119', 'mp-1381152', 'mp-1676242', 'mp-1842571', 'mp-1598319']",0.00028485,"{'Tl': 2.0, 'Te': 6.0, 'Mo': 6.0}",379.48027091054615,[],NM,False,176,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.501263817043848e-06,0.00028485,0,0.0005697,MP,data/source/MP/cleaned/cifs/MP-mp-16096.cif,False,,data/final/MP/graphs/Mo3Te3Tl1-MP-mp-16096.json,0,True,6/m,0,3,0,0,0,0,0,1,0,0,0,1.0,False
Cs0.32W1O3,2,0.0056980056980057,3.0,False,Cs0.96W3O9,Cs1W3O9,1.12,Oxide,True,Cs7.407W23.148O69.44444444444443,Cs-W-O,3,Supercon,Cs0.32O3W1,MP-mp-753119,Cs1W3O9,Cs-W-O,Cs7.692W23.077O69.23076923076923,P 6/m m m,hexagonal,3.887459,7.544746001131922,7.54474626,data/final/MP/cifs/Cs0.32W1O3-MP-mp-753119-synth_doped.cif,data/source/MP/raw/cifs/mp-753119.cif,mp-753119,0.0,,2014-02-13 20:26:51,7.178173970651413,,,{'GGA+U': {'task_id': 'mp-1729896'}},0.0,3.52433864,520.0,-94.0038219,-7.231063223076924,{'tags': []},-94.0038219,-7.231063223076924,-2.24610700561008,['bandstructure'],True,[],True,2021-05-12 10:58:57.544000,FM,13,8,mp-753119,oxide,Cs(WO3)3,"{'functional': 'PBE', 'labels': ['Cs_sv', 'W_pv', 'O'], 'pot_type': 'paw'}","{'Cs': 1.0, 'W': 3.0, 'O': 9.0}",GGA+U,mp-753119,"['mp-763713', 'mp-880554', 'mp-894582', 'mp-753119', 'mp-1400201', 'mp-1729896', 'mp-1882816', 'mp-895340']",0.8712151,"{'Cs': 1.0, 'W': 3.0, 'O': 9.0}",191.6398049642021,[],FM,True,65,1,"[0.0, 0.3, 0.4, 0.4, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0045461072148489,0.8712151,3,0.8712151,MP,data/source/MP/cleaned/cifs/MP-mp-753119.cif,True,,data/final/MP/graphs/Cs0.32W1O3-MP-mp-753119-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
B2C1Cu0.3Ni1.7Y1,3,0.1,1.0,True,B2C1Cu0.3Ni1.7Y1,B2C1Ni2Y1,10.85,Other,True,B33.333C16.667Cu5Ni28.333Y16.667,B-C-Cu-Ni-Y,5,Supercon,Y1Ni1.7Cu0.3B2C1,MP-mp-6576,Y1Ni2B2C1,B-C-Ni-Y,B33.333C16.667Ni33.333Y16.667,I 4/m m m,tetragonal,3.548790000501972,3.548790000501972,5.76144136,data/final/MP/cifs/B2C1Cu0.3Ni1.7Y1-MP-mp-6576-synth_doped.cif,data/source/MP/raw/cifs/mp-6576.cif,mp-6576,0.0,,2011-05-13 05:21:43,6.099730998852292,10.17188/1281366,"@misc{osti_1281366,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281366"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688230'}},0.0,6.81083016,520.0,-43.677878,-7.279646333333333,{'tags': []},-43.677878,-7.279646333333333,-0.5109282141666659,"['xas', 'bandstructure']",True,"[75816, 89142, 83231, 79574, 41549]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6576,,YNi2B2C,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6576,"['mp-6576', 'mp-1007054', 'mp-1000583', 'mp-1439516', 'mp-1688230', 'mp-1794280', 'mp-1011792', 'mp-1597064']",0.0006603,"{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.3152437079014,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",1.010943177297096e-05,0.0006603,0,0.0006603,MP,data/source/MP/cleaned/cifs/MP-mp-6576.cif,True,,data/final/MP/graphs/B2C1Cu0.3Ni1.7Y1-MP-mp-6576-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Fe1S0.5Se0.5,1,0.0,2.0,False,Fe2S1Se1,Fe2S1Se1,2.75,Ferrite,True,Fe50S25Se25,Fe-S-Se,3,Supercon,Fe1Se0.5S0.5,MP-mp-1225163,Fe2Se1S1,Fe-S-Se,Fe50S25Se25,P -6 m 2,hexagonal,3.415354002894329,3.41535372,5.658565,data/final/MP/cifs/Fe1S0.5Se0.5-MP-mp-1225163.cif,data/source/MP/raw/cifs/mp-1225163.cif,mp-1225163,0.0,,2019-01-13 01:18:49.100000,6.469790579478093,,,{'GGA': {'task_id': 'mp-1763783'}},0.2831379099999997,6.79096851,520.0,-24.99649553,-6.2491238825,{'tags': []},-24.99649553,-6.2491238825,-0.3497793213671878,['bandstructure'],True,[],True,2021-05-12 10:58:45.495000,FM,4,5,mp-1225163,,Fe2SeS,"{'functional': 'PBE', 'labels': ['Fe_pv', 'Se', 'S'], 'pot_type': 'paw'}","{'Fe': 2.0, 'Se': 1.0, 'S': 1.0}",GGA,mp-1225163,"['mp-1225163', 'mp-1432807', 'mp-1763783', 'mp-1782446', 'mp-1584901']",3.9408212,"{'Fe': 2.0, 'Se': 1.0, 'S': 1.0}",57.162121968969856,[],FM,True,187,1,"[1.9, 1.9, 0.0, 0.0]",0.0689411285700564,3.9408212,2,3.9408212,MP,data/source/MP/cleaned/cifs/MP-mp-1225163.cif,False,,data/final/MP/graphs/Fe1S0.5Se0.5-MP-mp-1225163.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Rh2Sc1Sn1,1,0.0,1.0,True,Rh2Sc1Sn1,Rh2Sc1Sn1,2.0,Other,True,Rh50Sc25Sn25,Rh-Sc-Sn,3,Supercon,Sc1Rh2Sn1,MP-mp-862623,Sc1Sn1Rh2,Rh-Sc-Sn,Rh50Sc25Sn25,F m -3 m,cubic,4.57344362,4.57344362,4.57344362,data/final/MP/cifs/Rh2Sc1Sn1-MP-mp-862623.cif,data/source/MP/raw/cifs/mp-862623.cif,mp-862623,0.0,,2014-08-23 01:28:07,9.070294965808715,10.17188/1309493,"@misc{osti_1309493,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ScSnRh2 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1309493"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1766021'}},0.0,8.05894758,520.0,-28.5765909,-7.144147725,{'tags': []},-28.5765909,-7.144147725,-0.8764835499999997,"['bandstructure', 'elasticity']",True,[],True,2021-05-12 10:56:31.128000,NM,4,5,mp-862623,,ScSnRh2,"{'functional': 'PBE', 'labels': ['Sc_sv', 'Sn_d', 'Rh_pv'], 'pot_type': 'paw'}","{'Sc': 1.0, 'Sn': 1.0, 'Rh': 2.0}",GGA,mp-862623,"['mp-862623', 'mp-1431492', 'mp-1766021', 'mp-1783766', 'mp-1614200']",0.1789619,"{'Sc': 1.0, 'Sn': 1.0, 'Rh': 2.0}",67.64177448423555,[],NM,False,225,0,"[0, 0, 0, 0]",0.002645730413854,0.1789619,0,0.1789619,MP,data/source/MP/cleaned/cifs/MP-mp-862623.cif,False,,data/final/MP/graphs/Rh2Sc1Sn1-MP-mp-862623.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Pt1Si1Ta1,1,0.0,4.0,False,Pt4Si4Ta4,Pt4Si4Ta4,3.54,Other,True,Pt33.333Si33.333Ta33.333,Pt-Si-Ta,3,Supercon,Ta1Pt1Si1,MP-mp-1208554,Ta4Si4Pt4,Pt-Si-Ta,Pt33.333Si33.333Ta33.333,P n m a,orthorhombic,3.856239,6.451746,7.429028,data/final/MP/cifs/Pt1Si1Ta1-MP-mp-1208554.cif,data/source/MP/raw/cifs/mp-1208554.cif,mp-1208554,0.0,,2019-01-12 11:26:54.549000,14.52256799359755,,,{'GGA': {'task_id': 'mp-1742131'}},0.0,8.71984889,520.0,-101.90917398,-8.492431165000001,"{'tags': ['TiNiSi', 'AlB2 family', 'TaPtSi']}",-101.90917398,-8.492431165000001,-0.7077647116666673,[],False,[],True,2021-05-12 11:00:21.818000,NM,12,4,mp-1208554,,TaSiPt,"{'functional': 'PBE', 'labels': ['Ta_pv', 'Si', 'Pt'], 'pot_type': 'paw'}","{'Ta': 1.0, 'Si': 1.0, 'Pt': 1.0}",GGA,mp-1208554,"['mp-1208554', 'mp-1394483', 'mp-1742131', 'mp-1789804']",1.745e-05,"{'Ta': 4.0, 'Si': 4.0, 'Pt': 4.0}",184.8303130074183,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.77643682274122e-07,1.745e-05,0,6.98e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1208554.cif,False,,data/final/MP/graphs/Pt1Si1Ta1-MP-mp-1208554.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Au0.25Te0.75,1,0.0,4.0,False,Au1Te3,Au1Te3,1.85,Other,True,Au25Te75,Au-Te,2,Supercon,Au0.25Te0.75,MP-mp-1217358,Te3Au1,Au-Te,Au25Te75,P 4/m m m,tetragonal,3.131671,3.131671,12.684502,data/final/MP/cifs/Au0.25Te0.75-MP-mp-1217358.cif,data/source/MP/raw/cifs/mp-1217358.cif,mp-1217358,0.0,,2019-01-12 18:42:28.776000,7.738852762525378,,,{'GGA': {'task_id': 'mp-1759116'}},0.0,5.29108172,520.0,-12.64616678,-3.161541695,{'tags': []},-12.64616678,-3.161541695,-0.3020956125,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,4,5,mp-1217358,,Te3Au,"{'functional': 'PBE', 'labels': ['Te', 'Au'], 'pot_type': 'paw'}","{'Te': 3.0, 'Au': 1.0}",GGA,mp-1217358,"['mp-1217358', 'mp-1399622', 'mp-1759116', 'mp-1787936', 'mp-1585580']",0.0020108,"{'Te': 3.0, 'Au': 1.0}",124.40151878777743,[],NM,False,123,0,"[0, 0, 0, 0]",1.6163789796090196e-05,0.0020108,0,0.0020108,MP,data/source/MP/cleaned/cifs/MP-mp-1217358.cif,False,,data/final/MP/graphs/Au0.25Te0.75-MP-mp-1217358.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Cu4K1S3,1,0.0,1.0,True,Cu4K1S3,Cu4K1S3,1.4,Other,True,Cu50K12.5S37.5,Cu-K-S,3,Supercon,Cu4K1S3,MP-mp-27677,K1Cu4S3,Cu-K-S,Cu50K12.5S37.5,P 4/m m m,tetragonal,3.89743,3.89743,9.295117,data/final/MP/cifs/Cu4K1S3-MP-mp-27677.cif,data/source/MP/raw/cifs/mp-27677.cif,mp-27677,0.0,,2014-02-24 03:29:00,4.580572272795164,10.17188/1201878,"@misc{osti_1201878,
    author = ""Persson, Kristin"",
    title = ""Materials Data on KCu4S3 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201878"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703295'}},0.0,4.56207927,520.0,-33.1539612,-4.14424515,"{'tags': ['Potassium copper sulfide (1/4/3)', 'Potassium tricopper(I) copper sulfide', 'Potassium copper(I/II) sulfide (1/4/3)']}",-33.1539612,-4.14424515,-0.5932982465468748,"['xas', 'elasticity', 'bandstructure']",True,"[23336, 602358, 602356, 25720]",True,2021-05-12 10:56:18.721000,NM,8,9,mp-27677,,KCu4S3,"{'functional': 'PBE', 'labels': ['K_sv', 'Cu_pv', 'S'], 'pot_type': 'paw'}","{'K': 1.0, 'Cu': 4.0, 'S': 3.0}",GGA,mp-27677,"['mp-1001656', 'mp-1008098', 'mp-27677', 'mp-1080604', 'mp-1425081', 'mp-1703295', 'mp-1780697', 'mp-1012420', 'mp-1589559']",0.0013989,"{'K': 1.0, 'Cu': 4.0, 'S': 3.0}",141.19246104793626,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0, 0, 0]",9.907752790887748e-06,0.0013989,0,0.0013989,MP,data/source/MP/cleaned/cifs/MP-mp-27677.cif,False,,data/final/MP/graphs/Cu4K1S3-MP-mp-27677.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ir0.96Rh0.04Te2,2,0.0266666666666666,4.0,False,Ir3.84Rh0.16Te8,Ir4Te8,0.0,Other,True,Ir32Rh1.333Te66.667,Ir-Rh-Te,3,Supercon,Ir0.96Rh0.04Te2,MP-mp-569322,Te8Ir4,Ir-Te,Ir33.333Te66.667,P n m a,orthorhombic,4.049805,5.441863,13.587474,data/final/MP/cifs/Ir0.96Rh0.04Te2-MP-mp-569322-synth_doped.cif,data/source/MP/raw/cifs/mp-569322.cif,mp-569322,0.0,,2014-02-16 04:48:25,9.924328423353325,10.17188/1275037,"@misc{osti_1275037,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Te2Ir (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1275037"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1746248'}},0.0123894575000003,7.60847828,520.0,-63.94410921,-5.3286757675,{'tags': ['Iridium telluride (1/2)']},-63.94410921,-5.3286757675,-0.5683316741666667,"['xas', 'bandstructure']",True,[93894],True,2021-05-12 10:57:24.969000,NM,12,7,mp-569322,,Te2Ir,"{'functional': 'PBE', 'labels': ['Te', 'Ir'], 'pot_type': 'paw'}","{'Te': 2.0, 'Ir': 1.0}",GGA,mp-569322,"['mp-927873', 'mp-927408', 'mp-569322', 'mp-911451', 'mp-1392626', 'mp-1746248', 'mp-1810340']",0.000153075,"{'Te': 8.0, 'Ir': 4.0}",299.44732816890644,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.0447669503153013e-06,0.000153075,0,0.0006123,MP,data/source/MP/cleaned/cifs/MP-mp-569322.cif,True,,data/final/MP/graphs/Ir0.96Rh0.04Te2-MP-mp-569322-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
B2C1Ho0.3Lu0.7Ni2,3,0.1,1.0,True,B2C1Ho0.3Lu0.7Ni2,B2C1Lu1Ni2,13.3,Other,True,B33.333C16.667Ho5Lu11.667Ni33.333,B-C-Ho-Lu-Ni,5,Supercon,Ho0.3Lu0.7Ni2B2C1,MP-mp-6544,Lu1Ni2B2C1,B-C-Lu-Ni,B33.333C16.667Lu16.667Ni33.333,I 4/m m m,tetragonal,3.4660159989239463,3.4660159989239463,5.81490896,data/final/MP/cifs/B2C1Ho0.3Lu0.7Ni2-MP-mp-6544-synth_doped.cif,data/source/MP/raw/cifs/mp-6544.cif,mp-6544,0.0,,2011-05-13 04:17:06,8.54504130524706,10.17188/1281287,"@misc{osti_1281287,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LuNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281287"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702891'}},0.0,6.71335166,520.0,-41.78223818,-6.963706363333333,{'tags': []},-41.78223818,-6.963706363333333,-0.5192416763888884,"['xas', 'bandstructure']",True,"[75609, 83230, 79564]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6544,,LuNi2B2C,"{'functional': 'PBE', 'labels': ['Lu_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Lu': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6544,"['mp-1000584', 'mp-1007055', 'mp-6544', 'mp-1441469', 'mp-1702891', 'mp-1783160', 'mp-1011794', 'mp-1588498']",0.0023161,"{'Lu': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",63.34823894903922,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",3.656139520884231e-05,0.0023161,0,0.0023161,MP,data/source/MP/cleaned/cifs/MP-mp-6544.cif,True,,data/final/MP/graphs/B2C1Ho0.3Lu0.7Ni2-MP-mp-6544-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Al2C1Nb3,1,0.0,4.0,False,Al8C4Nb12,Al8C4Nb12,0.0,Other,True,Al33.333C16.667Nb50,Al-C-Nb,3,Supercon,Nb3Al2C1,MP-mp-1190604,Nb12Al8C4,Al-C-Nb,Al33.333C16.667Nb50,P 41 3 2,cubic,7.130205,7.130205,7.130205,data/final/MP/cifs/Al2C1Nb3-MP-mp-1190604.cif,data/source/MP/raw/cifs/mp-1190604.cif,mp-1190604,0.0,,2019-01-11 21:04:24.696000,6.315902239089256,,,{'GGA': {'task_id': 'mp-1711669'}},0.0,6.71635368,520.0,-199.06064595,-8.294193581250001,"{'tags': ['*', 'Niobium aluminium carbide (3/2/1)', 'Niobium aluminium carbide (0.6/0.4/0.2)', 'Nb3Al2C']}",-199.06064595,-8.294193581250001,-0.4572190012500006,['bandstructure'],True,"[606237, 606235]",True,2021-05-12 10:58:33.577000,NM,24,6,mp-1190604,,Nb3Al2C,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al', 'C'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Al': 2.0, 'C': 1.0}",GGA,mp-1190604,"['mp-1190604', 'mp-1191265', 'mp-1431060', 'mp-1711669', 'mp-1839309', 'mp-1605632']",0.00095985,"{'Nb': 12.0, 'Al': 8.0, 'C': 4.0}",362.49836259242335,[],NM,False,213,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.0591496117506185e-05,0.00095985,0,0.0038394,MP,data/source/MP/cleaned/cifs/MP-mp-1190604.cif,False,,data/final/MP/graphs/Al2C1Nb3-MP-mp-1190604.json,0,True,432,4,0,0,0,0,0,0,1,0,0,0,1.0,False
B2C1Gd0.21Ni2Y0.79,3,0.0699999999999999,1.0,True,B2C1Gd0.21Ni2Y0.79,B2C1Ni2Y1,7.81,Other,True,B33.333C16.667Gd3.5Ni33.333Y13.167,B-C-Gd-Ni-Y,5,Supercon,Y0.79Gd0.21Ni2B2C1,MP-mp-6576,Y1Ni2B2C1,B-C-Ni-Y,B33.333C16.667Ni33.333Y16.667,I 4/m m m,tetragonal,3.548790000501972,3.548790000501972,5.76144136,data/final/MP/cifs/B2C1Gd0.21Ni2Y0.79-MP-mp-6576-synth_doped.cif,data/source/MP/raw/cifs/mp-6576.cif,mp-6576,0.0,,2011-05-13 05:21:43,6.099730998852292,10.17188/1281366,"@misc{osti_1281366,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281366"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688230'}},0.0,6.81083016,520.0,-43.677878,-7.279646333333333,{'tags': []},-43.677878,-7.279646333333333,-0.5109282141666659,"['xas', 'bandstructure']",True,"[75816, 89142, 83231, 79574, 41549]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6576,,YNi2B2C,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6576,"['mp-6576', 'mp-1007054', 'mp-1000583', 'mp-1439516', 'mp-1688230', 'mp-1794280', 'mp-1011792', 'mp-1597064']",0.0006603,"{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.3152437079014,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",1.010943177297096e-05,0.0006603,0,0.0006603,MP,data/source/MP/cleaned/cifs/MP-mp-6576.cif,True,,data/final/MP/graphs/B2C1Gd0.21Ni2Y0.79-MP-mp-6576-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ce1Co0.7In5Rh0.3,3,0.0857142857142857,1.0,True,Ce1Co0.7In5Rh0.3,Ce1Co1In5,1.42,Heavy_fermion,True,Ce14.286Co10In71.429Rh4.286,Ce-Co-In-Rh,4,Supercon,Ce1Rh0.3Co0.7In5,MP-mp-19961,Ce1In5Co1,Ce-Co-In,Ce14.286Co14.286In71.429,P 4/m m m,tetragonal,4.635989,4.635989,7.564124,data/final/MP/cifs/Ce1Co0.7In5Rh0.3-MP-mp-19961-synth_doped.cif,data/source/MP/raw/cifs/mp-19961.cif,mp-19961,0.0,,2014-02-21 14:08:25,7.897022127398995,10.17188/1195145,"@misc{osti_1195145,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeIn5Co (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195145"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701944'}},0.0,7.80626318,520.0,-28.52795357,-4.075421938571429,{'tags': ['Cerium cobalt indium (1/1/5)']},-28.52795357,-4.075421938571429,-0.2468754242857146,"['xas', 'bandstructure']",True,[102108],True,2021-05-12 10:56:57.051000,FM,7,8,mp-19961,,CeIn5Co,"{'functional': 'PBE', 'labels': ['Ce', 'In_d', 'Co'], 'pot_type': 'paw'}","{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",GGA,mp-19961,"['mp-928775', 'mp-912209', 'mp-928270', 'mp-19961', 'mp-1504062', 'mp-1701944', 'mp-1785253', 'mp-1593180']",0.9310323,"{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",162.57113333428427,[],FM,True,123,1,"[0.7, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0057269226147644,0.9310323,1,0.9310323,MP,data/source/MP/cleaned/cifs/MP-mp-19961.cif,True,,data/final/MP/graphs/Ce1Co0.7In5Rh0.3-MP-mp-19961-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Hf0.87Ta0.13V2,3,0.0866666666666666,2.0,False,Hf1.74Ta0.26V4,Hf2V4,10.45,Other,True,Hf29Ta4.333V66.667,Hf-Ta-V,3,Supercon,V2Hf0.87Ta0.13,MP-mp-1077017,Hf2V4,Hf-V,Hf33.333V66.667,I 41/a m d,tetragonal,5.147745850539648,5.14774585,5.14774585,data/final/MP/cifs/Hf0.87Ta0.13V2-MP-mp-1077017-synth_doped.cif,data/source/MP/raw/cifs/mp-1077017.cif,mp-1077017,0.0,,2018-04-07 18:44:03,9.47163160017764,,,{'GGA': {'task_id': 'mp-1759109'}},0.0337706083333326,5.06389256,520.0,-56.04737833,-9.341229721666666,{'tags': ['Hafnium vanadium (1/2)']},-56.04737833,-9.341229721666666,0.033770608333332,['bandstructure'],True,[187951],True,2021-05-12 10:58:14.654000,NM,6,5,mp-1077017,,HfV2,"{'functional': 'PBE', 'labels': ['Hf_pv', 'V_pv'], 'pot_type': 'paw'}","{'Hf': 1.0, 'V': 2.0}",GGA,mp-1077017,"['mp-1077017', 'mp-1391381', 'mp-1759109', 'mp-1796366', 'mp-1627385']",0.03458425,"{'Hf': 2.0, 'V': 4.0}",98.30836742237948,[],NM,False,141,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0007035871087434,0.03458425,0,0.0691685,MP,data/source/MP/cleaned/cifs/MP-mp-1077017.cif,True,,data/final/MP/graphs/Hf0.87Ta0.13V2-MP-mp-1077017-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B2C2Lu1,1,0.0,2.0,False,B4C4Lu2,B4C4Lu2,1.2,Other,True,B40C40Lu20,B-C-Lu,3,Supercon,Lu1B2C2,MP-mp-10858,Lu2B4C4,B-C-Lu,B40C40Lu20,P 4/m b m,tetragonal,3.438655,5.319229,5.319229,data/final/MP/cifs/B2C2Lu1-MP-mp-10858.cif,data/source/MP/raw/cifs/mp-10858.cif,mp-10858,0.0,,2011-05-28 02:35:41,7.530418186707828,10.17188/1187403,"@misc{osti_1187403,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Lu(BC)2 (SG:127) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187403"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678149'}},0.0271630099999935,6.53436299,520.0,-76.90116944,-7.690116944000001,{'tags': ['Lutetium boride carbide (1/2/2)']},-76.90116944,-7.690116944000001,-0.4234578516666673,"['xas', 'bandstructure']",True,[94044],True,2021-05-12 10:56:51.169000,NM,10,5,mp-10858,,Lu(BC)2,"{'functional': 'PBE', 'labels': ['Lu_3', 'B', 'C'], 'pot_type': 'paw'}","{'Lu': 1.0, 'B': 2.0, 'C': 2.0}",GGA,mp-10858,"['mp-10858', 'mp-1300779', 'mp-1678149', 'mp-1782433', 'mp-1591175']",0.00031665,"{'Lu': 2.0, 'B': 4.0, 'C': 4.0}",97.29398251610432,[],NM,False,127,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.509138423798973e-06,0.00031665,0,0.0006333,MP,data/source/MP/cleaned/cifs/MP-mp-10858.cif,False,,data/final/MP/graphs/B2C2Lu1-MP-mp-10858.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B2C1Ce1Ni2,1,0.0,1.0,True,B2C1Ce1Ni2,B2C1Ce1Ni2,0.05,Heavy_fermion,True,B33.333C16.667Ce16.667Ni33.333,B-C-Ce-Ni,4,Supercon,Ce1Ni2B2C1,MP-mp-10860,Ce1Ni2B2C1,B-C-Ce-Ni,B33.333C16.667Ce16.667Ni33.333,I 4/m m m,tetragonal,3.630616000426174,3.630616000426176,5.70347353,data/final/MP/cifs/B2C1Ce1Ni2-MP-mp-10860.cif,data/source/MP/raw/cifs/mp-10860.cif,mp-10860,0.0,,2011-05-28 07:48:01,7.201246039727224,10.17188/1187405,"@misc{osti_1187405,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187405"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1673239'}},0.0,8.40404392,520.0,-42.97030742,-7.161717903333333,{'tags': []},-42.97030742,-7.161717903333333,-0.4818967772222216,"['xas', 'bandstructure']",True,[56645],True,2021-05-12 10:56:51.169000,FM,6,8,mp-10860,,CeNi2B2C,"{'functional': 'PBE', 'labels': ['Ce', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-10860,"['mp-927406', 'mp-10860', 'mp-917644', 'mp-927840', 'mp-1300322', 'mp-1673239', 'mp-1781919', 'mp-1591682']",0.1608578,"{'Ce': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",67.13308624050798,[],FM,True,139,1,"[0.1, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0023961031587869,0.1608578,1,0.1608578,MP,data/source/MP/cleaned/cifs/MP-mp-10860.cif,False,,data/final/MP/graphs/B2C1Ce1Ni2-MP-mp-10860.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Fe1Se0.41Te0.41,3,0.0989010989010989,2.0,False,Fe2Se0.82Te0.82,Fe2Se1Te1,13.2,Ferrite,True,Fe54.945Se22.527Te22.527,Fe-Se-Te,3,Supercon,Fe1Se0.41Te0.41,MP-mp-1225136,Fe2Te1Se1,Fe-Se-Te,Fe50Se25Te25,P 4 m m,tetragonal,3.755398,3.755398,5.937717,data/final/MP/cifs/Fe1Se0.41Te0.41-MP-mp-1225136-synth_doped.cif,data/source/MP/raw/cifs/mp-1225136.cif,mp-1225136,0.0,,2019-01-13 01:17:25.998000,6.310824077785493,,,{'GGA': {'task_id': 'mp-1764167'}},0.0802741556250001,4.86336573,520.0,-24.0729629,-6.018240725,{'tags': []},-24.0729629,-6.018240725,-0.3469333980859375,['bandstructure'],True,[],True,2021-05-12 10:58:45.495000,FM,4,5,mp-1225136,,Fe2TeSe,"{'functional': 'PBE', 'labels': ['Fe_pv', 'Te', 'Se'], 'pot_type': 'paw'}","{'Fe': 2.0, 'Te': 1.0, 'Se': 1.0}",GGA,mp-1225136,"['mp-1225136', 'mp-1425562', 'mp-1764167', 'mp-1784460', 'mp-1615275']",0.1061773,"{'Fe': 2.0, 'Te': 1.0, 'Se': 1.0}",83.73970680084179,[],FM,True,99,1,"[0.1, 0.1, -0.0, -0.0]",0.0012679444920021,0.1061773,2,0.1061773,MP,data/source/MP/cleaned/cifs/MP-mp-1225136.cif,True,,data/final/MP/graphs/Fe1Se0.41Te0.41-MP-mp-1225136-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
As2Ba0.4Fe2K0.6,2,0.0266666666666666,3.0,False,As6Ba1.2Fe6K1.8,As6Ba1Fe6K2,31.2,Ferrite,True,As40Ba8Fe40K12,As-Ba-Fe-K,4,Supercon,Ba0.4K0.6Fe2As2,MP-mp-1223766,K2Ba1Fe6As6,As-Ba-Fe-K,As40Ba6.667Fe40K13.333,C 1 2/m 1,monoclinic,5.437740001361472,7.18634711,8.612102760000003,data/final/MP/cifs/As2Ba0.4Fe2K0.6-MP-mp-1223766-synth_doped.cif,data/source/MP/raw/cifs/mp-1223766.cif,mp-1223766,0.0,,2019-01-13 00:06:57.709000,5.619425416151954,,,,0.0077898596666665,3.9822019,520.0,-88.48429402,-5.898952934666666,{'tags': []},-88.48429402,-5.898952934666666,-0.3713176110666666,[],False,[],True,2021-05-12 11:00:52.054000,FM,15,3,mp-1223766,,K2Ba(FeAs)6,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'K': 2.0, 'Ba': 1.0, 'Fe': 6.0, 'As': 6.0}",GGA,mp-1223766,"['mp-1223766', 'mp-1375545', 'mp-1808794']",0.1908756,"{'K': 2.0, 'Ba': 1.0, 'Fe': 6.0, 'As': 6.0}",295.5362020180066,[],FM,True,12,2,"[-0.0, -0.0, -0.0, -0.0, 0.1, 0.1, 0.1, 0.1, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0006458619915145,0.1908756,4,0.1908756,MP,data/source/MP/cleaned/cifs/MP-mp-1223766.cif,True,,data/final/MP/graphs/As2Ba0.4Fe2K0.6-MP-mp-1223766-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
Ru3Si2Th1,1,0.0,1.0,True,Ru3Si2Th1,Ru3Si2Th1,3.98,Other,True,Ru50Si33.333Th16.667,Ru-Si-Th,3,Supercon,Th1Ru3Si2,MP-mp-1025056,Th1Si2Ru3,Ru-Si-Th,Ru50Si33.333Th16.667,P 6/m m m,hexagonal,3.622271,5.645039999249384,5.64503996,data/final/MP/cifs/Ru3Si2Th1-MP-mp-1025056.cif,data/source/MP/raw/cifs/mp-1025056.cif,mp-1025056,0.0,,2016-09-28 02:50:03,9.824236309244828,10.17188/1355362,"@article{osti_1355362,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ThSi2Ru3 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1355362"",
    place = ""United States"",
    year = ""2017"",
    month = ""5""
}
",{'GGA': {'task_id': 'mp-1705018'}},0.0140006558333336,8.40048746,520.0,-50.61192637,-8.435321061666667,"{'tags': ['ThRu3Si2', 'LaRu3Si2', 'Ruthenium thorium silicide (3/1/2)']}",-50.61192637,-8.435321061666667,-0.7540451858333329,"['bandstructure', 'elasticity']",True,[650643],True,2021-05-12 10:56:10.715000,NM,6,10,mp-1025056,,ThSi2Ru3,"{'functional': 'PBE', 'labels': ['Th', 'Si', 'Ru_pv'], 'pot_type': 'paw'}","{'Th': 1.0, 'Si': 2.0, 'Ru': 3.0}",GGA,mp-1025056,"['mp-1025056', 'mp-1072605', 'mp-1072651', 'mp-1072627', 'mp-1142871', 'mp-1415516', 'mp-1705018', 'mp-1797528', 'mp-1593039', 'mp-1072649']",2.86e-05,"{'Th': 1.0, 'Si': 2.0, 'Ru': 3.0}",99.96445758717093,[],NM,False,191,0,"[0, 0, 0, 0, 0, 0]",2.86101687442862e-07,2.86e-05,0,2.86e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1025056.cif,False,,data/final/MP/graphs/Ru3Si2Th1-MP-mp-1025056.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Cu4Ga0.05Y0.95O8,2,0.0066666666666666,1.0,True,Ba2Cu4Ga0.05Y0.95O8,Ba2Cu4Y1O8,75.0,Cuprate,True,Ba13.333Cu26.667Ga0.333Y6.333O53.333333333333336,Ba-Cu-Ga-Y-O,5,Supercon,Y0.95Ga0.05Ba2Cu4O8,MP-mp-6790,Ba2Y1Cu4O8,Ba-Cu-Y-O,Ba13.333Cu26.667Y6.667O53.333333333333336,C m m m,orthorhombic,3.889922,3.899603999537882,13.88942687,data/final/MP/cifs/Ba2Cu4Ga0.05Y0.95O8-MP-mp-6790-synth_doped.cif,data/source/MP/raw/cifs/mp-6790.cif,mp-6790,0.0,,2011-05-16 03:21:24,5.936250568336678,10.17188/1283441,"@misc{osti_1283441,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Y(CuO2)4 (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1283441"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686864'}},0.0,3.31391536,520.0,-91.58381472,-6.105587648,"{'tags': ['Yttrium barium copper oxide (1/2/4/8)', 'High pressure experimental phase']}",-91.58381472,-6.105587648,-2.0529924817777783,"['xas', 'bandstructure']",True,"[72261, 85273, 74251, 400273, 85277, 85275, 400280, 67632, 85272, 67631, 83920, 66613, 85279, 400277, 75689, 74259, 85278, 85280, 66603, 94265, 400276, 88873, 71417, 75712, 97052, 66605, 72258, 85281, 85274, 400279, 66604, 69698]",True,2021-05-12 10:57:34.594000,NM,15,10,mp-6790,oxide,Ba2Y(CuO2)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-6790,"['mp-1000664', 'mp-6790', 'mp-1007136', 'mp-1237713', 'mp-1440937', 'mp-1686864', 'mp-1834179', 'mp-1011883', 'mp-1590064', 'mp-1590433']",0.0004643,"{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",208.60454115924333,[],NM,False,65,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.225742533790601e-06,0.0004643,0,0.0004643,MP,data/source/MP/cleaned/cifs/MP-mp-6790.cif,True,,data/final/MP/graphs/Ba2Cu4Ga0.05Y0.95O8-MP-mp-6790-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ce1Pt2,1,0.0,2.0,False,Ce2Pt4,Ce2Pt4,0.0,Heavy_fermion,True,Ce33.333Pt66.667,Ce-Pt,2,Supercon,Ce1Pt2,MP-mp-2109,Ce2Pt4,Ce-Pt,Ce33.333Pt66.667,F d -3 m,cubic,5.49474578,5.49474578,5.49474578,data/final/MP/cifs/Ce1Pt2-MP-mp-2109.cif,data/source/MP/raw/cifs/mp-2109.cif,mp-2109,0.0,,2011-05-13 10:55:52,15.01273444986084,10.17188/1196366,"@misc{osti_1196366,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CePt2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196366"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-918536'}},0.0251967213333346,8.50986015,520.0,-42.1330184,-7.022169733333333,{'tags': ['Cerium platinum (1/2)']},-42.1330184,-7.022169733333333,-0.9972015416666656,"['xas', 'bandstructure']",True,"[150483, 621876, 603836, 108262, 621884, 102257, 621877, 621888, 621878, 621885]",True,2021-05-12 10:56:57.051000,NM,6,8,mp-2109,,CePt2,"{'functional': 'PBE', 'labels': ['Ce', 'Pt'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Pt': 2.0}",GGA,mp-2109,"['mp-918536', 'mp-919531', 'mp-905332', 'mp-2109', 'mp-1439943', 'mp-1686381', 'mp-1803441', 'mp-1596929']",0.0037782,"{'Ce': 2.0, 'Pt': 4.0}",117.308049554034,[],NM,False,227,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",6.441501694663672e-05,0.0037782,0,0.0075564,MP,data/source/MP/cleaned/cifs/MP-mp-2109.cif,False,,data/final/MP/graphs/Ce1Pt2-MP-mp-2109.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ba0.75Bi1K0.25O3,1,0.0,4.0,False,Ba3Bi4K1O12,Ba3Bi4K1O12,0.0,Oxide,True,Ba15Bi20K5O60,Ba-Bi-K-O,4,Supercon,Ba0.75K0.25Bi1O3,MP-mp-1223500,K1Ba3Bi4O12,Ba-Bi-K-O,Ba15Bi20K5O60,P m m 2,orthorhombic,6.174105,6.250419,8.750792,data/final/MP/cifs/Ba0.75Bi1K0.25O3-MP-mp-1223500.cif,data/source/MP/raw/cifs/mp-1223500.cif,mp-1223500,0.0,,2019-01-12 23:53:10.974000,7.272519893580743,,,{'GGA': {'task_id': 'mp-1685501'}},0.0,3.59370248,520.0,-115.03537759,-5.7517688795,{'tags': []},-115.03537759,-5.7517688795,-2.07381984265,[],False,[],True,2021-05-12 11:00:52.054000,NM,20,4,mp-1223500,oxide,KBa3(BiO3)4,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Bi', 'O'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 3.0, 'Bi': 4.0, 'O': 12.0}",GGA,mp-1223500,"['mp-1223500', 'mp-1347932', 'mp-1685501', 'mp-1810668']",5.8e-06,"{'K': 1.0, 'Ba': 3.0, 'Bi': 4.0, 'O': 12.0}",337.6995668685706,[],NM,False,25,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.7175029431581428e-08,5.8e-06,0,5.8e-06,MP,data/source/MP/cleaned/cifs/MP-mp-1223500.cif,False,,data/final/MP/graphs/Ba0.75Bi1K0.25O3-MP-mp-1223500.json,0,True,mm2,0,0,0,6,0,0,0,1,0,0,0,1.0,False
Au2Ga1Y1,1,0.0,1.0,True,Au2Ga1Y1,Au2Ga1Y1,0.0,Other,True,Au50Ga25Y25,Au-Ga-Y,3,Supercon,Au2Ga1Y1,MP-mp-979422,Y1Ga1Au2,Au-Ga-Y,Au50Ga25Y25,F m -3 m,cubic,4.86638382,4.866383819999999,4.866383819999999,data/final/MP/cifs/Au2Ga1Y1-MP-mp-979422.cif,data/source/MP/raw/cifs/mp-979422.cif,mp-979422,0.0,,2015-10-09 18:49:00,11.259679322941018,,,{'GGA': {'task_id': 'mp-1767494'}},0.0334416570833333,4.59554599,520.0,-18.66884263,-4.6672106575,{'tags': []},-18.66884263,-4.6672106575,-0.6566281035416663,"['xas', 'elasticity', 'bandstructure']",True,[],True,2021-05-12 10:56:37.246000,NM,4,8,mp-979422,,YGaAu2,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ga_d', 'Au'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ga': 1.0, 'Au': 2.0}",GGA,mp-979422,"['mp-1005911', 'mp-979422', 'mp-980266', 'mp-1005812', 'mp-1423839', 'mp-1767494', 'mp-1933879', 'mp-1617865']",0.0016426,"{'Y': 1.0, 'Ga': 1.0, 'Au': 2.0}",81.48995557295292,[],NM,False,225,0,"[0, 0, 0, 0]",2.015708547698841e-05,0.0016426,0,0.0016426,MP,data/source/MP/cleaned/cifs/MP-mp-979422.cif,False,,data/final/MP/graphs/Au2Ga1Y1-MP-mp-979422.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Cr0.01N1Nb0.99,2,0.01,1.0,True,Cr0.01N1Nb0.99,N1Nb1,1.2,Other,True,Cr0.5N50Nb49.5,Cr-N-Nb,3,Supercon,Nb0.99Cr0.01N1,MP-mp-2634,Nb1N1,N-Nb,N50Nb50,P -6 m 2,hexagonal,2.898656,2.9761920047347994,2.97619211,data/final/MP/cifs/Cr0.01N1Nb0.99-MP-mp-2634-synth_doped.cif,data/source/MP/raw/cifs/mp-2634.cif,mp-2634,0.0,,2011-05-12 17:49:04,7.984187332554685,10.17188/1201157,"@misc{osti_1201157,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbN (SG:187) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201157"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671304'}},0.0,7.12357548,520.0,-20.57319827,-10.286599135,"{'tags': ['Niobium nitride (1/1)', 'Niobium nitride', 'Niobium nitride (1/1) - gamma']}",-20.57319827,-10.286599135,-1.2481991524999998,"['xas', 'elasticity', 'bandstructure']",True,"[185569, 644536, 76385, 191062]",True,2021-05-12 10:56:18.721000,NM,2,17,mp-2634,,NbN,"{'functional': 'PBE', 'labels': ['Nb_pv', 'N'], 'pot_type': 'paw'}","{'Nb': 1.0, 'N': 1.0}",GGA,mp-2634,"['mp-926732', 'mp-910421', 'mp-926222', 'mp-2634', 'mp-1058402', 'mp-1058440', 'mp-1058487', 'mp-1061535', 'mp-1061589', 'mp-1061648', 'mp-1116126', 'mp-1442283', 'mp-1671304', 'mp-1924826', 'mp-1594881', 'mp-1061618', 'mp-1058457']",0.0002504,"{'Nb': 1.0, 'N': 1.0}",22.23561881453577,[],NM,False,187,0,"[0, 0]",1.1261211216496917e-05,0.0002504,0,0.0002504,MP,data/source/MP/cleaned/cifs/MP-mp-2634.cif,True,,data/final/MP/graphs/Cr0.01N1Nb0.99-MP-mp-2634-synth_doped.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
B2Co3Tm1,1,0.0,1.0,True,B2Co3Tm1,B2Co3Tm1,0.0,Other,True,B33.333Co50Tm16.667,B-Co-Tm,3,Supercon,Tm1Co3B2,MP-mp-5714,Tm1Co3B2,B-Co-Tm,B33.333Co50Tm16.667,P 6/m m m,hexagonal,3.027256,4.956763995913077,4.95676439,data/final/MP/cifs/B2Co3Tm1-MP-mp-5714.cif,data/source/MP/raw/cifs/mp-5714.cif,mp-5714,0.0,,2011-05-12 23:54:08,9.470211590697932,10.17188/1276234,"@misc{osti_1276234,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TmCo3B2 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1276234"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704323'}},0.0,5.58755019,520.0,-42.34061402,-7.056769003333333,"{'tags': ['Cobalt thulium boride (3/1/2)', 'Thulium cobalt boride (1/3/2)']}",-42.34061402,-7.056769003333333,-0.5301736116666653,"['xas', 'elasticity', 'bandstructure']",True,"[44184, 613363]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-5714,,TmCo3B2,"{'functional': 'PBE', 'labels': ['Tm_3', 'Co', 'B'], 'pot_type': 'paw'}","{'Tm': 1.0, 'Co': 3.0, 'B': 2.0}",GGA,mp-5714,"['mp-926026', 'mp-925632', 'mp-910090', 'mp-5714', 'mp-1441218', 'mp-1704323', 'mp-1782956', 'mp-1596317']",0.0142986,"{'Tm': 1.0, 'Co': 3.0, 'B': 2.0}",64.41341284692929,[],NM,False,191,0,"[-0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0002219817172857,0.0142986,0,0.0142986,MP,data/source/MP/cleaned/cifs/MP-mp-5714.cif,False,,data/final/MP/graphs/B2Co3Tm1-MP-mp-5714.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ge7Ir3,1,0.0,2.0,False,Ge14Ir6,Ge14Ir6,0.87,Other,True,Ge70Ir30,Ge-Ir,2,Supercon,Ge7Ir3,MP-mp-505780,Ge14Ir6,Ge-Ir,Ge70Ir30,I m -3 m,cubic,7.619081921689032,7.619081920000001,7.61908192,data/final/MP/cifs/Ge7Ir3-MP-mp-505780.cif,data/source/MP/raw/cifs/mp-505780.cif,mp-505780,0.0,,2014-02-25 19:55:23,10.584618864553867,10.17188/1262751,"@misc{osti_1262751,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ge7Ir3 (SG:229) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1262751"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1675632'}},0.0,5.97966505,520.0,-123.17905372,-6.158952686,{'tags': ['Iridium germanide (3/7)']},-123.17905372,-6.158952686,-0.2713040615000004,"['xas', 'elasticity', 'bandstructure']",True,[53656],True,2021-05-12 10:56:20.740000,NM,20,7,mp-505780,,Ge7Ir3,"{'functional': 'PBE', 'labels': ['Ge_d', 'Ir'], 'pot_type': 'paw'}","{'Ge': 7.0, 'Ir': 3.0}",GGA,mp-505780,"['mp-505780', 'mp-996524', 'mp-1140221', 'mp-1436566', 'mp-1675632', 'mp-1838007', 'mp-1609036']",0.00131545,"{'Ge': 14.0, 'Ir': 6.0}",340.47563562501,[],NM,False,229,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",7.727131473506072e-06,0.00131545,0,0.0026309,MP,data/source/MP/cleaned/cifs/MP-mp-505780.cif,False,,data/final/MP/graphs/Ge7Ir3-MP-mp-505780.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,1,0,1.0,False
La5Ru2,1,0.0,2.0,False,La10Ru4,La10Ru4,2.35,Other,True,La71.429Ru28.571,La-Ru,2,Supercon,La5Ru2,MP-mp-1104417,La10Ru4,La-Ru,La71.429Ru28.571,C 1 2/c 1,monoclinic,6.721843997287566,7.35036374,9.10215779,data/final/MP/cifs/La5Ru2-MP-mp-1104417.cif,data/source/MP/raw/cifs/mp-1104417.cif,mp-1104417,0.0,,2018-07-18 21:55:26,7.154635129908844,,,{'GGA': {'task_id': 'mp-1677117'}},0.0,8.04248411,520.0,-90.27680955,-6.448343539285714,"{'tags': ['Lanthanum ruthenium (5/2)', 'Mn5C2', 'La5Ru2']}",-90.27680955,-6.448343539285714,-0.2727985628571424,['bandstructure'],True,"[641780, 641763]",True,2021-05-12 10:58:20.361000,NM,14,6,mp-1104417,,La5Ru2,"{'functional': 'PBE', 'labels': ['La', 'Ru_pv'], 'pot_type': 'paw'}","{'La': 5.0, 'Ru': 2.0}",GGA,mp-1104417,"['mp-1104417', 'mp-1104870', 'mp-1382651', 'mp-1677117', 'mp-1820167', 'mp-1605014']",0.00086855,"{'La': 10.0, 'Ru': 4.0}",416.2200132877121,[],NM,False,15,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0, -0.0, -0.0]",4.173513873777208e-06,0.00086855,0,0.0017371,MP,data/source/MP/cleaned/cifs/MP-mp-1104417.cif,False,,data/final/MP/graphs/La5Ru2-MP-mp-1104417.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
C2Cu0.1La1Ni0.9,2,0.0499999999999999,1.0,True,C2Cu0.1La1Ni0.9,C2La1Ni1,3.24,Other,True,C50Cu2.5La25Ni22.5,C-Cu-La-Ni,4,Supercon,La1Ni0.9Cu0.1C2,MP-mp-1018048,La1Ni1C2,C-La-Ni,C50La25Ni25,A m m 2,orthorhombic,3.82731293,3.82731293,3.977635,data/final/MP/cifs/C2Cu0.1La1Ni0.9-MP-mp-1018048-synth_doped.cif,data/source/MP/raw/cifs/mp-1018048.cif,mp-1018048,0.0,,2017-04-06 23:27:44,6.5955568384756855,10.17188/1350127,"@article{osti_1350127,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaNiC2 (SG:38) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1350127"",
    place = ""United States"",
    year = ""2017"",
    month = ""4""
}
",{'GGA': {'task_id': 'mp-1697101'}},0.0,8.87914765,520.0,-30.18892584,-7.54723146,"{'tags': ['LaNiC2', 'Lanthanum nickel carbide (1/1/2)', 'CeNiC2']}",-30.18892584,-7.54723146,-0.2548051637499995,"['bandstructure', 'elasticity']",True,[618179],True,2021-05-12 10:56:08.727000,NM,4,12,mp-1018048,,LaNiC2,"{'functional': 'PBE', 'labels': ['La', 'Ni_pv', 'C'], 'pot_type': 'paw'}","{'La': 1.0, 'Ni': 1.0, 'C': 2.0}",GGA,mp-1018048,"['mp-1018048', 'mp-1018270', 'mp-1018463', 'mp-1067001', 'mp-1067047', 'mp-1067181', 'mp-1115476', 'mp-1412950', 'mp-1697101', 'mp-1783297', 'mp-1594865', 'mp-1067093']",0.005804,"{'La': 1.0, 'Ni': 1.0, 'C': 2.0}",55.79651958097468,[],NM,False,38,0,"[0.0, -0.0, 0.0, 0.0]",0.0001040208250189,0.005804,0,0.005804,MP,data/source/MP/cleaned/cifs/MP-mp-1018048.cif,True,,data/final/MP/graphs/C2Cu0.1La1Ni0.9-MP-mp-1018048-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Al13Os4,1,0.0,1.0,True,Al13Os4,Al13Os4,5.4,Other,True,Al76.471Os23.529,Al-Os,2,Supercon,Al13Os4,MP-mp-567929,Al13Os4,Al-Os,Al76.471Os23.529,C 1 2/m 1,monoclinic,4.241351998812886,7.81811309,9.105754,data/final/MP/cifs/Al13Os4-MP-mp-567929.cif,data/source/MP/raw/cifs/mp-567929.cif,mp-567929,0.0,,2014-02-24 19:39:26,6.984115683995712,10.17188/1274135,"@misc{osti_1274135,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Al13Os4 (SG:12) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1274135"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1673470'}},0.0,7.99297578,520.0,-101.14656317,-5.949797833529411,{'tags': ['Aluminium osmium (13/4)']},-101.14656317,-5.949797833529411,-0.4438007270588228,"['xas', 'elasticity', 'bandstructure']",True,[58110],True,2021-05-12 10:56:22.739000,NM,17,9,mp-567929,,Al13Os4,"{'functional': 'PBE', 'labels': ['Al', 'Os_pv'], 'pot_type': 'paw'}","{'Al': 13.0, 'Os': 4.0}",GGA,mp-567929,"['mp-1008059', 'mp-1001558', 'mp-567929', 'mp-1257933', 'mp-1436831', 'mp-1673470', 'mp-1925537', 'mp-1012383', 'mp-1607598']",0.0009213,"{'Al': 13.0, 'Os': 4.0}",264.31235621955534,[],NM,False,12,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.4856486211136767e-06,0.0009213,0,0.0009213,MP,data/source/MP/cleaned/cifs/MP-mp-567929.cif,False,,data/final/MP/graphs/Al13Os4-MP-mp-567929.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
Ba2Cu3Er0.7Pr0.3O7,3,0.0461538461538461,1.0,True,Ba2Cu3Er0.7Pr0.3O7,Ba2Cu3Er1O7,61.1,Cuprate,True,Ba15.385Cu23.077Er5.385Pr2.308O53.84615384615385,Ba-Cu-Er-Pr-O,5,Supercon,Er0.7Pr0.3Ba2Cu3O7,MP-mp-622110,Ba2Er1Cu3O7,Ba-Cu-Er-O,Ba15.385Cu23.077Er7.692O53.84615384615385,P m m m,orthorhombic,3.834762,3.933125,11.788769,data/final/MP/cifs/Ba2Cu3Er0.7Pr0.3O7-MP-mp-622110-synth_doped.cif,data/source/MP/raw/cifs/mp-622110.cif,mp-622110,0.0,,2014-02-15 20:42:48,6.953388209207566,10.17188/1278094,"@misc{osti_1278094,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2ErCu3O7 (SG:47) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278094"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1676776'}},0.0334336014102625,3.20253361,520.0,-79.04238944,-6.080183803076922,"{'tags': ['Erbium barium copper oxide (1/2/3/7)', 'Erbium dibarium tricopper heptaoxide']}",-79.04238944,-6.080183803076922,-2.1932601480769227,['bandstructure'],True,"[63405, 81176]",True,2021-05-12 10:58:51.532000,NM,13,8,mp-622110,oxide,Ba2ErCu3O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Er_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Er': 1.0, 'Cu': 3.0, 'O': 7.0}",GGA,mp-622110,"['mp-932741', 'mp-622110', 'mp-931664', 'mp-916329', 'mp-1380960', 'mp-1676776', 'mp-1835850', 'mp-1598909']",0.0002229,"{'Ba': 2.0, 'Er': 1.0, 'Cu': 3.0, 'O': 7.0}",177.80526717534096,[],NM,False,47,0,"[0.0, 0.0, 0.0, 0.0, 0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",1.2536186556284031e-06,0.0002229,0,0.0002229,MP,data/source/MP/cleaned/cifs/MP-mp-622110.cif,True,,data/final/MP/graphs/Ba2Cu3Er0.7Pr0.3O7-MP-mp-622110-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ba2Cu1Tl2O6.056,2,0.0046046572819365,1.9816264861294584,False,Ba3.963Cu1.982Tl3.963O12,Ba4Cu2Tl4O12,40.0,Cuprate,True,Ba18.09Cu9.045Tl18.09O54.77568740955137,Ba-Cu-Tl-O,4,Supercon,Tl2Ba2Cu1O6.056,MP-mp-6027,Ba4Tl4Cu2O12,Ba-Cu-Tl-O,Ba18.182Cu9.091Tl18.182O54.54545454545455,C m c a,orthorhombic,5.504110002693673,5.585743,12.28312762,data/final/MP/cifs/Ba2Cu1Tl2O6.056-MP-mp-6027-synth_doped.cif,data/source/MP/raw/cifs/mp-6027.cif,mp-6027,0.0,,2011-05-19 00:05:23,7.606665315628389,10.17188/1277350,"@misc{osti_1277350,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Tl2CuO6 (SG:64) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277350"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1673478'}},0.0059215576010052,4.10961464,520.0,-115.75418737,-5.261553971363636,"{'tags': ['Dithallium dibarium cuprate', 'Dithallium(III) dibarium copper oxide']}",-115.75418737,-5.261553971363636,-1.7862630028787878,"['xas', 'bandstructure']",True,"[202723, 202724, 202722]",True,2021-05-12 10:57:28.836000,NM,22,8,mp-6027,oxide,Ba2Tl2CuO6,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Tl_d', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Tl': 2.0, 'Cu': 1.0, 'O': 6.0}",GGA,mp-6027,"['mp-925246', 'mp-909581', 'mp-924678', 'mp-6027', 'mp-1504634', 'mp-1673478', 'mp-1837163', 'mp-1605186']",2.9e-05,"{'Ba': 4.0, 'Tl': 4.0, 'Cu': 2.0, 'O': 12.0}",368.0385386017736,[],NM,False,64,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.5759219189476614e-07,2.9e-05,0,5.8e-05,MP,data/source/MP/cleaned/cifs/MP-mp-6027.cif,True,,data/final/MP/graphs/Ba2Cu1Tl2O6.056-MP-mp-6027-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
As0.25Se0.75Y1,1,0.0,4.0,False,As1Se3Y4,As1Se3Y4,0.78,Other,True,As12.5Se37.5Y50,As-Se-Y,3,Supercon,As0.25Se0.75Y1,MP-mp-38494,Y4As1Se3,As-Se-Y,As12.5Se37.5Y50,I 4/m m m,tetragonal,5.792752002408483,5.792752002408483,7.102477300000001,data/final/MP/cifs/As0.25Se0.75Y1-MP-mp-38494.cif,data/source/MP/raw/cifs/mp-38494.cif,mp-38494,0.0,,2014-02-19 11:21:24,5.692174730517906,10.17188/1207531,"@misc{osti_1207531,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Y4AsSe3 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207531"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1731750'}},0.0,5.64856899,520.0,-55.01730499,-6.87716312375,{'tags': []},-55.01730499,-6.87716312375,-1.9275709623372383,"['xas', 'bandstructure']",True,[],True,2021-05-12 10:57:06.958000,NM,8,8,mp-38494,,Y4AsSe3,"{'functional': 'PBE', 'labels': ['Y_sv', 'As', 'Se'], 'pot_type': 'paw'}","{'Y': 4.0, 'As': 1.0, 'Se': 3.0}",GGA,mp-38494,"['mp-1002249', 'mp-1008549', 'mp-38494', 'mp-1408449', 'mp-1731750', 'mp-1784825', 'mp-1012766', 'mp-1623799']",0.0117867,"{'Y': 4.0, 'As': 1.0, 'Se': 3.0}",194.7033144614425,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0, 0]",6.0536719842713016e-05,0.0117867,0,0.0117867,MP,data/source/MP/cleaned/cifs/MP-mp-38494.cif,False,,data/final/MP/graphs/As0.25Se0.75Y1-MP-mp-38494.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Al0.25V0.75,1,0.0,8.0,False,Al2V6,Al2V6,16.9,Other,True,Al25V75,Al-V,2,Supercon,Al0.25V0.75,MP-mp-1387,Al2V6,Al-V,Al25V75,P m -3 n,cubic,4.809439,4.809439,4.809439,data/final/MP/cifs/Al0.25V0.75-MP-mp-1387.cif,data/source/MP/raw/cifs/mp-1387.cif,mp-1387,0.0,,2011-05-13 16:21:19,5.367846692804527,10.17188/1189788,"@misc{osti_1189788,
    author = ""Persson, Kristin"",
    title = ""Materials Data on AlV3 (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189788"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695894'}},0.0,6.44208835,520.0,-63.0685394,-7.883567425,"{'tags': ['Aluminium vanadium (1/3)', 'Aluminum vanadium (1/3)']}",-63.0685394,-7.883567425,-0.1342439149999998,"['xas', 'elasticity', 'bandstructure']",True,"[609619, 609614, 58200]",True,2021-05-12 10:56:12.755000,FM,8,9,mp-1387,,AlV3,"{'functional': 'PBE', 'labels': ['Al', 'V_pv'], 'pot_type': 'paw'}","{'Al': 1.0, 'V': 3.0}",GGA,mp-1387,"['mp-928632', 'mp-911987', 'mp-928179', 'mp-1387', 'mp-1252991', 'mp-1428170', 'mp-1695894', 'mp-1802978', 'mp-1594038']",0.17173495,"{'Al': 2.0, 'V': 6.0}",111.24570748494747,[],FM,True,131,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.0, 0.0, 0.0]",0.0030874890165669,0.17173495,2,0.3434699,MP,data/source/MP/cleaned/cifs/MP-mp-1387.cif,False,,data/final/MP/graphs/Al0.25V0.75-MP-mp-1387.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ge2.03La1Pt1.97,2,0.0119999999999999,1.0,True,Ge2.03La1Pt1.97,Ge2La1Pt2,0.83,Other,True,Ge40.6La20Pt39.4,Ge-La-Pt,3,Supercon,La1Pt1.97Ge2.03,MP-mp-21057,La1Ge2Pt2,Ge-La-Pt,Ge40La20Pt40,I 4/m m m,tetragonal,4.458128002603763,4.458128002603763,5.96043246,data/final/MP/cifs/Ge2.03La1Pt1.97-MP-mp-21057-synth_doped.cif,data/source/MP/raw/cifs/mp-21057.cif,mp-21057,0.0,,2014-02-21 09:25:11,11.137876633950224,10.17188/1196317,"@misc{osti_1196317,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La(GePt)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196317"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704515'}},0.0973405535000013,6.85937735,520.0,-30.67754438,-6.135508876,{'tags': ['Lanthanum platinum germanide (1/2/2)']},-30.67754438,-6.135508876,-0.8707332289999996,"['xas', 'bandstructure']",True,[53665],True,2021-05-12 10:56:57.051000,NM,5,8,mp-21057,,La(GePt)2,"{'functional': 'PBE', 'labels': ['La', 'Ge_d', 'Pt'], 'pot_type': 'paw'}","{'La': 1.0, 'Ge': 2.0, 'Pt': 2.0}",GGA,mp-21057,"['mp-993642', 'mp-991893', 'mp-21057', 'mp-1429115', 'mp-1704515', 'mp-1783057', 'mp-994947', 'mp-1591906']",0.003651,"{'La': 1.0, 'Ge': 2.0, 'Pt': 2.0}",100.53893739664449,[],NM,False,139,0,"[0, 0, 0, 0, 0]",3.631428871777447e-05,0.003651,0,0.003651,MP,data/source/MP/cleaned/cifs/MP-mp-21057.cif,True,,data/final/MP/graphs/Ge2.03La1Pt1.97-MP-mp-21057-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Bi2Ca1Cu2Sr2O8.11,2,0.0067946172512684,1.9729745992601728,False,Bi3.946Ca1.973Cu3.946Sr3.946O16,Bi4Ca2Cu4Sr4O16,86.45,Cuprate,True,Bi13.236Ca6.618Cu13.236Sr13.236O53.67306419589676,Bi-Ca-Cu-Sr-O,5,Supercon,Bi2Sr2Ca1Cu2O8.11,MP-mp-1218930,Sr4Ca2Cu4Bi4O16,Bi-Ca-Cu-Sr-O,Bi13.333Ca6.667Cu13.333Sr13.333O53.333333333333336,C c c 2,orthorhombic,5.417115,5.472898000129128,16.11398919,data/final/MP/cifs/Bi2Ca1Cu2Sr2O8.11-MP-mp-1218930-synth_doped.cif,data/source/MP/raw/cifs/mp-1218930.cif,mp-1218930,0.0,,2019-01-12 20:01:06.544000,6.266668983881059,,,,0.039252223722225,4.51768334,520.0,-173.15021002,-5.771673667333333,{'tags': []},-173.15021002,-5.771673667333333,-2.074956548222222,[],False,[],True,2021-05-12 11:00:42.526000,NM,30,3,mp-1218930,oxide,Sr2CaCu2(BiO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",GGA,mp-1218930,"['mp-1218930', 'mp-1359698', 'mp-1817714']",0.00011165,"{'Sr': 4.0, 'Ca': 2.0, 'Cu': 4.0, 'Bi': 4.0, 'O': 16.0}",470.7976286073367,[],NM,False,37,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.743014544498498e-07,0.00011165,0,0.0002233,MP,data/source/MP/cleaned/cifs/MP-mp-1218930.cif,True,,data/final/MP/graphs/Bi2Ca1Cu2Sr2O8.11-MP-mp-1218930-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Au1Nb2.85V0.15,3,0.0749999999999999,2.0,False,Au2Nb5.7V0.3,Au2Nb6,8.4,Other,True,Au25Nb71.25V3.75,Au-Nb-V,3,Supercon,Nb2.85V0.15Au1,MP-mp-2752,Nb6Au2,Au-Nb,Au25Nb75,P m -3 n,cubic,5.256336,5.256336,5.256336,data/final/MP/cifs/Au1Nb2.85V0.15-MP-mp-2752-synth_doped.cif,data/source/MP/raw/cifs/mp-2752.cif,mp-2752,0.0,,2011-05-14 04:00:34,10.878019698243486,10.17188/1201733,"@misc{osti_1201733,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Au (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201733"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677627'}},0.0265571000000033,5.43391329,520.0,-67.6805768,-8.4600721,{'tags': ['Gold niobium (1/3)']},-67.6805768,-8.4600721,-0.0656229350000003,"['xas', 'elasticity', 'bandstructure']",True,"[612199, 58557, 612192, 612186, 612203, 612188, 612198, 612185]",True,2021-05-12 10:56:18.721000,FM,8,8,mp-2752,,Nb3Au,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Au'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Au': 1.0}",GGA,mp-2752,"['mp-941043', 'mp-934500', 'mp-940884', 'mp-2752', 'mp-1437534', 'mp-1677627', 'mp-1787383', 'mp-1591584']",0.84123765,"{'Nb': 6.0, 'Au': 2.0}",145.22766553647008,[],FM,True,223,1,"[0.2, 0.2, 0.2, 0.2, 0.2, 0.2, 0.0, 0.0]",0.0115850881013954,0.84123765,6,1.6824753,MP,data/source/MP/cleaned/cifs/MP-mp-2752.cif,True,,data/final/MP/graphs/Au1Nb2.85V0.15-MP-mp-2752-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ta0.5V0.5,1,0.0,2.0,False,Ta1V1,Ta1V1,2.54,Other,True,Ta50V50,Ta-V,2,Supercon,Ta0.5V0.5,MP-mp-1217812,Ta1V1,Ta-V,Ta50V50,C m m m,orthorhombic,2.81199402,2.81199402,4.341361,data/final/MP/cifs/Ta0.5V0.5-MP-mp-1217812.cif,data/source/MP/raw/cifs/mp-1217812.cif,mp-1217812,0.0,,2019-01-12 19:05:12.238000,11.96040270853948,,,{'GGA': {'task_id': 'mp-1675696'}},0.1634680800000012,5.45409775,520.0,-20.77116494,-10.38558247,{'tags': []},-20.77116494,-10.38558247,0.0852593800000001,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,FM,2,5,mp-1217812,,TaV,"{'functional': 'PBE', 'labels': ['Ta_pv', 'V_pv'], 'pot_type': 'paw'}","{'Ta': 1.0, 'V': 1.0}",GGA,mp-1217812,"['mp-1217812', 'mp-1435957', 'mp-1675696', 'mp-1791590', 'mp-1606012']",0.4025704,"{'Ta': 1.0, 'V': 1.0}",32.19468307239578,[],FM,True,65,1,"[0.0, 0.3]",0.0125042510620385,0.4025704,1,0.4025704,MP,data/source/MP/cleaned/cifs/MP-mp-1217812.cif,False,,data/final/MP/graphs/Ta0.5V0.5-MP-mp-1217812.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Hf1N1.118,3,0.087144206124376,6.0,False,Hf6N6.708,Hf6N8,0.0,Other,True,Hf47.214N52.786,Hf-N,2,Supercon,Hf1N1.118,MP-mp-755988,Hf6N8,Hf-N,Hf42.857N57.143,F d -3 m,cubic,6.415418610000001,6.41541861,6.41541861,data/final/MP/cifs/Hf1N1.118-MP-mp-755988-synth_doped.cif,data/source/MP/raw/cifs/mp-755988.cif,mp-755988,0.9615,,2014-05-07 23:57:53,10.521350594503051,10.17188/1290285,"@misc{osti_1290285,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Hf3N4 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1290285"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1730347'}},0.0157412203571425,4.11417674,520.0,-149.51021699,-10.67930121357143,{'tags': []},-149.51021699,-10.67930121357143,-1.854508892142858,['bandstructure'],True,[],True,2021-05-12 10:58:57.544000,NM,14,7,mp-755988,,Hf3N4,"{'functional': 'PBE', 'labels': ['Hf_pv', 'N'], 'pot_type': 'paw'}","{'Hf': 3.0, 'N': 4.0}",GGA,mp-755988,"['mp-755988', 'mp-859389', 'mp-858593', 'mp-1402367', 'mp-1730347', 'mp-1882943', 'mp-859975']",6.7e-05,"{'Hf': 6.0, 'N': 8.0}",186.70674175272617,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",7.177030606504246e-07,6.7e-05,0,0.000134,MP,data/source/MP/cleaned/cifs/MP-mp-755988.cif,True,,data/final/MP/graphs/Hf1N1.118-MP-mp-755988-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ca2Cu3Ga1Sr2O9,1,0.0,2.0,False,Ca4Cu6Ga2Sr4O18,Ca4Cu6Ga2Sr4O18,71.5,Cuprate,True,Ca11.765Cu17.647Ga5.882Sr11.765O52.94117647058824,Ca-Cu-Ga-Sr-O,5,Supercon,Ca2Sr2Cu3Ga1O9,MP-mp-1209020,Sr4Ca4Ga2Cu6O18,Ca-Cu-Ga-Sr-O,Ca11.765Cu17.647Ga5.882Sr11.765O52.94117647058824,I m a 2,orthorhombic,5.3882780010773486,5.47885200127976,15.41222772,data/final/MP/cifs/Ca2Cu3Ga1Sr2O9-MP-mp-1209020.cif,data/source/MP/raw/cifs/mp-1209020.cif,mp-1209020,0.0,,2019-01-12 11:49:33.957000,4.972648998927004,,,,0.0271306076470576,2.8206056,520.0,-198.5586812,-5.839961211764706,{'tags': []},-198.5586812,-5.839961211764706,-2.247928756225491,[],False,[],True,2021-05-12 11:00:21.818000,NM,34,3,mp-1209020,oxide,Sr2Ca2Ga(CuO3)3,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Ga_d', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ca': 2.0, 'Ga': 1.0, 'Cu': 3.0, 'O': 9.0}",GGA,mp-1209020,"['mp-1209020', 'mp-1380291', 'mp-1926602']",0.08761555,"{'Sr': 4.0, 'Ca': 4.0, 'Ga': 2.0, 'Cu': 6.0, 'O': 18.0}",440.627643852704,[],NM,False,46,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0003976852166328,0.08761555,0,0.1752311,MP,data/source/MP/cleaned/cifs/MP-mp-1209020.cif,False,,data/final/MP/graphs/Ca2Cu3Ga1Sr2O9-MP-mp-1209020.json,0,True,mm2,0,0,0,6,0,0,0,0,0,1,0,1.0,False
Ca0.08Cu1La1.92O4,2,0.0228571428571428,1.0,True,Ca0.08Cu1La1.92O4,Cu1La2O4,15.0,Cuprate,True,Ca1.143Cu14.286La27.429O57.142857142857146,Ca-Cu-La-O,4,Supercon,La1.92Ca0.08Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ca0.08Cu1La1.92O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ca0.08Cu1La1.92O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Lu1Si3,1,0.0,1.0,True,Lu1Si3,Lu1Si3,6.78,Other,True,Lu25Si75,Lu-Si,2,Supercon,Lu1Si3,MP-mp-973668,Lu1Si3,Lu-Si,Lu25Si75,P m -3 m,cubic,4.077339,4.077339,4.077339,data/final/MP/cifs/Lu1Si3-MP-mp-973668.cif,data/source/MP/raw/cifs/mp-973668.cif,mp-973668,0.0,,2015-09-16 09:30:57,6.350281884960529,10.17188/1314183,"@misc{osti_1314183,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LuSi3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1314183"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1768176'}},0.2458516950000007,7.83314647,520.0,-21.55478119,-5.3886952975,{'tags': []},-21.55478119,-5.3886952975,-0.1362221525000002,"['xas', 'bandstructure']",True,[],True,2021-05-12 10:57:55.580000,NM,4,7,mp-973668,,LuSi3,"{'functional': 'PBE', 'labels': ['Lu_3', 'Si'], 'pot_type': 'paw'}","{'Lu': 1.0, 'Si': 3.0}",GGA,mp-973668,"['mp-973668', 'mp-1143828', 'mp-1249556', 'mp-1413527', 'mp-1768176', 'mp-1783307', 'mp-1618227']",0.003117,"{'Lu': 1.0, 'Si': 3.0}",67.78451044043072,[],NM,False,221,0,"[0, 0, 0, 0]",4.598395680292227e-05,0.003117,0,0.003117,MP,data/source/MP/cleaned/cifs/MP-mp-973668.cif,False,,data/final/MP/graphs/Lu1Si3-MP-mp-973668.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
B6Tb0.01Y0.99,2,0.0028571428571428,1.0,True,B6Tb0.01Y0.99,B6Y1,0.0,Other,True,B85.714Tb0.143Y14.143,B-Tb-Y,3,Supercon,B6Tb0.01Y0.99,MP-mp-2203,Y1B6,B-Y,B85.714Y14.286,P m -3 m,cubic,4.1021,4.1021,4.1021,data/final/MP/cifs/B6Tb0.01Y0.99-MP-mp-2203-synth_doped.cif,data/source/MP/raw/cifs/mp-2203.cif,mp-2203,0.0,,2011-05-12 20:11:15,3.699194842606093,10.17188/1197299,"@misc{osti_1197299,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YB6 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197299"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686414'}},0.0285229421428576,6.62579631,520.0,-49.33978236,-7.048540337142858,"{'tags': ['Yttrium boride (1/6)', 'Yttrium octahedro-hexaboride', 'Yttrium hexaboride']}",-49.33978236,-7.048540337142858,-0.3995658030952376,"['xas', 'elasticity', 'bandstructure']",True,"[194635, 615723, 54730, 615726, 615714, 659505, 76126, 615728, 615710]",True,2021-05-12 10:56:16.728000,NM,7,9,mp-2203,,YB6,"{'functional': 'PBE', 'labels': ['Y_sv', 'B'], 'pot_type': 'paw'}","{'Y': 1.0, 'B': 6.0}",GGA,mp-2203,"['mp-1000404', 'mp-1006875', 'mp-2203', 'mp-1077859', 'mp-1440131', 'mp-1686414', 'mp-1801281', 'mp-1011609', 'mp-1592923']",3.48e-05,"{'Y': 1.0, 'B': 6.0}",69.026957252261,[],NM,False,221,0,"[0, 0, 0, 0, 0, 0, 0]",5.041508620005138e-07,3.48e-05,0,3.48e-05,MP,data/source/MP/cleaned/cifs/MP-mp-2203.cif,True,,data/final/MP/graphs/B6Tb0.01Y0.99-MP-mp-2203-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Rh1Si1Ti1,1,0.0,4.0,False,Rh4Si4Ti4,Rh4Si4Ti4,5.1,Other,True,Rh33.333Si33.333Ti33.333,Rh-Si-Ti,3,Supercon,Ti1Rh1Si1,MP-mp-672645,Ti4Si4Rh4,Rh-Si-Ti,Rh33.333Si33.333Ti33.333,P n m a,orthorhombic,3.832653,6.276026,7.279585,data/final/MP/cifs/Rh1Si1Ti1-MP-mp-672645.cif,data/source/MP/raw/cifs/mp-672645.cif,mp-672645,0.0,,2013-10-15 05:59:43,6.784636780988309,10.17188/1281884,"@misc{osti_1281884,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TiSiRh (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281884"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704610'}},0.0,7.78977246,520.0,-94.38373509,-7.8653112575,{'tags': ['Rhodium titanium silicide (1/1/1)']},-94.38373509,-7.8653112575,-0.9466066219444436,"['bandstructure', 'elasticity']",True,[108723],True,2021-05-12 10:56:27.046000,NM,12,11,mp-672645,,TiSiRh,"{'functional': 'PBE', 'labels': ['Ti_pv', 'Si', 'Rh_pv'], 'pot_type': 'paw'}","{'Ti': 1.0, 'Si': 1.0, 'Rh': 1.0}",GGA,mp-672645,"['mp-672645', 'mp-944161', 'mp-934116', 'mp-944806', 'mp-1125279', 'mp-1133297', 'mp-1179016', 'mp-1430956', 'mp-1704610', 'mp-1779383', 'mp-1597908']",3.4525e-05,"{'Ti': 4.0, 'Si': 4.0, 'Rh': 4.0}",175.1018991650009,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",7.886836216999936e-07,3.4525e-05,0,0.0001381,MP,data/source/MP/cleaned/cifs/MP-mp-672645.cif,False,,data/final/MP/graphs/Rh1Si1Ti1-MP-mp-672645.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Li1.22Ti1.78O4,3,0.0628571428571428,2.0,False,Li2.44Ti3.56O8,Li2Ti4O8,0.0,Oxide,True,Li17.429Ti25.429O57.142857142857146,Li-Ti-O,3,Supercon,Li1.22Ti1.78O4,MP-mp-5670,Li2Ti4O8,Li-Ti-O,Li14.286Ti28.571O57.142857142857146,F d -3 m,cubic,5.986032260000001,5.98603226,5.98603226,data/final/MP/cifs/Li1.22Ti1.78O4-MP-mp-5670-synth_doped.cif,data/source/MP/raw/cifs/mp-5670.cif,mp-5670,0.0,,2011-05-14 11:10:22,3.649565337909552,10.17188/1273637,"@misc{osti_1273637,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LiTi2O4 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1273637"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699404'}},0.0,5.03116805,520.0,-114.93444733,-8.209603380714286,"{'tags': ['Lithium titanium oxide (1/2/4)', 'Lithium titanium(III) titanium(IV) oxide', 'Lithium titanium(III) titanium oxide', 'Lithium titanium titanium(III) oxide', 'Lithium titano(III)titanate', 'Spinel-(Li,Ti)']}",-114.93444733,-8.209603380714286,-3.2462103921428564,"['bandstructure', 'elasticity']",True,"[72859, 78482, 154982, 81329, 15789, 48127]",True,2021-05-12 10:56:22.739000,NM,14,7,mp-5670,oxide,LiTi2O4,"{'functional': 'PBE', 'labels': ['Li_sv', 'Ti_pv', 'O'], 'pot_type': 'paw'}","{'Li': 1.0, 'Ti': 2.0, 'O': 4.0}",GGA,mp-5670,"['mp-923613', 'mp-922835', 'mp-908534', 'mp-5670', 'mp-1418091', 'mp-1699404', 'mp-1787951']",0.0521081,"{'Li': 2.0, 'Ti': 4.0, 'O': 8.0}",151.67086379131675,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0006871207652868,0.0521081,0,0.1042162,MP,data/source/MP/cleaned/cifs/MP-mp-5670.cif,True,,data/final/MP/graphs/Li1.22Ti1.78O4-MP-mp-5670-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Be2Cr1,1,0.0,4.0,False,Be8Cr4,Be8Cr4,0.0,Other,True,Be66.667Cr33.333,Be-Cr,2,Supercon,Be2Cr1,MP-mp-30438,Be8Cr4,Be-Cr,Be66.667Cr33.333,P 63/m m c,hexagonal,4.198814004595678,4.19881436,6.910917,data/final/MP/cifs/Be2Cr1-MP-mp-30438.cif,data/source/MP/raw/cifs/mp-30438.cif,mp-30438,0.0,,2014-12-22 16:13:49,4.407724505572408,10.17188/1204846,"@misc{osti_1204846,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Be2Cr (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1204846"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698162'}},0.0,5.16767275,520.0,-71.17287371,-5.931072809166667,{'tags': ['Beryllium chromium (2/1)']},-71.17287371,-5.931072809166667,-0.2204484091666666,"['xas', 'elasticity', 'bandstructure']",True,"[616224, 58697]",True,2021-05-12 10:56:18.721000,NM,12,8,mp-30438,,Be2Cr,"{'functional': 'PBE', 'labels': ['Be_sv', 'Cr_pv'], 'pot_type': 'paw'}","{'Be': 2.0, 'Cr': 1.0}",GGA,mp-30438,"['mp-928181', 'mp-912117', 'mp-30438', 'mp-1414726', 'mp-1698162', 'mp-1931246', 'mp-928706', 'mp-1599804']",0.00041835,"{'Be': 8.0, 'Cr': 4.0}",105.51631871407923,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.5859158283700764e-05,0.00041835,0,0.0016734,MP,data/source/MP/cleaned/cifs/MP-mp-30438.cif,False,,data/final/MP/graphs/Be2Cr1-MP-mp-30438.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Al2Pd5Pu1,1,0.0,1.0,True,Al2Pd5Pu1,Al2Pd5Pu1,0.0,Heavy_fermion,True,Al25Pd62.5Pu12.5,Al-Pd-Pu,3,Supercon,Pu1Pd5Al2,MP-mp-1091385,Pu1Al2Pd5,Al-Pd-Pu,Al25Pd62.5Pu12.5,I 4/m m m,tetragonal,4.175633998145242,4.1756339981452415,8.08730538,data/final/MP/cifs/Al2Pd5Pu1-MP-mp-1091385.cif,data/source/MP/raw/cifs/mp-1091385.cif,mp-1091385,0.0,,2018-04-26 11:57:04,10.499662392985089,,,{'GGA': {'task_id': 'mp-1687938'}},0.2271489950000003,7.70413465,520.0,-51.90042724,-6.487553405,{'tags': ['Plutonium palladium aluminium (1/5/2)']},-51.90042724,-6.487553405,-0.5302535249999991,['bandstructure'],True,[166270],True,2021-05-12 10:58:18.470000,FM,8,6,mp-1091385,,PuAl2Pd5,"{'functional': 'PBE', 'labels': ['Pu', 'Al', 'Pd'], 'pot_type': 'paw'}","{'Pu': 1.0, 'Al': 2.0, 'Pd': 5.0}",GGA,mp-1091385,"['mp-1091385', 'mp-1248761', 'mp-1300229', 'mp-1687938', 'mp-1788185', 'mp-1593568']",0.1625505,"{'Pu': 1.0, 'Al': 2.0, 'Pd': 5.0}",131.27585591263392,[],FM,True,139,1,"[0.8, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0012382360706768,0.1625505,1,0.1625505,MP,data/source/MP/cleaned/cifs/MP-mp-1091385.cif,False,,data/final/MP/graphs/Al2Pd5Pu1-MP-mp-1091385.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Bi2Cu1Sr2O6.14,2,0.0114248408682878,1.9543493485342016,False,Bi3.909Cu1.954Sr3.909O12,Bi4Cu2Sr4O12,14.0,Cuprate,True,Bi17.953Cu8.977Sr17.953O55.11669658886894,Bi-Cu-Sr-O,4,Supercon,Bi2Sr2Cu1O6.14,MP-mp-555827,Sr4Cu2Bi4O12,Bi-Cu-Sr-O,Bi18.182Cu9.091Sr18.182O54.54545454545455,C c c m,orthorhombic,5.133052,5.52519599964684,13.01880065,data/final/MP/cifs/Bi2Cu1Sr2O6.14-MP-mp-555827-synth_doped.cif,data/source/MP/raw/cifs/mp-555827.cif,mp-555827,0.0,,2014-02-22 10:13:35,6.928457216674172,10.17188/1269010,"@misc{osti_1269010,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr2Cu(BiO3)2 (SG:66) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1269010"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1707731'}},0.0585641377272736,4.75363105,520.0,-126.5422218,-5.7519191727272725,{'tags': ['Dibismuth distrontium copper hexaoxide']},-126.5422218,-5.7519191727272725,-2.0406438793939388,"['xas', 'bandstructure']",True,[67426],True,2021-05-12 10:57:17.297000,NM,22,8,mp-555827,oxide,Sr2Cu(BiO3)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Cu': 1.0, 'Bi': 2.0, 'O': 6.0}",GGA,mp-555827,"['mp-932594', 'mp-931549', 'mp-918058', 'mp-555827', 'mp-1418436', 'mp-1707731', 'mp-1837530', 'mp-1605675']",0.00627605,"{'Sr': 4.0, 'Cu': 2.0, 'Bi': 4.0, 'O': 12.0}",360.8189966762927,[],NM,False,66,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",3.478780251490214e-05,0.00627605,0,0.0125521,MP,data/source/MP/cleaned/cifs/MP-mp-555827.cif,True,,data/final/MP/graphs/Bi2Cu1Sr2O6.14-MP-mp-555827-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Nd0.2Os4Pr0.8Sb12,3,0.0235294117647058,1.0,True,Nd0.2Os4Pr0.8Sb12,Os4Pr1Sb12,1.52,Heavy_fermion,True,Nd1.176Os23.529Pr4.706Sb70.588,Nd-Os-Pr-Sb,4,Supercon,Pr0.8Nd0.2Os4Sb12,MP-mp-4251,Pr1Sb12Os4,Os-Pr-Sb,Os23.529Pr5.882Sb70.588,I m -3,cubic,8.16020751180899,8.16020751,8.16020751,data/final/MP/cifs/Nd0.2Os4Pr0.8Sb12-MP-mp-4251-synth_doped.cif,data/source/MP/raw/cifs/mp-4251.cif,mp-4251,0.0,,2011-05-15 09:44:04,9.380402650313032,10.17188/1208003,"@misc{osti_1208003,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Pr(Sb3Os)4 (SG:204) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208003"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700242'}},0.0086126564705901,7.28147826,520.0,-102.089288,-6.005252235294117,{'tags': ['Praseodymium osmium antimonide (1/4/12)']},-102.089288,-6.005252235294117,-0.1677005267647063,"['xas', 'elasticity', 'bandstructure']",True,"[155178, 155187, 165911, 155182, 155185, 155181, 647731, 155183, 155188, 155180, 155179, 165910, 155184, 155186, 183087]",True,2021-05-12 10:56:20.740000,NM,17,9,mp-4251,,Pr(Sb3Os)4,"{'functional': 'PBE', 'labels': ['Pr_3', 'Sb', 'Os_pv'], 'pot_type': 'paw'}","{'Pr': 1.0, 'Sb': 12.0, 'Os': 4.0}",GGA,mp-4251,"['mp-1000443', 'mp-1006919', 'mp-4251', 'mp-1188290', 'mp-1430112', 'mp-1700242', 'mp-1817791', 'mp-1011635', 'mp-1609307']",0.0526026,"{'Pr': 1.0, 'Sb': 12.0, 'Os': 4.0}",418.2940787754696,[],NM,False,204,0,"[-0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.000125755067234,0.0526026,0,0.0526026,MP,data/source/MP/cleaned/cifs/MP-mp-4251.cif,True,,data/final/MP/graphs/Nd0.2Os4Pr0.8Sb12-MP-mp-4251-synth_doped.json,0,True,m-3,2,0,0,0,0,0,0,0,0,1,0,1.0,False
Mg0.47Tl0.53,3,0.06,2.0,False,Mg0.94Tl1.06,Mg1Tl1,2.75,Other,True,Mg47Tl53,Mg-Tl,2,Supercon,Mg0.47Tl0.53,MP-mp-11498,Mg1Tl1,Mg-Tl,Mg50Tl50,P m -3 m,cubic,3.691257,3.691257,3.691257,data/final/MP/cifs/Mg0.47Tl0.53-MP-mp-11498-synth_doped.cif,data/source/MP/raw/cifs/mp-11498.cif,mp-11498,0.0,,2011-05-27 17:58:30,7.550404048694951,10.17188/1188009,"@misc{osti_1188009,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MgTl (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188009"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672962'}},0.0,5.59265911,520.0,-4.03588904,-2.01794452,{'tags': ['Magnesium thallium (1/1)']},-4.03588904,-2.01794452,-0.0364829216666664,"['xas', 'elasticity', 'bandstructure']",True,[104884],True,2021-05-12 10:56:12.755000,NM,2,8,mp-11498,,MgTl,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Tl_d'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Tl': 1.0}",GGA,mp-11498,"['mp-993459', 'mp-991512', 'mp-11498', 'mp-1140643', 'mp-1439598', 'mp-1672962', 'mp-1792997', 'mp-994760']",0.0009901,"{'Mg': 1.0, 'Tl': 1.0}",50.29477280622854,[],NM,False,221,0,"[0, 0]",1.9685942390366764e-05,0.0009901,0,0.0009901,MP,data/source/MP/cleaned/cifs/MP-mp-11498.cif,True,,data/final/MP/graphs/Mg0.47Tl0.53-MP-mp-11498-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
H2Th1,1,0.0,1.0,True,H2Th1,H2Th1,0.0,Other,True,H66.667Th33.333,H-Th,2,Supercon,H2Th1,MP-mp-24291,Th1H2,H-Th,H66.667Th33.333,I 4/m m m,tetragonal,3.79407713027935,3.79407713,3.79407713,data/final/MP/cifs/H2Th1-MP-mp-24291.cif,data/source/MP/raw/cifs/mp-24291.cif,mp-24291,0.0,,2014-02-19 10:33:52,9.521679108306428,10.17188/1200017,"@misc{osti_1200017,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ThH2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1200017"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686561'}},0.0,6.64499555,520.0,-15.62840339,-5.209467796666667,"{'tags': ['Thorium hydride (1/2)', 'Thorium hydride (1/2) - bct', 'Thorium(II) hydride']}",-15.62840339,-5.209467796666667,-0.5956976833333337,"['xas', 'elasticity', 'bandstructure']",True,"[654527, 24623, 56178, 180580]",True,2021-05-12 10:56:16.728000,NM,3,8,mp-24291,,ThH2,"{'functional': 'PBE', 'labels': ['Th', 'H'], 'pot_type': 'paw'}","{'Th': 1.0, 'H': 2.0}",GGA,mp-24291,"['mp-950632', 'mp-939341', 'mp-949824', 'mp-24291', 'mp-1440258', 'mp-1686561', 'mp-1792613', 'mp-1591493']",0.0005439,"{'Th': 1.0, 'H': 2.0}",40.817980383586,[],NM,False,139,0,"[0, 0, 0]",1.332501007861518e-05,0.0005439,0,0.0005439,MP,data/source/MP/cleaned/cifs/MP-mp-24291.cif,False,,data/final/MP/graphs/H2Th1-MP-mp-24291.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Co1Ti1,1,0.0,1.0,True,Co1Ti1,Co1Ti1,0.71,Other,True,Co50Ti50,Co-Ti,2,Supercon,Co1Ti1,MP-mp-823,Ti1Co1,Co-Ti,Co50Ti50,P m -3 m,cubic,2.978077,2.978077,2.978077,data/final/MP/cifs/Co1Ti1-MP-mp-823.cif,data/source/MP/raw/cifs/mp-823.cif,mp-823,0.0,,2011-05-12 18:25:46,6.714495321842168,10.17188/1282130,"@misc{osti_1282130,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TiCo (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1282130"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686725'}},0.0,6.47001277,520.0,-15.80484391,-7.902421955,"{'tags': ['Cobalt titanium (1/2)', 'Titanium cobalt (1/1)', 'Cobalt titanium (1/1)']}",-15.80484391,-7.902421955,-0.4005170491666669,"['bandstructure', 'elasticity']",True,"[150937, 108322, 625488, 625477, 625473, 102705, 187975, 189225]",True,2021-05-12 10:56:31.128000,FM,2,17,mp-823,,TiCo,"{'functional': 'PBE', 'labels': ['Ti_pv', 'Co'], 'pot_type': 'paw'}","{'Ti': 1.0, 'Co': 1.0}",GGA,mp-823,"['mp-823', 'mp-990532', 'mp-992197', 'mp-1060570', 'mp-1060594', 'mp-1060679', 'mp-1061358', 'mp-1061384', 'mp-1061484', 'mp-1440917', 'mp-1686725', 'mp-1791192', 'mp-993834', 'mp-1593534', 'mp-1592277', 'mp-1061486', 'mp-1060651']",0.8779597,"{'Ti': 1.0, 'Co': 1.0}",26.412394024774137,[],FM,True,221,1,"[0.0, 0.9]",0.0332404438301388,0.8779597,1,0.8779597,MP,data/source/MP/cleaned/cifs/MP-mp-823.cif,False,,data/final/MP/graphs/Co1Ti1-MP-mp-823.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
La2.706Pr0.294Tl1,3,0.147,1.0,True,La2.706Pr0.294Tl1,La3Tl1,5.25,Other,True,La67.65Pr7.35Tl25,La-Pr-Tl,3,Supercon,La2.706Pr0.294Tl1,MP-mp-371,La3Tl1,La-Tl,La75Tl25,P m -3 m,cubic,5.080077,5.080077,5.080077,data/final/MP/cifs/La2.706Pr0.294Tl1-MP-mp-371-synth_doped.cif,data/source/MP/raw/cifs/mp-371.cif,mp-371,0.0,,2011-05-13 01:00:39,7.866825897387702,10.17188/1207308,"@misc{osti_1207308,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La3Tl (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207308"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696891'}},0.0,8.20468759,520.0,-18.13168413,-4.5329210325,{'tags': ['Lanthanum thallium (3/1)']},-18.13168413,-4.5329210325,-0.240254917083333,"['xas', 'bandstructure']",True,"[642071, 104732]",True,2021-05-12 10:57:06.958000,NM,4,8,mp-371,,La3Tl,"{'functional': 'PBE', 'labels': ['La', 'Tl_d'], 'pot_type': 'paw'}","{'La': 3.0, 'Tl': 1.0}",GGA,mp-371,"['mp-929022', 'mp-912604', 'mp-929400', 'mp-371', 'mp-1441859', 'mp-1696891', 'mp-1779718', 'mp-1597062']",0.0883015,"{'La': 3.0, 'Tl': 1.0}",131.10247336875844,[],NM,False,221,0,"[0, 0, 0, 0]",0.0006735303898625,0.0883015,0,0.0883015,MP,data/source/MP/cleaned/cifs/MP-mp-371.cif,True,,data/final/MP/graphs/La2.706Pr0.294Tl1-MP-mp-371-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Al0.8Ga0.2Nb3,3,0.0999999999999999,2.0,False,Al1.6Ga0.4Nb6,Al2Nb6,18.395,Other,True,Al20Ga5Nb75,Al-Ga-Nb,3,Supercon,Nb3Al0.8Ga0.2,MP-mp-796,Nb6Al2,Al-Nb,Al25Nb75,P m -3 n,cubic,5.215254,5.215254,5.215254,data/final/MP/cifs/Al0.8Ga0.2Nb3-MP-mp-796-synth_doped.cif,data/source/MP/raw/cifs/mp-796.cif,mp-796,0.0,,2011-05-13 16:07:37,7.157298025966356,,,{'GGA': {'task_id': 'mp-1686893'}},0.0460773865000003,5.52947534,520.0,-69.48918494,-8.6861481175,"{'tags': ['Aluminium niobium (1/3)', 'Niobium aluminide (3/1)', 'Aluminum niobium (1/3)']}",-69.48918494,-8.6861481175,-0.1737753800000003,"['bandstructure', 'elasticity']",True,"[608675, 608654, 608688, 608668, 608669, 608685, 608676, 608683, 58014, 608657, 107856, 608655, 608666, 608691, 608656, 608665, 608673, 608653, 608661]",True,2021-05-12 10:56:31.128000,NM,8,10,mp-796,,Nb3Al,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Al': 1.0}",GGA,mp-796,"['mp-911586', 'mp-927906', 'mp-796', 'mp-927472', 'mp-1260512', 'mp-1440919', 'mp-1686893', 'mp-1927652', 'mp-1591599', 'mp-1587739']",0.16323955,"{'Nb': 6.0, 'Al': 2.0}",141.8490379078192,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0023015954483396,0.16323955,0,0.3264791,MP,data/source/MP/cleaned/cifs/MP-mp-796.cif,True,,data/final/MP/graphs/Al0.8Ga0.2Nb3-MP-mp-796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Nb3Si0.6Sn0.4,2,0.0499999999999999,2.0,False,Nb6Si1.2Sn0.8,Nb6Si1Sn1,6.5,Other,True,Nb75Si15Sn10,Nb-Si-Sn,3,Supercon,Nb3Si0.6Sn0.4,MP-mp-1220364,Nb6Si1Sn1,Nb-Si-Sn,Nb75Si12.5Sn12.5,P m -3,cubic,5.236963,5.236963,5.236963,data/final/MP/cifs/Nb3Si0.6Sn0.4-MP-mp-1220364-synth_doped.cif,data/source/MP/raw/cifs/mp-1220364.cif,mp-1220364,0.0,,2019-01-12 21:13:22.751000,8.141931305487384,,,{'GGA': {'task_id': 'mp-1751428'}},0.0709012627083343,6.36846422,520.0,-71.87120737,-8.98390092125,{'tags': []},-71.87120737,-8.98390092125,-0.2285614068749986,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,8,5,mp-1220364,,Nb6SiSn,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Si', 'Sn_d'], 'pot_type': 'paw'}","{'Nb': 6.0, 'Si': 1.0, 'Sn': 1.0}",GGA,mp-1220364,"['mp-1220364', 'mp-1389036', 'mp-1751428', 'mp-1930712', 'mp-1620555']",0.3092932,"{'Nb': 6.0, 'Si': 1.0, 'Sn': 1.0}",143.62780276974934,[],NM,False,200,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0021534354354485,0.3092932,0,0.3092932,MP,data/source/MP/cleaned/cifs/MP-mp-1220364.cif,True,,data/final/MP/graphs/Nb3Si0.6Sn0.4-MP-mp-1220364-synth_doped.json,0,True,m-3,2,0,0,0,0,0,0,1,0,0,0,1.0,False
Al1Au2Sc1,1,0.0,1.0,True,Al1Au2Sc1,Al1Au2Sc1,4.4,Other,True,Al25Au50Sc25,Al-Au-Sc,3,Supercon,Al1Sc1Au2,MP-mp-10873,Sc1Al1Au2,Al-Au-Sc,Al25Au50Sc25,F m -3 m,cubic,4.672481,4.672480999999999,4.672480999999999,data/final/MP/cifs/Al1Au2Sc1-MP-mp-10873.cif,data/source/MP/raw/cifs/mp-10873.cif,mp-10873,0.0,,2011-05-27 22:35:24,10.72473960877334,10.17188/1187417,"@misc{osti_1187417,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ScAlAu2 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187417"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698581'}},0.0,6.16998305,520.0,-19.44598505,-4.8614962625,{'tags': ['Aluminium gold scandium (1/2/1)']},-19.44598505,-4.8614962625,-0.7050442587500001,"['xas', 'elasticity', 'bandstructure']",True,[57505],True,2021-05-12 10:56:10.715000,NM,4,9,mp-10873,,ScAlAu2,"{'functional': 'PBE', 'labels': ['Sc_sv', 'Al', 'Au'], 'pot_type': 'paw'}","{'Sc': 1.0, 'Al': 1.0, 'Au': 2.0}",GGA,mp-10873,"['mp-10873', 'mp-927441', 'mp-911514', 'mp-927860', 'mp-1251656', 'mp-1476192', 'mp-1698581', 'mp-1799880', 'mp-1592187']",0.0016182,"{'Sc': 1.0, 'Al': 1.0, 'Au': 2.0}",72.13194357813579,[],NM,False,225,0,"[0, 0, 0, 0]",2.243388878392151e-05,0.0016182,0,0.0016182,MP,data/source/MP/cleaned/cifs/MP-mp-10873.cif,False,,data/final/MP/graphs/Al1Au2Sc1-MP-mp-10873.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ce0.06In1La2.94,2,0.03,1.0,True,Ce0.06In1La2.94,In1La3,5.58,Other,True,Ce1.5In25La73.5,Ce-In-La,3,Supercon,La2.94Ce0.06In1,MP-mp-20909,La3In1,In-La,In25La75,P m -3 m,cubic,5.076766,5.076766,5.076766,data/final/MP/cifs/Ce0.06In1La2.94-MP-mp-20909-synth_doped.cif,data/source/MP/raw/cifs/mp-20909.cif,mp-20909,0.0,,2014-02-21 06:52:52,6.7455760598452565,10.17188/1196104,"@misc{osti_1196104,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La3In (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196104"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671685'}},0.0,8.16935076,520.0,-18.73796121,-4.6844903025,"{'tags': ['Indium lanthanum (1/3)', 'Lanthanum indium (3/1)']}",-18.73796121,-4.6844903025,-0.2945640412500001,"['xas', 'bandstructure']",True,"[639844, 51950, 639851, 639840, 603208, 107019]",True,2021-05-12 10:56:57.051000,NM,4,8,mp-20909,,La3In,"{'functional': 'PBE', 'labels': ['La', 'In_d'], 'pot_type': 'paw'}","{'La': 3.0, 'In': 1.0}",GGA,mp-20909,"['mp-906743', 'mp-921394', 'mp-920373', 'mp-20909', 'mp-1476042', 'mp-1671685', 'mp-1778647', 'mp-1590323']",0.0489742,"{'La': 3.0, 'In': 1.0}",130.84629766481785,[],NM,False,221,0,"[0, 0, 0, 0]",0.0003742880071811,0.0489742,0,0.0489742,MP,data/source/MP/cleaned/cifs/MP-mp-20909.cif,True,,data/final/MP/graphs/Ce0.06In1La2.94-MP-mp-20909-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Hf1V2.3,3,0.0606060606060605,1.7390652173913046,False,Hf1.739V4,Hf2V4,9.2,Other,True,Hf30.303V69.697,Hf-V,2,Supercon,Hf1V2.3,MP-mp-1071274,Hf2V4,Hf-V,Hf33.333V66.667,I m m a,orthorhombic,5.12363999937376,5.168692930000001,5.168692929701653,data/final/MP/cifs/Hf1V2.3-MP-mp-1071274-synth_doped.cif,data/source/MP/raw/cifs/mp-1071274.cif,mp-1071274,0.0,,2018-03-22 04:57:58,9.4965077073998,,,{'GGA': {'task_id': 'mp-1759566'}},0.0342260283333324,5.08952326,520.0,-56.04464581,-9.340774301666666,{'tags': ['Hafnium vanadium (1/2)']},-56.04464581,-9.340774301666666,0.0342260283333324,['bandstructure'],True,"[187952, 187953]",True,2021-05-12 10:58:14.654000,NM,6,10,mp-1071274,,HfV2,"{'functional': 'PBE', 'labels': ['Hf_pv', 'V_pv'], 'pot_type': 'paw'}","{'Hf': 1.0, 'V': 2.0}",GGA,mp-1071274,"['mp-1071274', 'mp-1071328', 'mp-1071426', 'mp-1076955', 'mp-1415637', 'mp-1759566', 'mp-1795847', 'mp-1927019', 'mp-1617061', 'mp-1071367']",0.0158748,"{'Hf': 2.0, 'V': 4.0}",98.0508485992305,[],NM,False,74,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0003238074983906,0.0158748,0,0.0317496,MP,data/source/MP/cleaned/cifs/MP-mp-1071274.cif,True,,data/final/MP/graphs/Hf1V2.3-MP-mp-1071274-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,0,1,0,1.0,False
Ga1.2Si0.8Sr1,3,0.1333333333333333,1.0,True,Ga1.2Si0.8Sr1,Ga1Si1Sr1,4.75,Other,True,Ga40Si26.667Sr33.333,Ga-Si-Sr,3,Supercon,Sr1Ga1.2Si0.8,MP-mp-1218262,Sr1Ga1Si1,Ga-Si-Sr,Ga33.333Si33.333Sr33.333,P -6 m 2,hexagonal,4.2209479997069455,4.220947830000001,4.723355,data/final/MP/cifs/Ga1.2Si0.8Sr1-MP-mp-1218262-synth_doped.cif,data/source/MP/raw/cifs/mp-1218262.cif,mp-1218262,0.0,,2019-01-12 19:27:35.341000,4.224977327446255,,,{'GGA': {'task_id': 'mp-1767455'}},0.0,4.14906217,520.0,-11.52735393,-3.84245131,{'tags': []},-11.52735393,-3.84245131,-0.4378168113888889,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,3,5,mp-1218262,,SrGaSi,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ga_d', 'Si'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Ga': 1.0, 'Si': 1.0}",GGA,mp-1218262,"['mp-1218262', 'mp-1432931', 'mp-1767455', 'mp-1801429', 'mp-1611910']",0.0052074,"{'Sr': 1.0, 'Ga': 1.0, 'Si': 1.0}",72.87879778923026,[],NM,False,187,0,"[0, 0, 0]",7.14528800963499e-05,0.0052074,0,0.0052074,MP,data/source/MP/cleaned/cifs/MP-mp-1218262.cif,True,,data/final/MP/graphs/Ga1.2Si0.8Sr1-MP-mp-1218262-synth_doped.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Rb0.14W1O3,2,0.0123671497584539,6.0,False,Rb0.84W6O18,Rb1W6O18,5.1,Oxide,True,Rb3.382W24.155O72.46376811594202,Rb-W-O,3,Supercon,Rb0.14W1O3,MP-mp-698610,Rb2W12O36,Rb-W-O,Rb4W24O72,I m m m,orthorhombic,7.517873,7.73016,8.453532552068545,data/final/MP/cifs/Rb0.14W1O3-MP-mp-698610-synth_doped.cif,data/source/MP/raw/cifs/mp-698610.cif,mp-698610,0.0,,2014-05-03 10:33:20,6.479585148375198,10.17188/1285396,"@misc{osti_1285396,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Rb(WO3)6 (SG:58) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1285396"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-948538'}},0.0,2.14597584,520.0,-369.09548382,-7.3819096764,{'tags': []},-369.09548382,-7.3819096764,-2.2299660371000005,[],False,[],True,2021-05-12 11:01:44.406000,NM,50,6,mp-698610,oxide,Rb(WO3)6,"{'functional': 'PBE', 'labels': ['Rb_sv', 'W_pv', 'O'], 'pot_type': 'paw'}","{'Rb': 1.0, 'W': 6.0, 'O': 18.0}",GGA+U,mp-698610,"['mp-698610', 'mp-938151', 'mp-948538', 'mp-949215', 'mp-1359932', 'mp-1892222']",0.0029009,"{'Rb': 2.0, 'W': 12.0, 'O': 36.0}",756.7709642128867,[],NM,False,4,0,"[0.0, 0.0, 0.0, -0.0, 0.0, -0.0, -0.0, -0.0, 0.0, 0.0, 0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",7.666520353399684e-06,0.0029009,0,0.0058018,MP,data/source/MP/cleaned/cifs/MP-mp-698610.cif,True,,data/final/MP/graphs/Rb0.14W1O3-MP-mp-698610-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,0,1,0,1.0,False
Ni2P2Sc2Sr4O6,1,0.0,1.0,True,Ni2P2Sc2Sr4O6,Ni2P2Sc2Sr4O6,3.525,Ferrite,True,Ni12.5P12.5Sc12.5Sr25O37.5,Ni-P-Sc-Sr-O,5,Supercon,Ni2P2Sr4Sc2O6,MP-mp-1189201,Sr4Sc2Ni2P2O6,Ni-P-Sc-Sr-O,Ni12.5P12.5Sc12.5Sr25O37.5,P 4/n m m,tetragonal,4.081001,4.081001,15.210651,data/final/MP/cifs/Ni2P2Sc2Sr4O6-MP-mp-1189201.cif,data/source/MP/raw/cifs/mp-1189201.cif,mp-1189201,0.0,,2019-01-11 20:00:58.547000,4.691509419702389,,,,0.2374498030431553,4.80867689,520.0,-100.9030364,-6.306439775,{'tags': ['Dinickel diphosphide tetrastrontium discandium hexaoxide']},-100.9030364,-6.306439775,-2.413092498333333,[],False,[180269],True,2021-05-12 10:59:54.607000,NM,16,2,mp-1189201,oxide,Sr2ScNiPO3,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Sc_sv', 'Ni_pv', 'P', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Sc': 1.0, 'Ni': 1.0, 'P': 1.0, 'O': 3.0}",GGA+U,mp-1189201,"['mp-1189201', 'mp-1879462']",0.00282235,"{'Sr': 4.0, 'Sc': 2.0, 'Ni': 2.0, 'P': 2.0, 'O': 6.0}",253.32683907855963,[],NM,False,129,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.2282281737425823e-05,0.00282235,0,0.0056447,MP,data/source/MP/cleaned/cifs/MP-mp-1189201.cif,False,,data/final/MP/graphs/Ni2P2Sc2Sr4O6-MP-mp-1189201.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Co2Zr1,1,0.0,2.0,False,Co4Zr2,Co4Zr2,0.0,Other,True,Co66.667Zr33.333,Co-Zr,2,Supercon,Co2Zr1,MP-mp-929,Zr2Co4,Co-Zr,Co66.667Zr33.333,F d -3 m,cubic,4.88536115,4.88536115,4.885361149999999,data/final/MP/cifs/Co2Zr1-MP-mp-929.cif,data/source/MP/raw/cifs/mp-929.cif,mp-929,0.0,,2011-05-13 08:17:55,8.422444143379728,10.17188/1313114,"@misc{osti_1313114,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrCo2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1313114"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668665'}},0.0,5.41148948,520.0,-47.39702675,-7.899504458333333,"{'tags': ['Zirconium cobalt hydride (1/2/0.17)', 'Cobalt zirconium (2/1)', 'Zirconium cobalt (1/2)']}",-47.39702675,-7.899504458333333,-0.3113923850000013,"['xas', 'elasticity', 'bandstructure']",True,"[625679, 625689, 189945, 625668, 625709, 656651, 625696, 625693, 604257, 625691, 625692, 625694, 603796, 625697, 102743, 603222, 625678, 625705, 102742, 625700, 96317]",True,2021-05-12 10:56:35.166000,NM,6,14,mp-929,,ZrCo2,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Co'], 'pot_type': 'paw'}","{'Zr': 1.0, 'Co': 2.0}",GGA,mp-929,"['mp-911940', 'mp-928058', 'mp-928583', 'mp-929', 'mp-1071642', 'mp-1071682', 'mp-1071569', 'mp-1077048', 'mp-1440732', 'mp-1668665', 'mp-1799292', 'mp-1591046', 'mp-1593083', 'mp-1071693']",0.0211448,"{'Zr': 2.0, 'Co': 4.0}",82.44703203369792,[],NM,False,227,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0005129305319652,0.0211448,0,0.0422896,MP,data/source/MP/cleaned/cifs/MP-mp-929.cif,False,,data/final/MP/graphs/Co2Zr1-MP-mp-929.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ir0.26Mo0.74,2,0.02,8.0,False,Ir2.08Mo5.92,Ir2Mo6,6.7,Other,True,Ir26Mo74,Ir-Mo,2,Supercon,Ir0.26Mo0.74,MP-mp-1120,Mo6Ir2,Ir-Mo,Ir25Mo75,P m -3 n,cubic,5.002782,5.002782,5.002782,data/final/MP/cifs/Ir0.26Mo0.74-MP-mp-1120-synth_doped.cif,data/source/MP/raw/cifs/mp-1120.cif,mp-1120,0.0,,2011-05-14 06:35:22,12.732657890506024,10.17188/1187628,"@misc{osti_1187628,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Mo3Ir (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187628"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696532'}},0.0650161950000001,8.5849993,520.0,-83.54743211,-10.44342901375,"{'tags': ['Iridium molydenum (1/3)', 'Iridium molybdenum (1/3)']}",-83.54743211,-10.44342901375,-0.0995891362499996,"['xas', 'elasticity', 'bandstructure']",True,"[640816, 600761, 640819, 640823]",True,2021-05-12 10:56:10.715000,NM,8,8,mp-1120,,Mo3Ir,"{'functional': 'PBE', 'labels': ['Mo_pv', 'Ir'], 'pot_type': 'paw'}","{'Mo': 3.0, 'Ir': 1.0}",GGA,mp-1120,"['mp-913557', 'mp-929931', 'mp-930423', 'mp-1120', 'mp-1414666', 'mp-1696532', 'mp-1803707', 'mp-1588387']",0.0177488,"{'Mo': 6.0, 'Ir': 2.0}",125.20876611439137,[],NM,False,131,0,"[-0.0, -0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0]",0.0002835073062501,0.0177488,0,0.0354976,MP,data/source/MP/cleaned/cifs/MP-mp-1120.cif,True,,data/final/MP/graphs/Ir0.26Mo0.74-MP-mp-1120-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Cu1Hg1O4.32,2,0.0384615384615384,0.9259814814814816,True,Ba1.852Cu0.926Hg0.926O4,Ba2Cu1Hg1O4,0.0,Cuprate,True,Ba24.038Cu12.019Hg12.019O51.92307692307692,Ba-Cu-Hg-O,4,Supercon,Hg1Ba2Cu1O4.32,MP-mp-6562,Ba2Cu1Hg1O4,Ba-Cu-Hg-O,Ba25Cu12.5Hg12.5O50,P 4/m m m,tetragonal,3.933714,3.933714,9.827602,data/final/MP/cifs/Ba2Cu1Hg1O4.32-MP-mp-6562-synth_doped.cif,data/source/MP/raw/cifs/mp-6562.cif,mp-6562,0.0,,2011-05-13 18:18:06,6.582036471328142,10.17188/1281336,"@misc{osti_1281336,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2CuHgO4 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281336"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697135'}},0.0234340381250053,2.58068675,520.0,-40.91481298,-5.1143516225,"{'tags': ['Mercury dibarium copper oxide', 'High pressure experimental phase']}",-40.91481298,-5.1143516225,-1.953767533125,"['xas', 'bandstructure']",True,"[75722, 75720, 75724, 75721, 75723]",True,2021-05-12 10:57:32.679000,NM,8,8,mp-6562,oxide,Ba2CuHgO4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Cu_pv', 'Hg', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",GGA,mp-6562,"['mp-6562', 'mp-990899', 'mp-992892', 'mp-1435690', 'mp-1697135', 'mp-1878488', 'mp-994198', 'mp-1592659']",0.0003984,"{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",152.07335344042525,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0, 0, 0]",2.619788352047311e-06,0.0003984,0,0.0003984,MP,data/source/MP/cleaned/cifs/MP-mp-6562.cif,True,,data/final/MP/graphs/Ba2Cu1Hg1O4.32-MP-mp-6562-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Si1Ti0.15V2.85,3,0.0749999999999999,2.0,False,Si2Ti0.3V5.7,Si2V6,14.55,Other,True,Si25Ti3.75V71.25,Si-Ti-V,3,Supercon,Si1Ti0.15V2.85,MP-mp-2567,V6Si2,Si-V,Si25V75,P m -3 n,cubic,4.702381,4.702381,4.702381,data/final/MP/cifs/Si1Ti0.15V2.85-MP-mp-2567-synth_doped.cif,data/source/MP/raw/cifs/mp-2567.cif,mp-2567,0.0,,2011-05-13 19:15:43,5.778142190030859,10.17188/1200874,"@misc{osti_1200874,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Si (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1200874"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668672'}},0.0,7.30599425,520.0,-69.05773321,-8.63221665125,{'tags': ['Vanadium silicide (3/1)']},-69.05773321,-8.63221665125,-0.4452085937499994,"['xas', 'elasticity', 'bandstructure']",True,"[652491, 87328, 652522, 652502, 652510, 652520, 600518, 186003, 652507, 652513, 652497, 601150, 652514, 652487, 22412, 652509, 652529, 652532, 652499, 652539, 652537, 652533, 652512, 652538, 652490, 652493, 652494, 652511, 652519, 87329, 652526, 652500]",True,2021-05-12 10:56:18.721000,FM,8,13,mp-2567,,V3Si,"{'functional': 'PBE', 'labels': ['V_pv', 'Si'], 'pot_type': 'paw'}","{'V': 3.0, 'Si': 1.0}",GGA,mp-2567,"['mp-920081', 'mp-906309', 'mp-919083', 'mp-2567', 'mp-1078474', 'mp-1078852', 'mp-1138781', 'mp-1145907', 'mp-1440678', 'mp-1668672', 'mp-1795955', 'mp-1593554', 'mp-1596575']",0.8382519,"{'V': 6.0, 'Si': 2.0}",103.98086881866836,[],FM,True,131,1,"[0.2, 0.3, 0.3, 0.2, 0.3, 0.3, 0.0, 0.0]",0.0161231947669493,0.8382519,6,1.6765038,MP,data/source/MP/cleaned/cifs/MP-mp-2567.cif,True,,data/final/MP/graphs/Si1Ti0.15V2.85-MP-mp-2567-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Cu1S1Se1,1,0.0,4.0,False,Cu4S4Se4,Cu4S4Se4,1.625,Other,True,Cu33.333S33.333Se33.333,Cu-S-Se,3,Supercon,Cu1S1Se1,MP-mp-1225747,Cu4Se4S4,Cu-S-Se,Cu33.333S33.333Se33.333,P 21 3,cubic,5.985369,5.985369,5.985369,data/final/MP/cifs/Cu1S1Se1-MP-mp-1225747.cif,data/source/MP/raw/cifs/mp-1225747.cif,mp-1225747,0.0,,2019-01-13 01:48:51.829000,5.407647804081031,,,{'GGA': {'task_id': 'mp-1732458'}},0.1857228570555529,5.45680013,520.0,-47.69690271,-3.9747418925,{'tags': []},-47.69690271,-3.9747418925,-0.2318858876562502,[],False,[],True,2021-05-12 11:00:54.298000,NM,12,4,mp-1225747,,CuSeS,"{'functional': 'PBE', 'labels': ['Cu_pv', 'Se', 'S'], 'pot_type': 'paw'}","{'Cu': 1.0, 'Se': 1.0, 'S': 1.0}",GGA,mp-1225747,"['mp-1225747', 'mp-1393696', 'mp-1732458', 'mp-1785221']",0.002198725,"{'Cu': 4.0, 'Se': 4.0, 'S': 4.0}",214.42370205889603,[],NM,False,198,0,"[-0.0, -0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",4.1016454410363147e-05,0.002198725,0,0.0087949,MP,data/source/MP/cleaned/cifs/MP-mp-1225747.cif,False,,data/final/MP/graphs/Cu1S1Se1-MP-mp-1225747.json,0,True,23,1,0,0,0,0,0,0,1,0,0,0,1.0,False
B2Ir3Tb1,1,0.0,1.0,True,B2Ir3Tb1,B2Ir3Tb1,0.0,Other,True,B33.333Ir50Tb16.667,B-Ir-Tb,3,Supercon,Tb1Ir3B2,MP-mp-1025075,Tb1B2Ir3,B-Ir-Tb,B33.333Ir50Tb16.667,P 6/m m m,hexagonal,3.159543,5.474887998615254,5.47488792,data/final/MP/cifs/B2Ir3Tb1-MP-mp-1025075.cif,data/source/MP/raw/cifs/mp-1025075.cif,mp-1025075,0.0,,2016-10-01 03:08:59,15.33039638828083,10.17188/1355206,"@article{osti_1355206,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TbB2Ir3 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1355206"",
    place = ""United States"",
    year = ""2017"",
    month = ""5""
}
",{'GGA': {'task_id': 'mp-1704772'}},0.0,7.83289059,520.0,-48.65837393,-8.109728988333334,"{'tags': ['Terbium iridium boride (1/3/2)', 'ErIr3B2', 'TbIr3B2']}",-48.65837393,-8.109728988333334,-0.6916555047222227,"['bandstructure', 'elasticity']",True,[614566],True,2021-05-12 10:56:10.715000,NM,6,5,mp-1025075,,TbB2Ir3,"{'functional': 'PBE', 'labels': ['Tb_3', 'B', 'Ir'], 'pot_type': 'paw'}","{'Tb': 1.0, 'B': 2.0, 'Ir': 3.0}",GGA,mp-1025075,"['mp-1025075', 'mp-1504184', 'mp-1704772', 'mp-1801170', 'mp-1593142']",0.0001839,"{'Tb': 1.0, 'B': 2.0, 'Ir': 3.0}",82.01728184283837,[],NM,False,191,0,"[0, 0, 0, 0, 0, 0]",2.242210371618867e-06,0.0001839,0,0.0001839,MP,data/source/MP/cleaned/cifs/MP-mp-1025075.cif,False,,data/final/MP/graphs/B2Ir3Tb1-MP-mp-1025075.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ge0.3Sb0.7,3,0.1,8.0,False,Ge2.4Sb5.6,Ge2Sb6,3.3,Other,True,Ge30Sb70,Ge-Sb,2,Supercon,Ge0.3Sb0.7,MP-mp-1184683,Ge2Sb6,Ge-Sb,Ge25Sb75,P 63/m m c,hexagonal,5.287048,6.699929995334291,6.69992949,data/final/MP/cifs/Ge0.3Sb0.7-MP-mp-1184683-synth_doped.cif,data/source/MP/raw/cifs/mp-1184683.cif,mp-1184683,0.0,,2019-01-11 12:58:50.361000,7.07602732528748,,,{'GGA': {'task_id': 'mp-1730915'}},0.15228952,7.86993288,520.0,-31.64974699,-3.95621837375,{'tags': []},-31.64974699,-3.95621837375,0.15228952,['bandstructure'],True,[],True,2021-05-12 10:58:27.755000,NM,8,5,mp-1184683,,GeSb3,"{'functional': 'PBE', 'labels': ['Ge_d', 'Sb'], 'pot_type': 'paw'}","{'Ge': 1.0, 'Sb': 3.0}",GGA,mp-1184683,"['mp-1184683', 'mp-1403093', 'mp-1730915', 'mp-1829210', 'mp-1622770']",0.0001257,"{'Ge': 2.0, 'Sb': 6.0}",205.53433010264084,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.223153328567809e-06,0.0001257,0,0.0002514,MP,data/source/MP/cleaned/cifs/MP-mp-1184683.cif,True,,data/final/MP/graphs/Ge0.3Sb0.7-MP-mp-1184683-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
As2Fe2K0.9Na0.1,2,0.0399999999999999,1.0,True,As2Fe2K0.9Na0.1,As2Fe2K1,2.9,Ferrite,True,As40Fe40K18Na2,As-Fe-K-Na,4,Supercon,K0.9Na0.1Fe2As2,MP-mp-35276,K1Fe2As2,As-Fe-K,As40Fe40K20,I 4/m m m,tetragonal,3.773663997645024,3.773663997645024,7.55368275,data/final/MP/cifs/As2Fe2K0.9Na0.1-MP-mp-35276-synth_doped.cif,data/source/MP/raw/cifs/mp-35276.cif,mp-35276,0.0,,2013-11-11 09:13:53,4.960691158678031,,,{'GGA': {'task_id': 'mp-1695961'}},0.0,3.49619278,520.0,-28.80228941,-5.760457882,"{'tags': ['Potassium iron arsenide (1/2/2)', 'Potassium iron iron(III) arsenide']}",-28.80228941,-5.760457882,-0.2867273506000004,"['xas', 'elasticity', 'bandstructure']",True,"[189036, 31473]",True,2021-05-12 10:56:27.046000,FM,5,13,mp-35276,,K(FeAs)2,"{'functional': 'PBE', 'labels': ['K_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'K': 1.0, 'Fe': 2.0, 'As': 2.0}",GGA,mp-35276,"['mp-675576', 'mp-936897', 'mp-947308', 'mp-947894', 'mp-1068571', 'mp-1068449', 'mp-1068488', 'mp-35276', 'mp-1441920', 'mp-1695961', 'mp-1796098', 'mp-1593314', 'mp-1068554']",1.3381583,"{'K': 1.0, 'Fe': 2.0, 'As': 2.0}",100.63322517614498,[],FM,True,139,1,"[0.0, 0.8, 0.8, 0.0, 0.0]",0.0132973806380321,1.3381583,2,1.3381583,MP,data/source/MP/cleaned/cifs/MP-mp-35276.cif,True,,data/final/MP/graphs/As2Fe2K0.9Na0.1-MP-mp-35276-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As2Cd1Sn1,1,0.0,2.0,False,As4Cd2Sn2,As4Cd2Sn2,2.29,Other,True,As50Cd25Sn25,As-Cd-Sn,3,Supercon,As2Cd1Sn1,MP-mp-3829,Cd2Sn2As4,As-Cd-Sn,As50Cd25Sn25,I -4 2 d,tetragonal,6.221410002621834,6.221410002621834,7.52243859,data/final/MP/cifs/As2Cd1Sn1-MP-mp-3829.cif,data/source/MP/raw/cifs/mp-3829.cif,mp-3829,0.3094000000000001,,2011-05-13 17:28:23,5.356919475295219,10.17188/1207500,"@misc{osti_1207500,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CdSnAs2 (SG:122) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207500"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699328'}},0.0,3.01968827,520.0,-29.55564796,-3.694455995,"{'tags': ['Cadmium tin arsenic (1/1/2)', 'Cadmium tin(IV) arsenide']}",-29.55564796,-3.694455995,-0.1317813887500003,"['xas', 'elasticity', 'bandstructure']",True,"[22182, 43358, 44258, 609982, 609985, 16737]",True,2021-05-12 10:56:20.740000,NM,8,8,mp-3829,,CdSnAs2,"{'functional': 'PBE', 'labels': ['Cd', 'Sn_d', 'As'], 'pot_type': 'paw'}","{'Cd': 1.0, 'Sn': 1.0, 'As': 2.0}",GGA,mp-3829,"['mp-925372', 'mp-3829', 'mp-909734', 'mp-924791', 'mp-1427674', 'mp-1699328', 'mp-1931754', 'mp-1594164']",8.575e-05,"{'Cd': 2.0, 'Sn': 2.0, 'As': 4.0}",236.18273150956887,[],NM,False,122,0,"[0, 0, 0, 0, 0, 0, 0, 0]",7.261326808435685e-07,8.575e-05,0,0.0001715,MP,data/source/MP/cleaned/cifs/MP-mp-3829.cif,False,,data/final/MP/graphs/As2Cd1Sn1-MP-mp-3829.json,0,True,-42m,0,0,0,0,6,0,0,0,0,1,0,1.0,False
Cu1La1.889Sr0.111O4,2,0.0317142857142857,1.0,True,Cu1La1.889Sr0.111O4,Cu1La2O4,29.2,Cuprate,True,Cu14.286La26.986Sr1.586O57.142857142857146,Cu-La-Sr-O,4,Supercon,La1.889Sr0.111Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La1.889Sr0.111O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La1.889Sr0.111O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B1Hf1,1,0.0,1.0,True,B1Hf1,B1Hf1,3.1,Other,True,B50Hf50,B-Hf,2,Supercon,B1Hf1,MP-mp-345,Hf1B1,B-Hf,B50Hf50,F m -3 m,cubic,3.4208426,3.4208425999999994,3.4208425999999994,data/final/MP/cifs/B1Hf1-MP-mp-345.cif,data/source/MP/raw/cifs/mp-345.cif,mp-345,0.0,,2011-05-12 17:25:20,11.104978646429895,10.17188/1206843,"@misc{osti_1206843,
    author = ""Persson, Kristin"",
    title = ""Materials Data on HfB (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1206843"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688479'}},0.3499148725000012,4.32131828,520.0,-17.46357609,-8.731788045,{'tags': ['Hafnium boride (1/1)']},-17.46357609,-8.731788045,-0.4134977345833324,"['xas', 'elasticity', 'bandstructure']",True,"[614418, 76128]",True,2021-05-12 10:56:20.740000,NM,2,7,mp-345,,HfB,"{'functional': 'PBE', 'labels': ['Hf_pv', 'B'], 'pot_type': 'paw'}","{'Hf': 1.0, 'B': 1.0}",GGA,mp-345,"['mp-1008011', 'mp-1001504', 'mp-345', 'mp-1440261', 'mp-1688479', 'mp-1791103', 'mp-1592194']",0.0009076,"{'Hf': 1.0, 'B': 1.0}",28.30637643301577,[],NM,False,225,0,"[0, 0]",3.206344698155716e-05,0.0009076,0,0.0009076,MP,data/source/MP/cleaned/cifs/MP-mp-345.cif,False,,data/final/MP/graphs/B1Hf1-MP-mp-345.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Be22Re0.99Ru0.01,2,0.0008695652173913,2.0,False,Be44Re1.98Ru0.02,Be44Re2,9.2,Other,True,Be95.652Re4.304Ru0.043,Be-Re-Ru,3,Supercon,Be22Re0.99Ru0.01,MP-mp-569364,Be44Re2,Be-Re,Be95.652Re4.348,F d -3 m,cubic,8.13033498,8.13033498,8.13033498,data/final/MP/cifs/Be22Re0.99Ru0.01-MP-mp-569364-synth_doped.cif,data/source/MP/raw/cifs/mp-569364.cif,mp-569364,0.0,,2014-02-18 16:00:38,3.359981469520108,10.17188/1275060,"@misc{osti_1275060,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Be22Re (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1275060"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1729467'}},0.0,5.02493221,520.0,-192.40958206,-4.182817001304348,"{'tags': ['Rhenium beryllium (1/22)', 'Beryllium rhenium (22/1)']}",-192.40958206,-4.182817001304348,-0.0649209050000001,"['xas', 'elasticity', 'bandstructure']",True,"[150540, 616399]",True,2021-05-12 10:56:22.739000,NM,46,7,mp-569364,,Be22Re,"{'functional': 'PBE', 'labels': ['Be_sv', 'Re_pv'], 'pot_type': 'paw'}","{'Be': 22.0, 'Re': 1.0}",GGA,mp-569364,"['mp-914535', 'mp-1001401', 'mp-569364', 'mp-1384180', 'mp-1729467', 'mp-1836331', 'mp-1007840']",9.15e-05,"{'Be': 44.0, 'Re': 2.0}",380.0233840958512,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.815493142228399e-07,9.15e-05,0,0.000183,MP,data/source/MP/cleaned/cifs/MP-mp-569364.cif,True,,data/final/MP/graphs/Be22Re0.99Ru0.01-MP-mp-569364-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ba2Cu3Pr0.6Y0.4O7,2,0.0153846153846153,2.0,False,Ba4Cu6Pr1.2Y0.8O14,Ba4Cu6Pr1Y1O14,0.0,Cuprate,True,Ba15.385Cu23.077Pr4.615Y3.077O53.84615384615385,Ba-Cu-Pr-Y-O,5,Supercon,Y0.4Pr0.6Ba2Cu3O7,MP-mp-1228182,Ba4Pr1Y1Cu6O14,Ba-Cu-Pr-Y-O,Ba15.385Cu23.077Pr3.846Y3.846O53.84615384615385,C m m m,orthorhombic,3.949929,7.74232199751255,12.49432076,data/final/MP/cifs/Ba2Cu3Pr0.6Y0.4O7-MP-mp-1228182-synth_doped.cif,data/source/MP/raw/cifs/mp-1228182.cif,mp-1228182,0.0,,2019-01-13 03:55:31.194000,6.327747434820984,,,,0.0237480683814448,3.26863064,520.0,-159.60355051,-6.138598096538461,{'tags': []},-159.60355051,-6.138598096538461,-2.1704462631410246,[],False,[],True,2021-05-12 11:00:59.151000,NM,26,3,mp-1228182,oxide,Ba4PrY(Cu3O7)2,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Pr_3', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 4.0, 'Pr': 1.0, 'Y': 1.0, 'Cu': 6.0, 'O': 14.0}",GGA,mp-1228182,"['mp-1228182', 'mp-1368338', 'mp-1838576']",0.0118757,"{'Ba': 4.0, 'Pr': 1.0, 'Y': 1.0, 'Cu': 6.0, 'O': 14.0}",363.293922142809,[],NM,False,65,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",3.268895865351615e-05,0.0118757,0,0.0118757,MP,data/source/MP/cleaned/cifs/MP-mp-1228182.cif,True,,data/final/MP/graphs/Ba2Cu3Pr0.6Y0.4O7-MP-mp-1228182-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ir2Si2U1,1,0.0,2.0,False,Ir4Si4U2,Ir4Si4U2,1.1,Heavy_fermion,True,Ir40Si40U20,Ir-Si-U,3,Supercon,U1Ir2Si2,MP-mp-22758,U2Si4Ir4,Ir-Si-U,Ir40Si40U20,P 4/n m m,tetragonal,4.104907,4.104907,9.900753,data/final/MP/cifs/Ir2Si2U1-MP-mp-22758.cif,data/source/MP/raw/cifs/mp-22758.cif,mp-22758,0.0,,2014-02-21 13:46:32,13.50951566480709,10.17188/1198952,"@misc{osti_1198952,
    author = ""Persson, Kristin"",
    title = ""Materials Data on U(SiIr)2 (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198952"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-922370'}},0.0,10.41383567,520.0,-87.64592496,-8.764592496,"{'tags': ['Uranium iridium silicide (1/2/2)', 'Iridium uranium silicide (2/1/2)']}",-87.64592496,-8.764592496,-0.8008127180000002,"['xas', 'bandstructure']",True,"[89097, 641026, 641021, 604000, 62716]",True,2021-05-12 10:56:59.077000,FM,10,9,mp-22758,,U(SiIr)2,"{'functional': 'PBE', 'labels': ['U', 'Si', 'Ir'], 'pot_type': 'paw'}","{'U': 1.0, 'Si': 2.0, 'Ir': 2.0}",GGA,mp-22758,"['mp-907800', 'mp-922370', 'mp-923144', 'mp-22758', 'mp-1125130', 'mp-1427417', 'mp-1699678', 'mp-1827304', 'mp-1594649']",1.33389275,"{'U': 2.0, 'Si': 4.0, 'Ir': 4.0}",166.83027688551851,[],FM,True,129,1,"[1.4, 1.4, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0159910152389825,1.33389275,2,2.6677855,MP,data/source/MP/cleaned/cifs/MP-mp-22758.cif,False,,data/final/MP/graphs/Ir2Si2U1-MP-mp-22758.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Cu1La1.883Sr0.117O4,2,0.0334285714285714,1.0,True,Cu1La1.883Sr0.117O4,Cu1La2O4,33.0,Cuprate,True,Cu14.286La26.9Sr1.671O57.142857142857146,Cu-La-Sr-O,4,Supercon,La1.883Sr0.117Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La1.883Sr0.117O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La1.883Sr0.117O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Rb0.23W1O3.05,2,0.0463695183321353,2.951331195058209,False,Rb0.679W2.951O9,Rb1W3O9,5.01,Oxide,True,Rb5.374W23.364O71.26168224299066,Rb-W-O,3,Supercon,Rb0.23W1O3.05,MP-mp-565431,Rb1W3O9,Rb-W-O,Rb7.692W23.077O69.23076923076923,P 6/m m m,hexagonal,3.882989,7.530094003231798,7.530093400000001,data/final/MP/cifs/Rb0.23W1O3.05-MP-mp-565431-synth_doped.cif,data/source/MP/raw/cifs/mp-565431.cif,mp-565431,0.0,,2014-02-23 19:51:49,6.801313653620402,10.17188/1272509,"@misc{osti_1272509,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Rb(WO3)3 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1272509"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-1672885'}},0.0038003846153671,3.17423124,520.0,-93.98226341,-7.229404877692308,{'tags': ['Rubidium tungsten oxide (0.33/1/3)']},-93.98226341,-7.229404877692308,-2.2379000678846164,"['xas', 'bandstructure']",True,[96419],True,2021-05-12 10:57:23.123000,FM,13,15,mp-565431,oxide,Rb(WO3)3,"{'functional': 'PBE', 'labels': ['Rb_sv', 'W_pv', 'O'], 'pot_type': 'paw'}","{'Rb': 1.0, 'W': 3.0, 'O': 9.0}",GGA+U,mp-565431,"['mp-704837', 'mp-932684', 'mp-940813', 'mp-940952', 'mp-565431', 'mp-1179797', 'mp-1192870', 'mp-1414087', 'mp-1427299', 'mp-1672885', 'mp-1670084', 'mp-1833003', 'mp-1609186', 'mp-1605159', 'mp-1984777']",0.8587592,"{'Rb': 1.0, 'W': 3.0, 'O': 9.0}",190.6766621234564,[],FM,True,65,1,"[0.0, 0.4, 0.4, 0.3, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0045037457150575,0.8587592,3,0.8587592,MP,data/source/MP/cleaned/cifs/MP-mp-565431.cif,True,,data/final/MP/graphs/Rb0.23W1O3.05-MP-mp-565431-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
B2Ir3Sc1,1,0.0,1.0,True,B2Ir3Sc1,B2Ir3Sc1,0.0,Other,True,B33.333Ir50Sc16.667,B-Ir-Sc,3,Supercon,Sc1Ir3B2,MP-mp-1077776,Sc1B2Ir3,B-Ir-Sc,B33.333Ir50Sc16.667,P 6/m m m,hexagonal,3.062962,5.467390001837631,5.46739032,data/final/MP/cifs/B2Ir3Sc1-MP-mp-1077776.cif,data/source/MP/raw/cifs/mp-1077776.cif,mp-1077776,0.0,,2018-04-09 16:25:48,13.47045520260375,,,{'GGA': {'task_id': 'mp-1698092'}},0.0063373897222245,8.04889962,520.0,-49.92796759,-8.321327931666668,"{'tags': ['ScIr3B2', 'Scandium iridium boride (1/3/2)', 'ErIr3B2']}",-49.92796759,-8.321327931666668,-0.6202372805555557,['bandstructure'],True,[614561],True,2021-05-12 10:58:14.654000,NM,6,5,mp-1077776,,ScB2Ir3,"{'functional': 'PBE', 'labels': ['Sc_sv', 'B', 'Ir'], 'pot_type': 'paw'}","{'Sc': 1.0, 'B': 2.0, 'Ir': 3.0}",GGA,mp-1077776,"['mp-1077776', 'mp-1431678', 'mp-1698092', 'mp-1799671', 'mp-1588754']",0.0028662,"{'Sc': 1.0, 'B': 2.0, 'Ir': 3.0}",79.29254958927858,[],NM,False,191,0,"[0, 0, 0, 0, 0, 0]",3.6147153986678577e-05,0.0028662,0,0.0028662,MP,data/source/MP/cleaned/cifs/MP-mp-1077776.cif,False,,data/final/MP/graphs/B2Ir3Sc1-MP-mp-1077776.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Eu1Ga1Sn1,1,0.0,4.0,False,Eu4Ga4Sn4,Eu4Ga4Sn4,0.0,Other,True,Eu33.333Ga33.333Sn33.333,Eu-Ga-Sn,3,Supercon,Eu1Ga1Sn1,MP-mp-1102160,Eu4Ga4Sn4,Eu-Ga-Sn,Eu33.333Ga33.333Sn33.333,P 63/m m c,hexagonal,4.580303997926897,4.58030346,17.929564,data/final/MP/cifs/Eu1Ga1Sn1-MP-mp-1102160.cif,data/source/MP/raw/cifs/mp-1102160.cif,mp-1102160,0.0,,2018-07-18 13:41:11,6.940742189340666,,,{'GGA': {'task_id': 'mp-1670801'}},0.0,4.72585993,520.0,-76.20189743,-6.350158119166667,{'tags': ['Europium gallium stannide (1/1/1)']},-76.20189743,-6.350158119166667,-0.573587668333334,['bandstructure'],True,[249600],True,2021-05-12 10:58:18.470000,FM,12,5,mp-1102160,,EuGaSn,"{'functional': 'PBE', 'labels': ['Eu', 'Ga_d', 'Sn_d'], 'pot_type': 'paw'}","{'Eu': 1.0, 'Ga': 1.0, 'Sn': 1.0}",GGA,mp-1102160,"['mp-1102160', 'mp-1422203', 'mp-1670801', 'mp-1812530', 'mp-1603105']",6.99036145,"{'Eu': 4.0, 'Ga': 4.0, 'Sn': 4.0}",325.7533567643637,[],FM,True,194,2,"[6.9, 6.9, 6.8, 6.8, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0858362476375834,6.99036145,4,27.9614458,MP,data/source/MP/cleaned/cifs/MP-mp-1102160.cif,False,,data/final/MP/graphs/Eu1Ga1Sn1-MP-mp-1102160.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
B0.69Mg0.31,2,0.0466666666666666,3.0,False,B2.07Mg0.93,B2Mg1,5.7,Other,True,B69Mg31,B-Mg,2,Supercon,B0.69Mg0.31,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B0.69Mg0.31-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B0.69Mg0.31-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Pt3Th1,1,0.0,2.0,False,Pt6Th2,Pt6Th2,0.0,Other,True,Pt75Th25,Pt-Th,2,Supercon,Pt3Th1,MP-mp-865400,Th2Pt6,Pt-Th,Pt75Th25,P 63/m m c,hexagonal,5.019243,5.933378001821378,5.9333788,data/final/MP/cifs/Pt3Th1-MP-mp-865400.cif,data/source/MP/raw/cifs/mp-865400.cif,mp-865400,0.0,,2014-08-31 02:17:00,17.737088974285186,10.17188/1310691,"@misc{osti_1310691,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ThPt3 (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1310691"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1755379'}},0.0,7.6664673,520.0,-59.91290764,-7.489113455,{'tags': []},-59.91290764,-7.489113455,-1.0824681099999998,"['xas', 'elasticity', 'bandstructure']",True,[],True,2021-05-12 10:56:33.121000,NM,8,8,mp-865400,,ThPt3,"{'functional': 'PBE', 'labels': ['Th', 'Pt'], 'pot_type': 'paw'}","{'Th': 1.0, 'Pt': 3.0}",GGA,mp-865400,"['mp-865400', 'mp-1052694', 'mp-1052713', 'mp-1390782', 'mp-1755379', 'mp-1938908', 'mp-1618848', 'mp-1052714']",1.22e-05,"{'Th': 2.0, 'Pt': 6.0}",153.0287270184426,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.5944718665181988e-07,1.22e-05,0,2.44e-05,MP,data/source/MP/cleaned/cifs/MP-mp-865400.cif,False,,data/final/MP/graphs/Pt3Th1-MP-mp-865400.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Al0.06B2Mg0.94,2,0.04,1.0,True,Al0.06B2Mg0.94,B2Mg1,37.0,Other,True,Al2B66.667Mg31.333,Al-B-Mg,3,Supercon,Mg0.94Al0.06B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/Al0.06B2Mg0.94-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/Al0.06B2Mg0.94-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Hf25Nb50Zr25,1,0.0,0.04,False,Hf1Nb2Zr1,Hf1Nb2Zr1,10.1,Other,True,Hf25Nb50Zr25,Hf-Nb-Zr,3,Supercon,Nb50Zr25Hf25,MP-mp-1224216,Hf1Zr1Nb2,Hf-Nb-Zr,Hf25Nb50Zr25,C m m 2,orthorhombic,3.01730681,3.01730681,9.746123,data/final/MP/cifs/Hf25Nb50Zr25-MP-mp-1224216.cif,data/source/MP/raw/cifs/mp-1224216.cif,mp-1224216,0.0,,2019-01-13 00:29:50.500000,9.211271820085342,,,{'GGA': {'task_id': 'mp-1735655'}},0.085118285,4.57260015,520.0,-38.36702642,-9.591756605,{'tags': []},-38.36702642,-9.591756605,0.085118285,['bandstructure'],True,[],True,2021-05-12 10:58:45.495000,NM,4,5,mp-1224216,,HfZrNb2,"{'functional': 'PBE', 'labels': ['Hf_pv', 'Zr_sv', 'Nb_pv'], 'pot_type': 'paw'}","{'Hf': 1.0, 'Zr': 1.0, 'Nb': 2.0}",GGA,mp-1224216,"['mp-1224216', 'mp-1419164', 'mp-1735655', 'mp-1799501', 'mp-1614367']",0.0058081,"{'Hf': 1.0, 'Zr': 1.0, 'Nb': 2.0}",82.11895117592066,[],NM,False,35,0,"[0, 0, 0, 0]",7.072788822591638e-05,0.0058081,0,0.0058081,MP,data/source/MP/cleaned/cifs/MP-mp-1224216.cif,False,,data/final/MP/graphs/Hf25Nb50Zr25-MP-mp-1224216.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Sn0.97Te1,2,0.0152284263959391,1.0,True,Sn0.97Te1,Sn1Te1,0.143666667,Other,True,Sn49.239Te50.761,Sn-Te,2,Supercon,Sn0.97Te1,MP-mp-1883,Sn1Te1,Sn-Te,Sn50Te50,F m -3 m,cubic,4.53766968,4.53766968,4.53766968,data/final/MP/cifs/Sn0.97Te1-MP-mp-1883-synth_doped.cif,data/source/MP/raw/cifs/mp-1883.cif,mp-1883,0.6623999999999999,,2011-05-12 18:43:07,6.19081042904143,10.17188/1193534,"@misc{osti_1193534,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SnTe (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1193534"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686906'}},0.0,6.06645058,520.0,-7.72519638,-3.86259819,"{'tags': ['Tin telluride (1/1)', 'Tin telluride']}",-7.72519638,-3.86259819,-0.4971617975000004,"['eos', 'elasticity', 'bandstructure', 'xas']",True,"[52489, 652760, 652744, 652756, 652761, 600865, 652763, 652745, 652742, 604177, 600813, 652741, 601065, 652750, 652755, 652753, 652751, 652749, 652752, 600136, 652754, 652746, 652759]",True,2021-05-12 10:56:14.760000,NM,2,9,mp-1883,,SnTe,"{'functional': 'PBE', 'labels': ['Sn_d', 'Te'], 'pot_type': 'paw'}","{'Sn': 1.0, 'Te': 1.0}",GGA,mp-1883,"['mp-663289', 'mp-655511', 'mp-657302', 'mp-1883', 'mp-1440781', 'mp-1686906', 'mp-1784332', 'mp-1596407', 'mp-1596974']",0.0,"{'Sn': 1.0, 'Te': 1.0}",66.06685541129963,[],NM,False,225,0,"[0, 0]",0.0,0.0,0,0.0,MP,data/source/MP/cleaned/cifs/MP-mp-1883.cif,True,,data/final/MP/graphs/Sn0.97Te1-MP-mp-1883-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
C1Cu0.09Mg1Ni2.91,2,0.0359999999999999,1.0,True,C1Cu0.09Mg1Ni2.91,C1Mg1Ni3,6.0,Other,True,C20Cu1.8Mg20Ni58.2,C-Cu-Mg-Ni,4,Supercon,Mg1C1Ni2.91Cu0.09,MP-mp-10700,Mg1Ni3C1,C-Mg-Ni,C20Mg20Ni60,P m -3 m,cubic,3.810209,3.810209,3.810209,data/final/MP/cifs/C1Cu0.09Mg1Ni2.91-MP-mp-10700-synth_doped.cif,data/source/MP/raw/cifs/mp-10700.cif,mp-10700,0.0,,2011-05-28 10:04:44,6.376007671789427,10.17188/1187303,"@misc{osti_1187303,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MgNi3C (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187303"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678621'}},0.0,6.64260176,520.0,-28.85099542,-5.770199084,{'tags': ['Magnesium nickel carbide (1/3/1)']},-28.85099542,-5.770199084,-0.1367049259999994,"['xas', 'elasticity', 'bandstructure']",True,[77152],True,2021-05-12 10:56:10.715000,NM,5,8,mp-10700,,MgNi3C,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Ni_pv', 'C'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",GGA,mp-10700,"['mp-927245', 'mp-927653', 'mp-911184', 'mp-10700', 'mp-1438083', 'mp-1678621', 'mp-1791467', 'mp-1591421']",0.0387875,"{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",55.31544309398296,[],NM,False,221,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",0.0007012056277683,0.0387875,0,0.0387875,MP,data/source/MP/cleaned/cifs/MP-mp-10700.cif,True,,data/final/MP/graphs/C1Cu0.09Mg1Ni2.91-MP-mp-10700-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ca0.2Cu1La1.8O4,3,0.0571428571428571,1.0,True,Ca0.2Cu1La1.8O4,Cu1La2O4,30.0,Cuprate,True,Ca2.857Cu14.286La25.714O57.142857142857146,Ca-Cu-La-O,4,Supercon,La1.8Ca0.2Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ca0.2Cu1La1.8O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ca0.2Cu1La1.8O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Cu5U1,1,0.0,1.0,True,Cu5U1,Cu5U1,0.0,Heavy_fermion,True,Cu83.333U16.667,Cu-U,2,Supercon,Cu5U1,MP-mp-510148,U1Cu5,Cu-U,Cu83.333U16.667,F -4 3 m,cubic,4.97811094,4.97811094,4.97811094,data/final/MP/cifs/Cu5U1-MP-mp-510148.cif,data/source/MP/raw/cifs/mp-510148.cif,mp-510148,0.0,,2014-02-27 22:39:40,10.57929720409056,10.17188/1262845,"@misc{osti_1262845,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UCu5 (SG:216) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1262845"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678282'}},0.1022760449999991,8.31379177,520.0,-31.17378709,-5.195631181666667,"{'tags': ['Uranium copper (1/5)', 'Copper uranium (5/1)']}",-31.17378709,-5.195631181666667,0.1022760449999999,"['xas', 'bandstructure']",True,"[629425, 629423, 629421, 103141, 167379]",True,2021-05-12 10:57:08.928000,FM,6,8,mp-510148,,UCu5,"{'functional': 'PBE', 'labels': ['U', 'Cu_pv'], 'pot_type': 'paw'}","{'U': 1.0, 'Cu': 5.0}",GGA,mp-510148,"['mp-993754', 'mp-992054', 'mp-510148', 'mp-1437557', 'mp-1678282', 'mp-1866232', 'mp-995059', 'mp-1591444']",1.4492061,"{'U': 1.0, 'Cu': 5.0}",87.23257924063266,[],FM,True,216,1,"[1.7, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0166131290925416,1.4492061,1,1.4492061,MP,data/source/MP/cleaned/cifs/MP-mp-510148.cif,False,,data/final/MP/graphs/Cu5U1-MP-mp-510148.json,0,True,-43m,5,0,0,0,0,0,0,0,0,0,1,1.0,False
Au0.374Te0.626,3,0.0813333333333333,3.0,False,Au1.122Te1.878,Au1Te2,1.3,Other,True,Au37.4Te62.6,Au-Te,2,Supercon,Au0.374Te0.626,MP-mp-567525,Te2Au1,Au-Te,Au33.333Te66.667,C 1 2/m 1,monoclinic,4.228509889999999,4.228509889999999,5.15701111,data/final/MP/cifs/Au0.374Te0.626-MP-mp-567525-synth_doped.cif,data/source/MP/raw/cifs/mp-567525.cif,mp-567525,0.0,,2014-02-16 11:21:24,9.349466095623004,10.17188/1272560,"@misc{osti_1272560,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Te2Au (SG:12) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1272560"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668681'}},0.0177770462499995,6.52239204,520.0,-9.77688527,-3.2589617566666664,"{'tags': ['Gold telluride (1/2)', 'Gold ditelluride', 'Calaverite, average structure', 'High pressure experimental phase', 'Calaverite']}",-9.77688527,-3.2589617566666664,-0.3534672899999993,"['xas', 'bandstructure']",True,"[64681, 64682, 72435, 659325, 151373, 72434, 72437, 66625, 66626, 612390, 65105, 659328, 65104, 659326, 72438, 72436, 659327, 72439]",True,2021-05-12 10:57:23.123000,NM,3,7,mp-567525,,Te2Au,"{'functional': 'PBE', 'labels': ['Te', 'Au'], 'pot_type': 'paw'}","{'Te': 2.0, 'Au': 1.0}",GGA,mp-567525,"['mp-567525', 'mp-1441005', 'mp-1668681', 'mp-1799624', 'mp-1934226', 'mp-1595493', 'mp-1592789']",0.0002727,"{'Te': 2.0, 'Au': 1.0}",80.30835608746618,[],NM,False,12,0,"[0, 0, 0]",3.3956615884777227e-06,0.0002727,0,0.0002727,MP,data/source/MP/cleaned/cifs/MP-mp-567525.cif,True,,data/final/MP/graphs/Au0.374Te0.626-MP-mp-567525-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
Nb2.85Sn1Zr0.15,3,0.0749999999999999,2.0,False,Nb5.7Sn2Zr0.3,Nb6Sn2,18.1,Other,True,Nb71.25Sn25Zr3.75,Nb-Sn-Zr,3,Supercon,Nb2.85Zr0.15Sn1,MP-mp-1326,Nb6Sn2,Nb-Sn,Nb75Sn25,P m -3 n,cubic,5.334611,5.334611,5.334611,data/final/MP/cifs/Nb2.85Sn1Zr0.15-MP-mp-1326-synth_doped.cif,data/source/MP/raw/cifs/mp-1326.cif,mp-1326,0.0,,2011-05-14 09:51:48,8.694218121896231,10.17188/1189484,"@misc{osti_1189484,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Sn (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189484"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668415'}},0.0,6.59372491,520.0,-69.93787048,-8.74223381,{'tags': ['Niobium tin (3/1)']},-69.93787048,-8.74223381,-0.163862066250001,"['xas', 'elasticity', 'bandstructure']",True,"[105230, 645503, 645489, 105231, 645498, 645485, 645474, 645496, 645480, 645488, 645482, 645487, 645500, 645493, 645477, 645484, 645502, 645483, 150878, 645479, 645481, 645486, 645473]",True,2021-05-12 10:56:12.755000,NM,8,9,mp-1326,,Nb3Sn,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Sn_d'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Sn': 1.0}",GGA,mp-1326,"['mp-930046', 'mp-913770', 'mp-930577', 'mp-1326', 'mp-1440651', 'mp-1668415', 'mp-1880085', 'mp-1594093', 'mp-1594507']",0.62023085,"{'Nb': 6.0, 'Sn': 2.0}",151.81275738025872,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0081709977567491,0.62023085,0,1.2404617,MP,data/source/MP/cleaned/cifs/MP-mp-1326.cif,True,,data/final/MP/graphs/Nb2.85Sn1Zr0.15-MP-mp-1326-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Cr1P1,1,0.0,4.0,False,Cr4P4,Cr4P4,0.0,Other,True,Cr50P50,Cr-P,2,Supercon,Cr1P1,MP-mp-21048,Cr4P4,Cr-P,Cr50P50,P n m a,orthorhombic,3.063179,5.334564,5.948189,data/final/MP/cifs/Cr1P1-MP-mp-21048.cif,data/source/MP/raw/cifs/mp-21048.cif,mp-21048,0.0,,2014-02-21 12:28:08,5.66987378355776,10.17188/1196308,"@misc{osti_1196308,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CrP (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196308"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687990'}},0.0,9.23887204,520.0,-64.57468695,-8.07183586875,{'tags': ['Chromium phosphide']},-64.57468695,-8.07183586875,-0.5386608804166659,"['xas', 'elasticity', 'bandstructure']",True,"[5418, 626498, 53201, 626502, 659681, 42080, 626514, 43247, 53200, 42081, 76028, 42079, 42082]",True,2021-05-12 10:56:16.728000,FM,8,8,mp-21048,,CrP,"{'functional': 'PBE', 'labels': ['Cr_pv', 'P'], 'pot_type': 'paw'}","{'Cr': 1.0, 'P': 1.0}",GGA,mp-21048,"['mp-924855', 'mp-909824', 'mp-925370', 'mp-21048', 'mp-1442019', 'mp-1687990', 'mp-1796396', 'mp-1591279']",0.077679475,"{'Cr': 4.0, 'P': 4.0}",97.19771724086549,[],FM,True,62,1,"[0.1, 0.1, 0.1, 0.1, -0.0, -0.0, -0.0, -0.0]",0.0031967612904942,0.077679475,4,0.3107179,MP,data/source/MP/cleaned/cifs/MP-mp-21048.cif,False,,data/final/MP/graphs/Cr1P1-MP-mp-21048.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
C1.58La1,3,0.1085271317829457,1.0,True,C1.58La1,C2La1,9.6,Other,True,C61.24La38.76,C-La,2,Supercon,C1.58La1,MP-mp-2367,La1C2,C-La,C66.667La33.333,I 4/m m m,tetragonal,3.93816799603586,4.31381491,3.93816799603586,data/final/MP/cifs/C1.58La1-MP-mp-2367-synth_doped.cif,data/source/MP/raw/cifs/mp-2367.cif,mp-2367,0.0,,2011-05-12 18:46:19,5.2948067338573725,10.17188/1199651,"@misc{osti_1199651,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaC2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199651"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686773'}},0.0,7.3435196,520.0,-23.87407566,-7.95802522,"{'tags': ['Lanthanum carbide (1/2)', 'Lanthanum dicarbide']}",-23.87407566,-7.95802522,-0.1615023849999997,"['xas', 'elasticity', 'bandstructure']",True,"[618153, 236844, 26587, 236840, 236842, 236841, 618162, 236851, 236846, 236849, 42897, 618167, 56161, 74667, 618168, 236847, 69887, 236848, 236839, 236843, 618147, 618170, 618156, 602553, 236852, 236850, 236845, 618158]",True,2021-05-12 10:56:16.728000,NM,3,65,mp-2367,,LaC2,"{'functional': 'PBE', 'labels': ['La', 'C'], 'pot_type': 'paw'}","{'La': 1.0, 'C': 2.0}",GGA,mp-2367,"['mp-1000639', 'mp-1007092', 'mp-2367', 'mp-1062039', 'mp-1062071', 'mp-1062110', 'mp-1062113', 'mp-1062140', 'mp-1062193', 'mp-1062381', 'mp-1062411', 'mp-1062413', 'mp-1062409', 'mp-1062446', 'mp-1062445', 'mp-1062470', 'mp-1062448', 'mp-1062475', 'mp-1062465', 'mp-1062501', 'mp-1062504', 'mp-1062498', 'mp-1062540', 'mp-1062384', 'mp-1063038', 'mp-1063086', 'mp-1063140', 'mp-1063238', 'mp-1063295', 'mp-1063337', 'mp-1063341', 'mp-1063387', 'mp-1063390', 'mp-1063272', 'mp-1063296', 'mp-1063313', 'mp-1063546', 'mp-1063558', 'mp-1063575', 'mp-1063584', 'mp-1063603', 'mp-1063635', 'mp-1063641', 'mp-1063650', 'mp-1063541', 'mp-1440714', 'mp-1686773', 'mp-1792065', 'mp-1011835', 'mp-1588055', 'mp-1594313', 'mp-1062479', 'mp-1063629', 'mp-1063290', 'mp-1063362', 'mp-1062436', 'mp-1062435', 'mp-1063360', 'mp-1062167', 'mp-1062485', 'mp-1062520', 'mp-1062093', 'mp-1063614', 'mp-1063113', 'mp-1063617']",0.0001596,"{'La': 1.0, 'C': 2.0}",51.09656428134838,[],NM,False,139,0,"[0, 0, 0]",3.1234976802199265e-06,0.0001596,0,0.0001596,MP,data/source/MP/cleaned/cifs/MP-mp-2367.cif,True,,data/final/MP/graphs/C1.58La1-MP-mp-2367-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As1Ce1Fe1O0.85,3,0.0584415584415584,2.0,False,As2Ce2Fe2O1.7,As2Ce2Fe2O2,42.6,Ferrite,True,As25.974Ce25.974Fe25.974O22.07792207792208,As-Ce-Fe-O,4,Supercon,Ce1Fe1As1O0.85,MP-mp-605060,Ce2Fe2As2O2,As-Ce-Fe-O,As25Ce25Fe25O25,P 4 m m,tetragonal,3.992256,3.992256,9.041971,data/final/MP/cifs/As1Ce1Fe1O0.85-MP-mp-605060-synth_doped.cif,data/source/MP/raw/cifs/mp-605060.cif,mp-605060,0.0,,2014-02-14 20:12:08,6.611233843492404,10.17188/1277425,"@misc{osti_1277425,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeFeAsO (SG:99) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277425"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-1751604'}},0.2072581873958352,6.30288445,520.0,-55.74271596,-6.967839495,{'tags': []},-55.74271596,-6.967839495,-1.7010452412499992,['bandstructure'],True,[],True,2021-05-12 10:58:51.532000,FiM,8,10,mp-605060,oxide,CeFeAsO,"{'functional': 'PBE', 'labels': ['Ce', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-605060,"['mp-605060', 'mp-917114', 'mp-918266', 'mp-919274', 'mp-1443189', 'mp-1751604', 'mp-1770633', 'mp-1779614', 'mp-1873964', 'mp-1622328']",2.99945325,"{'Ce': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",144.11191005541338,[],FiM,True,99,3,"[-0.5, -0.5, 3.5, 3.5, 0.0, 0.0, 0.0, 0.0]",0.0416267225775671,2.99945325,4,5.9989065,MP,data/source/MP/cleaned/cifs/MP-mp-605060.cif,True,,data/final/MP/graphs/As1Ce1Fe1O0.85-MP-mp-605060-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
Al0.8Ca1Si1.2,3,0.1333333333333333,1.0,True,Al0.8Ca1Si1.2,Al1Ca1Si1,4.05,Other,True,Al26.667Ca33.333Si40,Al-Ca-Si,3,Supercon,Ca1Al0.8Si1.2,MP-mp-3173,Ca1Al1Si1,Al-Ca-Si,Al33.333Ca33.333Si33.333,P -6 m 2,hexagonal,4.204102004380959,4.20410189,4.381114,data/final/MP/cifs/Al0.8Ca1Si1.2-MP-mp-3173-synth_doped.cif,data/source/MP/raw/cifs/mp-3173.cif,mp-3173,0.0,,2011-05-12 18:07:21,2.3559907742364445,10.17188/1205871,"@misc{osti_1205871,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CaAlSi (SG:187) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1205871"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688380'}},0.0042011372222221,5.20030027,520.0,-12.33105355,-4.110351183333333,"{'tags': ['Calcium aluminium silicide (1/1/1) - 1H', 'Calcium aluminium silicide (1/1/1) - (SrPtSb)-type']}",-12.33105355,-4.110351183333333,-0.36118794,"['xas', 'elasticity', 'bandstructure']",True,"[162864, 155853]",True,2021-05-12 10:56:20.740000,NM,3,12,mp-3173,,CaAlSi,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Al', 'Si'], 'pot_type': 'paw'}","{'Ca': 1.0, 'Al': 1.0, 'Si': 1.0}",GGA,mp-3173,"['mp-3173', 'mp-1000446', 'mp-1006914', 'mp-1170858', 'mp-1252945', 'mp-1258722', 'mp-1259938', 'mp-1439603', 'mp-1688380', 'mp-1781727', 'mp-1011629', 'mp-1597142']",0.0033294,"{'Ca': 1.0, 'Al': 1.0, 'Si': 1.0}",67.05970809230726,[],NM,False,187,0,"[0, 0, 0]",4.964829246523266e-05,0.0033294,0,0.0033294,MP,data/source/MP/cleaned/cifs/MP-mp-3173.cif,True,,data/final/MP/graphs/Al0.8Ca1Si1.2-MP-mp-3173-synth_doped.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Li1.07Ti1.93O4,2,0.02,2.0,False,Li2.14Ti3.86O8,Li2Ti4O8,11.05,Oxide,True,Li15.286Ti27.571O57.142857142857146,Li-Ti-O,3,Supercon,Li1.07Ti1.93O4,MP-mp-5670,Li2Ti4O8,Li-Ti-O,Li14.286Ti28.571O57.142857142857146,F d -3 m,cubic,5.986032260000001,5.98603226,5.98603226,data/final/MP/cifs/Li1.07Ti1.93O4-MP-mp-5670-synth_doped.cif,data/source/MP/raw/cifs/mp-5670.cif,mp-5670,0.0,,2011-05-14 11:10:22,3.649565337909552,10.17188/1273637,"@misc{osti_1273637,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LiTi2O4 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1273637"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699404'}},0.0,5.03116805,520.0,-114.93444733,-8.209603380714286,"{'tags': ['Lithium titanium oxide (1/2/4)', 'Lithium titanium(III) titanium(IV) oxide', 'Lithium titanium(III) titanium oxide', 'Lithium titanium titanium(III) oxide', 'Lithium titano(III)titanate', 'Spinel-(Li,Ti)']}",-114.93444733,-8.209603380714286,-3.2462103921428564,"['bandstructure', 'elasticity']",True,"[72859, 78482, 154982, 81329, 15789, 48127]",True,2021-05-12 10:56:22.739000,NM,14,7,mp-5670,oxide,LiTi2O4,"{'functional': 'PBE', 'labels': ['Li_sv', 'Ti_pv', 'O'], 'pot_type': 'paw'}","{'Li': 1.0, 'Ti': 2.0, 'O': 4.0}",GGA,mp-5670,"['mp-923613', 'mp-922835', 'mp-908534', 'mp-5670', 'mp-1418091', 'mp-1699404', 'mp-1787951']",0.0521081,"{'Li': 2.0, 'Ti': 4.0, 'O': 8.0}",151.67086379131675,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0006871207652868,0.0521081,0,0.1042162,MP,data/source/MP/cleaned/cifs/MP-mp-5670.cif,True,,data/final/MP/graphs/Li1.07Ti1.93O4-MP-mp-5670-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
B2C1Ni2Tb0.95Y0.05,2,0.0166666666666666,1.0,True,B2C1Ni2Tb0.95Y0.05,B2C1Ni2Tb1,0.0,Other,True,B33.333C16.667Ni33.333Tb15.833Y0.833,B-C-Ni-Tb-Y,5,Supercon,Y0.05Tb0.95Ni2B2C1,MP-mp-6092,Tb1Ni2B2C1,B-C-Ni-Tb,B33.333C16.667Ni33.333Tb16.667,I 4/m m m,tetragonal,3.5665140003823987,3.5665140003823987,5.7333997100000005,data/final/MP/cifs/B2C1Ni2Tb0.95Y0.05-MP-mp-6092-synth_doped.cif,data/source/MP/raw/cifs/mp-6092.cif,mp-6092,0.0,,2011-05-13 04:21:03,7.858244682564482,10.17188/1277657,"@misc{osti_1277657,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TbNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277657"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686417'}},0.0,6.76233636,520.0,-41.85355222,-6.975592036666666,{'tags': []},-41.85355222,-6.975592036666666,-0.5122247530555543,"['xas', 'elasticity', 'bandstructure']",True,"[89159, 89157, 79572, 56648, 89155, 89156, 89160, 89158]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-6092,,TbNi2B2C,"{'functional': 'PBE', 'labels': ['Tb_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Tb': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6092,"['mp-1007320', 'mp-1000865', 'mp-6092', 'mp-1440112', 'mp-1686417', 'mp-1793943', 'mp-1012059', 'mp-1590555']",0.0029604,"{'Tb': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.4949740949675,[],NM,False,139,0,"[-0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",4.520041485484718e-05,0.0029604,0,0.0029604,MP,data/source/MP/cleaned/cifs/MP-mp-6092.cif,True,,data/final/MP/graphs/B2C1Ni2Tb0.95Y0.05-MP-mp-6092-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Bi2Ca1Cu2Sr2O8.373,2,0.0226457642186517,1.9109808193001316,False,Bi3.822Ca1.911Cu3.822Sr3.822O16,Bi4Ca2Cu4Sr4O16,47.2,Cuprate,True,Bi13.01Ca6.505Cu13.01Sr13.01O54.46562154426592,Bi-Ca-Cu-Sr-O,5,Supercon,Bi2Sr2Ca1Cu2O8.373,MP-mp-1218930,Sr4Ca2Cu4Bi4O16,Bi-Ca-Cu-Sr-O,Bi13.333Ca6.667Cu13.333Sr13.333O53.333333333333336,C c c 2,orthorhombic,5.417115,5.472898000129128,16.11398919,data/final/MP/cifs/Bi2Ca1Cu2Sr2O8.373-MP-mp-1218930-synth_doped.cif,data/source/MP/raw/cifs/mp-1218930.cif,mp-1218930,0.0,,2019-01-12 20:01:06.544000,6.266668983881059,,,,0.039252223722225,4.51768334,520.0,-173.15021002,-5.771673667333333,{'tags': []},-173.15021002,-5.771673667333333,-2.074956548222222,[],False,[],True,2021-05-12 11:00:42.526000,NM,30,3,mp-1218930,oxide,Sr2CaCu2(BiO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",GGA,mp-1218930,"['mp-1218930', 'mp-1359698', 'mp-1817714']",0.00011165,"{'Sr': 4.0, 'Ca': 2.0, 'Cu': 4.0, 'Bi': 4.0, 'O': 16.0}",470.7976286073367,[],NM,False,37,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.743014544498498e-07,0.00011165,0,0.0002233,MP,data/source/MP/cleaned/cifs/MP-mp-1218930.cif,True,,data/final/MP/graphs/Bi2Ca1Cu2Sr2O8.373-MP-mp-1218930-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Bi2Ca1Cu2Sr2O8.291,2,0.0177620822706167,1.9299606802556988,False,Bi3.86Ca1.93Cu3.86Sr3.86O16,Bi4Ca2Cu4Sr4O16,89.1,Cuprate,True,Bi13.08Ca6.54Cu13.08Sr13.08O54.22143744686417,Bi-Ca-Cu-Sr-O,5,Supercon,Bi2Sr2Ca1Cu2O8.291,MP-mp-1218930,Sr4Ca2Cu4Bi4O16,Bi-Ca-Cu-Sr-O,Bi13.333Ca6.667Cu13.333Sr13.333O53.333333333333336,C c c 2,orthorhombic,5.417115,5.472898000129128,16.11398919,data/final/MP/cifs/Bi2Ca1Cu2Sr2O8.291-MP-mp-1218930-synth_doped.cif,data/source/MP/raw/cifs/mp-1218930.cif,mp-1218930,0.0,,2019-01-12 20:01:06.544000,6.266668983881059,,,,0.039252223722225,4.51768334,520.0,-173.15021002,-5.771673667333333,{'tags': []},-173.15021002,-5.771673667333333,-2.074956548222222,[],False,[],True,2021-05-12 11:00:42.526000,NM,30,3,mp-1218930,oxide,Sr2CaCu2(BiO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",GGA,mp-1218930,"['mp-1218930', 'mp-1359698', 'mp-1817714']",0.00011165,"{'Sr': 4.0, 'Ca': 2.0, 'Cu': 4.0, 'Bi': 4.0, 'O': 16.0}",470.7976286073367,[],NM,False,37,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.743014544498498e-07,0.00011165,0,0.0002233,MP,data/source/MP/cleaned/cifs/MP-mp-1218930.cif,True,,data/final/MP/graphs/Bi2Ca1Cu2Sr2O8.291-MP-mp-1218930-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Mo0.5V0.5,1,0.0,2.0,False,Mo1V1,Mo1V1,0.11,Other,True,Mo50V50,Mo-V,2,Supercon,Mo0.5V0.5,MP-mp-1216323,V1Mo1,Mo-V,Mo50V50,C m m m,orthorhombic,2.71695816,2.71695816,4.24640815,data/final/MP/cifs/Mo0.5V0.5-MP-mp-1216323.cif,data/source/MP/raw/cifs/mp-1216323.cif,mp-1216323,0.0,,2019-01-12 17:51:09.076000,8.301532504178253,,,,0.0,6.99897995,520.0,-20.13310171,-10.066550855,{'tags': []},-20.13310171,-10.066550855,-0.1017763049999995,[],False,[],True,2021-05-12 11:00:40.103000,NM,2,2,mp-1216323,,VMo,"{'functional': 'PBE', 'labels': ['V_pv', 'Mo_pv'], 'pot_type': 'paw'}","{'V': 1.0, 'Mo': 1.0}",GGA,mp-1216323,"['mp-1216323', 'mp-1881117']",1.73e-05,"{'V': 1.0, 'Mo': 1.0}",29.38041485569672,[],NM,False,65,0,"[0, 0]",5.888276283697749e-07,1.73e-05,0,1.73e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1216323.cif,False,,data/final/MP/graphs/Mo0.5V0.5-MP-mp-1216323.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Co0.8Cu0.2Zr2,3,0.1333333333333333,2.0,False,Co1.6Cu0.4Zr4,Co2Zr4,5.41,Other,True,Co26.667Cu6.667Zr66.667,Co-Cu-Zr,3,Supercon,Zr2Co0.8Cu0.2,MP-mp-628,Zr4Co2,Co-Zr,Co33.333Zr66.667,I 4/m c m,tetragonal,5.27792884001752,5.27792884,5.277928840000001,data/final/MP/cifs/Co0.8Cu0.2Zr2-MP-mp-628-synth_doped.cif,data/source/MP/raw/cifs/mp-628.cif,mp-628,0.0,,2011-05-13 12:16:44,7.17077101131263,10.17188/1278899,"@misc{osti_1278899,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Zr2Co (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278899"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677545'}},0.0,4.51380976,520.0,-49.95120762,-8.325201269999999,"{'tags': ['Cobalt zirconium (1/2)', 'Zirconium cobalt (2/1)']}",-49.95120762,-8.325201269999999,-0.2572949183333328,"['xas', 'elasticity', 'bandstructure']",True,"[625671, 191386, 625688, 102740, 625665]",True,2021-05-12 10:56:27.046000,NM,6,20,mp-628,,Zr2Co,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Co'], 'pot_type': 'paw'}","{'Zr': 2.0, 'Co': 1.0}",GGA,mp-628,"['mp-928347', 'mp-912327', 'mp-928866', 'mp-628', 'mp-1071352', 'mp-1071381', 'mp-1071431', 'mp-1071762', 'mp-1071803', 'mp-1071859', 'mp-1071883', 'mp-1071742', 'mp-1071925', 'mp-1441633', 'mp-1677545', 'mp-1802810', 'mp-1591799', 'mp-1071792', 'mp-1071416', 'mp-1071915']",0.0001226,"{'Zr': 4.0, 'Co': 2.0}",111.79353060019714,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0]",2.1933290654975308e-06,0.0001226,0,0.0002452,MP,data/source/MP/cleaned/cifs/MP-mp-628.cif,True,,data/final/MP/graphs/Co0.8Cu0.2Zr2-MP-mp-628-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Al1La1,1,0.0,4.0,False,Al4La4,Al4La4,0.0,Other,True,Al50La50,Al-La,2,Supercon,Al1La1,MP-mp-12684,La4Al4,Al-La,Al50La50,C m c m,orthorhombic,5.771267,6.12466442,6.12466442,data/final/MP/cifs/Al1La1-MP-mp-12684.cif,data/source/MP/raw/cifs/mp-12684.cif,mp-12684,0.0,,2011-05-28 08:47:57,5.190966771320567,10.17188/1189120,"@misc{osti_1189120,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaAl (SG:63) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189120"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699721'}},0.0,7.7870451,520.0,-38.01838727,-4.75229840875,{'tags': ['Lanthanum aluminide (1/1)']},-38.01838727,-4.75229840875,-0.4115069412499998,"['xas', 'elasticity', 'bandstructure']",True,[54470],True,2021-05-12 10:56:12.755000,NM,8,9,mp-12684,,LaAl,"{'functional': 'PBE', 'labels': ['La', 'Al'], 'pot_type': 'paw'}","{'La': 1.0, 'Al': 1.0}",GGA,mp-12684,"['mp-919405', 'mp-905121', 'mp-918427', 'mp-12684', 'mp-1251915', 'mp-1425607', 'mp-1699721', 'mp-1851655', 'mp-1600521']",0.000222275,"{'La': 4.0, 'Al': 4.0}",212.2624709860229,[],NM,False,63,0,"[0, 0, 0, 0, 0, 0, 0, 0]",4.188682040069842e-06,0.000222275,0,0.0008891,MP,data/source/MP/cleaned/cifs/MP-mp-12684.cif,False,,data/final/MP/graphs/Al1La1-MP-mp-12684.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Bi1S3,1,0.0,2.0,False,Bi2S6,Bi2S6,0.0,Other,True,Bi25S75,Bi-S,2,Supercon,Bi1S3,MP-mp-1183481,Bi2S6,Bi-S,Bi25S75,P 63/m m c,hexagonal,3.919284,7.079864002759698,7.079864800000001,data/final/MP/cifs/Bi1S3-MP-mp-1183481.cif,data/source/MP/raw/cifs/mp-1183481.cif,mp-1183481,0.0,,2019-01-11 12:03:09.901000,5.957188654074986,,,{'GGA': {'task_id': 'mp-1751628'}},0.4629354229687497,6.062653,520.0,-29.42803215,-3.67850401875,{'tags': []},-29.42803215,-3.67850401875,0.0190919589062499,['bandstructure'],True,[],True,2021-05-12 10:58:25.879000,NM,8,5,mp-1183481,,BiS3,"{'functional': 'PBE', 'labels': ['Bi', 'S'], 'pot_type': 'paw'}","{'Bi': 1.0, 'S': 3.0}",GGA,mp-1183481,"['mp-1183481', 'mp-1392171', 'mp-1751628', 'mp-1834864', 'mp-1621627']",0.00041435,"{'Bi': 2.0, 'S': 6.0}",170.13249144582247,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",4.8709096831388845e-06,0.00041435,0,0.0008287,MP,data/source/MP/cleaned/cifs/MP-mp-1183481.cif,False,,data/final/MP/graphs/Bi1S3-MP-mp-1183481.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ca0.19Cu1La1.81O4,3,0.0542857142857142,1.0,True,Ca0.19Cu1La1.81O4,Cu1La2O4,32.0,Cuprate,True,Ca2.714Cu14.286La25.857O57.142857142857146,Ca-Cu-La-O,4,Supercon,La1.81Ca0.19Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ca0.19Cu1La1.81O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ca0.19Cu1La1.81O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Cu2Gd1Nb0.1Ru0.9Sr2O8,2,0.0142857142857142,2.0,False,Cu4Gd2Nb0.2Ru1.8Sr4O16,Cu4Gd2Ru2Sr4O16,11.65,Cuprate,True,Cu14.286Gd7.143Nb0.714Ru6.429Sr14.286O57.142857142857146,Cu-Gd-Nb-Ru-Sr-O,6,Supercon,Ru0.9Nb0.1Sr2Gd1Cu2O8,MP-mp-1194240,Sr4Gd2Cu4Ru2O16,Cu-Gd-Ru-Sr-O,Cu14.286Gd7.143Ru7.143Sr14.286O57.142857142857146,P 4/m b m,tetragonal,5.472451,5.472451,11.740702,data/final/MP/cifs/Cu2Gd1Nb0.1Ru0.9Sr2O8-MP-mp-1194240-synth_doped.cif,data/source/MP/raw/cifs/mp-1194240.cif,mp-1194240,0.0,,2019-01-11 23:51:58.932000,6.504561898971391,,,{'GGA': {'task_id': 'mp-1765260'}},0.0213449239285443,3.93502801,520.0,-201.55352223,-7.198340079642857,"{'tags': ['Sr2Cu2GdRuO8 orth', 'Sr2Cu2GdRuO8', 'Ruthenium distrontium gadolinium dicopper octaoxide']}",-201.55352223,-7.198340079642857,-2.268654352380952,['bandstructure'],True,[245741],True,2021-05-12 10:58:35.561000,FiM,28,6,mp-1194240,oxide,Sr2GdCu2RuO8,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Gd', 'Cu_pv', 'Ru_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Gd': 1.0, 'Cu': 2.0, 'Ru': 1.0, 'O': 8.0}",GGA,mp-1194240,"['mp-1194240', 'mp-1396976', 'mp-1659973', 'mp-1765260', 'mp-1841948', 'mp-1638264']",4.23696715,"{'Sr': 4.0, 'Gd': 2.0, 'Cu': 4.0, 'Ru': 2.0, 'O': 16.0}",351.6072554818909,[],FiM,True,127,2,"[-0.0, -0.0, -0.0, -0.0, 6.9, 6.9, 0.0, 0.0, 0.0, 0.0, -1.8, -1.8, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0241005672319991,4.23696715,4,8.4739343,MP,data/source/MP/cleaned/cifs/MP-mp-1194240.cif,True,,data/final/MP/graphs/Cu2Gd1Nb0.1Ru0.9Sr2O8-MP-mp-1194240-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Bi1La0.8S2Th0.2O1,3,0.0799999999999999,2.0,False,Bi2La1.6S4Th0.4O2,Bi2La2S4O2,2.046,Oxide,True,Bi20La16S40Th4O20,Bi-La-S-Th-O,5,Supercon,La0.8Th0.2Bi1S2O1,MP-mp-1078397,La2Bi2S4O2,Bi-La-S-O,Bi20La20S40O20,P 4/n m m,tetragonal,4.055497,4.055497,14.173265,data/final/MP/cifs/Bi1La0.8S2Th0.2O1-MP-mp-1078397-synth_doped.cif,data/source/MP/raw/cifs/mp-1078397.cif,mp-1078397,1.0743999999999998,,2018-04-11 10:57:38,6.097899749460756,,,{'GGA': {'task_id': 'mp-1676377'}},0.0053330699999989,4.69184382,520.0,-61.66700475,-6.166700475,{'tags': ['Lanthanum bismuth oxodisulphate']},-61.66700475,-6.166700475,-2.09592004425,['bandstructure'],True,[196231],True,2021-05-12 10:58:14.654000,NM,10,5,mp-1078397,oxide,LaBiS2O,"{'functional': 'PBE', 'labels': ['La', 'Bi', 'S', 'O'], 'pot_type': 'paw'}","{'La': 1.0, 'Bi': 1.0, 'S': 2.0, 'O': 1.0}",GGA,mp-1078397,"['mp-1078397', 'mp-1380859', 'mp-1676377', 'mp-1776923', 'mp-1600973']",6.57e-05,"{'La': 2.0, 'Bi': 2.0, 'S': 4.0, 'O': 2.0}",233.1084819815865,[],NM,False,129,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.636860524465146e-07,6.57e-05,0,0.0001314,MP,data/source/MP/cleaned/cifs/MP-mp-1078397.cif,True,,data/final/MP/graphs/Bi1La0.8S2Th0.2O1-MP-mp-1078397-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ag0.438Hg0.562,3,0.124,8.0,False,Ag3.504Hg4.496,Ag4Hg4,0.64,Other,True,Ag43.8Hg56.2,Ag-Hg,2,Supercon,Ag0.438Hg0.562,MP-mp-758523,Ag4Hg4,Ag-Hg,Ag50Hg50,P 21 3,cubic,5.531463,5.531463,5.531463,data/final/MP/cifs/Ag0.438Hg0.562-MP-mp-758523-synth_doped.cif,data/source/MP/raw/cifs/mp-758523.cif,mp-758523,0.0,,2014-05-06 19:22:22,12.105573628551594,10.17188/1272776,"@misc{osti_1272776,
    author = ""Persson, Kristin"",
    title = ""Materials Data on AgHg (SG:198) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1272776"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1751588'}},0.0834321504166666,2.85397851,520.0,-11.87748827,-1.48468603375,{'tags': []},-11.87748827,-1.48468603375,0.0834321504166666,['bandstructure'],True,[],True,2021-05-12 10:59:01.620000,NM,8,8,mp-758523,,AgHg,"{'functional': 'PBE', 'labels': ['Ag', 'Hg'], 'pot_type': 'paw'}","{'Ag': 1.0, 'Hg': 1.0}",GGA,mp-758523,"['mp-881112', 'mp-895182', 'mp-758523', 'mp-1383228', 'mp-1751588', 'mp-1779026', 'mp-895651', 'mp-1618520']",0.00012045,"{'Ag': 4.0, 'Hg': 4.0}",169.246632081953,[],NM,False,198,0,"[0, 0, 0, 0, 0, 0, 0, 0]",2.8467331613825062e-06,0.00012045,0,0.0004818,MP,data/source/MP/cleaned/cifs/MP-mp-758523.cif,True,,data/final/MP/graphs/Ag0.438Hg0.562-MP-mp-758523-synth_doped.json,0,True,23,1,0,0,0,0,0,0,1,0,0,0,1.0,False
Rh3Th1,1,0.0,1.0,True,Rh3Th1,Rh3Th1,0.0,Other,True,Rh75Th25,Rh-Th,2,Supercon,Rh3Th1,MP-mp-2509,Th1Rh3,Rh-Th,Rh75Th25,P m -3 m,cubic,4.137493,4.137493,4.137493,data/final/MP/cifs/Rh3Th1-MP-mp-2509.cif,data/source/MP/raw/cifs/mp-2509.cif,mp-2509,0.0,,2011-05-13 06:52:01,12.67761246049922,10.17188/1200481,"@misc{osti_1200481,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ThRh3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1200481"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687689'}},0.0,7.05382116,520.0,-32.37751324,-8.09437831,{'tags': ['Rhodium thorium (3/1)']},-32.37751324,-8.09437831,-0.7176828449999997,"['xas', 'elasticity', 'bandstructure']",True,"[650460, 105950, 105949, 650470, 650468]",True,2021-05-12 10:56:16.728000,NM,4,8,mp-2509,,ThRh3,"{'functional': 'PBE', 'labels': ['Th', 'Rh_pv'], 'pot_type': 'paw'}","{'Th': 1.0, 'Rh': 3.0}",GGA,mp-2509,"['mp-991552', 'mp-993500', 'mp-2509', 'mp-1439095', 'mp-1687689', 'mp-1783503', 'mp-994828', 'mp-1588607']",0.0121254,"{'Th': 1.0, 'Rh': 3.0}",70.82911511295197,[],NM,False,221,0,"[0, 0, 0, 0]",0.0001711923123797,0.0121254,0,0.0121254,MP,data/source/MP/cleaned/cifs/MP-mp-2509.cif,False,,data/final/MP/graphs/Rh3Th1-MP-mp-2509.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Co1Si2,1,0.0,1.0,True,Co1Si2,Co1Si2,1.306666667,Other,True,Co33.333Si66.667,Co-Si,2,Supercon,Co1Si2,MP-mp-2379,Co1Si2,Co-Si,Co33.333Si66.667,F m -3 m,cubic,3.79018993,3.79018993,3.79018993,data/final/MP/cifs/Co1Si2-MP-mp-2379.cif,data/source/MP/raw/cifs/mp-2379.cif,mp-2379,0.0,,2011-05-12 18:05:08,4.9644635645178745,10.17188/1199728,"@misc{osti_1199728,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CoSi2 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199728"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688507'}},0.0,8.67415646,520.0,-19.3651998,-6.455066599999999,"{'tags': ['Cobalt silicide (1/2)', 'Cobalt silicon (1/2)']}",-19.3651998,-6.455066599999999,-0.4214179883333327,"['xas', 'elasticity', 'bandstructure']",True,"[27139, 625025, 625030, 189220]",True,2021-05-12 10:56:16.728000,NM,3,15,mp-2379,,CoSi2,"{'functional': 'PBE', 'labels': ['Co', 'Si'], 'pot_type': 'paw'}","{'Co': 1.0, 'Si': 2.0}",GGA,mp-2379,"['mp-1001056', 'mp-1007459', 'mp-2379', 'mp-1063298', 'mp-1063320', 'mp-1063304', 'mp-1138678', 'mp-1146710', 'mp-1263266', 'mp-1439919', 'mp-1688507', 'mp-1794218', 'mp-1012217', 'mp-1589701', 'mp-1063318']",0.003825,"{'Co': 1.0, 'Si': 2.0}",38.50063759015754,[],NM,False,225,0,"[-0.0, 0.0, 0.0]",9.934900405332088e-05,0.003825,0,0.003825,MP,data/source/MP/cleaned/cifs/MP-mp-2379.cif,False,,data/final/MP/graphs/Co1Si2-MP-mp-2379.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
C1Mg0.7Ni3Zn0.3,3,0.12,1.0,True,C1Mg0.7Ni3Zn0.3,C1Mg1Ni3,2.5,Other,True,C20Mg14Ni60Zn6,C-Mg-Ni-Zn,4,Supercon,Mg0.7Zn0.3C1Ni3,MP-mp-10700,Mg1Ni3C1,C-Mg-Ni,C20Mg20Ni60,P m -3 m,cubic,3.810209,3.810209,3.810209,data/final/MP/cifs/C1Mg0.7Ni3Zn0.3-MP-mp-10700-synth_doped.cif,data/source/MP/raw/cifs/mp-10700.cif,mp-10700,0.0,,2011-05-28 10:04:44,6.376007671789427,10.17188/1187303,"@misc{osti_1187303,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MgNi3C (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187303"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678621'}},0.0,6.64260176,520.0,-28.85099542,-5.770199084,{'tags': ['Magnesium nickel carbide (1/3/1)']},-28.85099542,-5.770199084,-0.1367049259999994,"['xas', 'elasticity', 'bandstructure']",True,[77152],True,2021-05-12 10:56:10.715000,NM,5,8,mp-10700,,MgNi3C,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Ni_pv', 'C'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",GGA,mp-10700,"['mp-927245', 'mp-927653', 'mp-911184', 'mp-10700', 'mp-1438083', 'mp-1678621', 'mp-1791467', 'mp-1591421']",0.0387875,"{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",55.31544309398296,[],NM,False,221,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",0.0007012056277683,0.0387875,0,0.0387875,MP,data/source/MP/cleaned/cifs/MP-mp-10700.cif,True,,data/final/MP/graphs/C1Mg0.7Ni3Zn0.3-MP-mp-10700-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
As1F0.11Fe1Nd1O0.89,3,0.0549999999999999,2.0,False,As2F0.22Fe2Nd2O1.78,As2Fe2Nd2O2,49.05,Ferrite,True,As25F2.75Fe25Nd25O22.25,As-F-Fe-Nd-O,5,Supercon,Nd1Fe1As1F0.11O0.89,MP-mp-622621,Nd2Fe2As2O2,As-Fe-Nd-O,As25Fe25Nd25O25,P 4/n m m,tetragonal,4.074653,4.074653,9.170967,data/final/MP/cifs/As1F0.11Fe1Nd1O0.89-MP-mp-622621-synth_doped.cif,data/source/MP/raw/cifs/mp-622621.cif,mp-622621,0.0,,2014-02-16 22:28:25,6.347279619112142,10.17188/1278150,"@misc{osti_1278150,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NdFeAsO (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278150"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-1677677'}},0.2809314202083302,3.74777613,520.0,-52.70842543,-6.58855317875,{'tags': ['Neodymium iron arsenic oxide (1/1/1/1)']},-52.70842543,-6.58855317875,-1.61299541125,"['xas', 'bandstructure']",True,"[163547, 164679, 422001, 163546, 236651, 236650, 602466, 164680, 164676]",True,2021-05-12 10:57:28.836000,FM,8,8,mp-622621,oxide,NdFeAsO,"{'functional': 'PBE', 'labels': ['Nd_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Nd': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-622621,"['mp-622621', 'mp-1079381', 'mp-1173401', 'mp-1438697', 'mp-1677677', 'mp-1772072', 'mp-1926310', 'mp-1592869']",3.83954265,"{'Nd': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",152.26370404041757,[],FM,True,129,1,"[0.0, 0.0, 3.6, 3.6, -0.0, -0.0, -0.0, -0.0]",0.0504328024094411,3.83954265,2,7.6790853,MP,data/source/MP/cleaned/cifs/MP-mp-622621.cif,True,,data/final/MP/graphs/As1F0.11Fe1Nd1O0.89-MP-mp-622621-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B2C1Fe0.02Ni1.98Y1,2,0.0066666666666666,1.0,True,B2C1Fe0.02Ni1.98Y1,B2C1Ni2Y1,13.4,Other,True,B33.333C16.667Fe0.333Ni33Y16.667,B-C-Fe-Ni-Y,5,Supercon,Y1Ni1.98Fe0.02B2C1,MP-mp-6576,Y1Ni2B2C1,B-C-Ni-Y,B33.333C16.667Ni33.333Y16.667,I 4/m m m,tetragonal,3.548790000501972,3.548790000501972,5.76144136,data/final/MP/cifs/B2C1Fe0.02Ni1.98Y1-MP-mp-6576-synth_doped.cif,data/source/MP/raw/cifs/mp-6576.cif,mp-6576,0.0,,2011-05-13 05:21:43,6.099730998852292,10.17188/1281366,"@misc{osti_1281366,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281366"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688230'}},0.0,6.81083016,520.0,-43.677878,-7.279646333333333,{'tags': []},-43.677878,-7.279646333333333,-0.5109282141666659,"['xas', 'bandstructure']",True,"[75816, 89142, 83231, 79574, 41549]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6576,,YNi2B2C,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6576,"['mp-6576', 'mp-1007054', 'mp-1000583', 'mp-1439516', 'mp-1688230', 'mp-1794280', 'mp-1011792', 'mp-1597064']",0.0006603,"{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.3152437079014,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",1.010943177297096e-05,0.0006603,0,0.0006603,MP,data/source/MP/cleaned/cifs/MP-mp-6576.cif,True,,data/final/MP/graphs/B2C1Fe0.02Ni1.98Y1-MP-mp-6576-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As1Fe1Nd1O0.7,3,0.1216216216216216,2.0,False,As2Fe2Nd2O1.4,As2Fe2Nd2O2,53.7,Ferrite,True,As27.027Fe27.027Nd27.027O18.918918918918916,As-Fe-Nd-O,4,Supercon,Nd1Fe1As1O0.7,MP-mp-622621,Nd2Fe2As2O2,As-Fe-Nd-O,As25Fe25Nd25O25,P 4/n m m,tetragonal,4.074653,4.074653,9.170967,data/final/MP/cifs/As1Fe1Nd1O0.7-MP-mp-622621-synth_doped.cif,data/source/MP/raw/cifs/mp-622621.cif,mp-622621,0.0,,2014-02-16 22:28:25,6.347279619112142,10.17188/1278150,"@misc{osti_1278150,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NdFeAsO (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278150"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-1677677'}},0.2809314202083302,3.74777613,520.0,-52.70842543,-6.58855317875,{'tags': ['Neodymium iron arsenic oxide (1/1/1/1)']},-52.70842543,-6.58855317875,-1.61299541125,"['xas', 'bandstructure']",True,"[163547, 164679, 422001, 163546, 236651, 236650, 602466, 164680, 164676]",True,2021-05-12 10:57:28.836000,FM,8,8,mp-622621,oxide,NdFeAsO,"{'functional': 'PBE', 'labels': ['Nd_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Nd': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-622621,"['mp-622621', 'mp-1079381', 'mp-1173401', 'mp-1438697', 'mp-1677677', 'mp-1772072', 'mp-1926310', 'mp-1592869']",3.83954265,"{'Nd': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",152.26370404041757,[],FM,True,129,1,"[0.0, 0.0, 3.6, 3.6, -0.0, -0.0, -0.0, -0.0]",0.0504328024094411,3.83954265,2,7.6790853,MP,data/source/MP/cleaned/cifs/MP-mp-622621.cif,True,,data/final/MP/graphs/As1Fe1Nd1O0.7-MP-mp-622621-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ca1.5Ru1Sr0.5O4,1,0.0,4.0,False,Ca6Ru4Sr2O16,Ca6Ru4Sr2O16,0.0,Oxide,True,Ca21.429Ru14.286Sr7.143O57.142857142857146,Ca-Ru-Sr-O,4,Supercon,Sr0.5Ca1.5Ru1O4,MP-mp-1218458,Sr2Ca6Ru4O16,Ca-Ru-Sr-O,Ca21.429Ru14.286Sr7.143O57.142857142857146,I b a 2,orthorhombic,5.377835998076124,5.377525998077448,13.27929773,data/final/MP/cifs/Ca1.5Ru1Sr0.5O4-MP-mp-1218458.cif,data/source/MP/raw/cifs/mp-1218458.cif,mp-1218458,0.0,,2019-01-12 19:37:22.195000,4.855857690820738,,,,0.0318479221726217,4.30674792,520.0,-190.42513831,-6.800897796785714,{'tags': []},-190.42513831,-6.800897796785714,-2.4907006222619046,[],False,[],True,2021-05-12 11:00:42.526000,FM,28,3,mp-1218458,oxide,SrCa3(RuO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Ru_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Ca': 3.0, 'Ru': 2.0, 'O': 8.0}",GGA,mp-1218458,"['mp-1218458', 'mp-1368385', 'mp-1836719']",3.210669,"{'Sr': 2.0, 'Ca': 6.0, 'Ru': 4.0, 'O': 16.0}",367.9482146676692,[],FM,True,45,2,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 1.4, 1.4, 0.9, 0.9, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0174517438705328,3.210669,4,6.421338,MP,data/source/MP/cleaned/cifs/MP-mp-1218458.cif,False,,data/final/MP/graphs/Ca1.5Ru1Sr0.5O4-MP-mp-1218458.json,0,True,mm2,0,0,0,6,0,0,0,0,0,1,0,1.0,False
B2C1Gd0.19Lu0.81Ni2,3,0.0633333333333333,1.0,True,B2C1Gd0.19Lu0.81Ni2,B2C1Lu1Ni2,6.155,Other,True,B33.333C16.667Gd3.167Lu13.5Ni33.333,B-C-Gd-Lu-Ni,5,Supercon,Lu0.81Gd0.19Ni2B2C1,MP-mp-6544,Lu1Ni2B2C1,B-C-Lu-Ni,B33.333C16.667Lu16.667Ni33.333,I 4/m m m,tetragonal,3.4660159989239463,3.4660159989239463,5.81490896,data/final/MP/cifs/B2C1Gd0.19Lu0.81Ni2-MP-mp-6544-synth_doped.cif,data/source/MP/raw/cifs/mp-6544.cif,mp-6544,0.0,,2011-05-13 04:17:06,8.54504130524706,10.17188/1281287,"@misc{osti_1281287,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LuNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281287"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702891'}},0.0,6.71335166,520.0,-41.78223818,-6.963706363333333,{'tags': []},-41.78223818,-6.963706363333333,-0.5192416763888884,"['xas', 'bandstructure']",True,"[75609, 83230, 79564]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6544,,LuNi2B2C,"{'functional': 'PBE', 'labels': ['Lu_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Lu': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6544,"['mp-1000584', 'mp-1007055', 'mp-6544', 'mp-1441469', 'mp-1702891', 'mp-1783160', 'mp-1011794', 'mp-1588498']",0.0023161,"{'Lu': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",63.34823894903922,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",3.656139520884231e-05,0.0023161,0,0.0023161,MP,data/source/MP/cleaned/cifs/MP-mp-6544.cif,True,,data/final/MP/graphs/B2C1Gd0.19Lu0.81Ni2-MP-mp-6544-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As1Fe1Tb1O0.82,3,0.0706806282722513,2.0,False,As2Fe2Tb2O1.64,As2Fe2Tb2O2,43.8,Ferrite,True,As26.178Fe26.178Tb26.178O21.465968586387433,As-Fe-Tb-O,4,Supercon,Tb1Fe1As1O0.82,MP-mp-1079887,Tb2Fe2As2O2,As-Fe-Tb-O,As25Fe25Tb25O25,P 4/n m m,tetragonal,3.971557,3.971557,9.096524,data/final/MP/cifs/As1Fe1Tb1O0.82-MP-mp-1079887-synth_doped.cif,data/source/MP/raw/cifs/mp-1079887.cif,mp-1079887,0.0,,2018-04-16 16:53:03,7.075630957925009,,,{'GGA+U': {'task_id': 'mp-1697746'}},0.2848640540625,4.29262424,520.0,-53.1200584,-6.6400073,{'tags': []},-53.1200584,-6.6400073,-1.69789381,['bandstructure'],True,[422004],True,2021-05-12 10:58:16.596000,FM,8,5,mp-1079887,oxide,TbFeAsO,"{'functional': 'PBE', 'labels': ['Tb_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Tb': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-1079887,"['mp-1079887', 'mp-1418181', 'mp-1697746', 'mp-1779163', 'mp-1589035']",3.7855201,"{'Tb': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",143.48188366951112,[],FM,True,129,1,"[0.0, 0.0, 3.6, 3.6, 0.0, 0.0, 0.0, 0.0]",0.0527665235942869,3.7855201,2,7.5710402,MP,data/source/MP/cleaned/cifs/MP-mp-1079887.cif,True,,data/final/MP/graphs/As1Fe1Tb1O0.82-MP-mp-1079887-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
N0.8Nb1,3,0.111111111111111,1.0,True,N0.8Nb1,N1Nb1,8.9,Other,True,N44.444Nb55.556,N-Nb,2,Supercon,N0.8Nb1,MP-mp-2634,Nb1N1,N-Nb,N50Nb50,P -6 m 2,hexagonal,2.898656,2.9761920047347994,2.97619211,data/final/MP/cifs/N0.8Nb1-MP-mp-2634-synth_doped.cif,data/source/MP/raw/cifs/mp-2634.cif,mp-2634,0.0,,2011-05-12 17:49:04,7.984187332554685,10.17188/1201157,"@misc{osti_1201157,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbN (SG:187) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201157"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671304'}},0.0,7.12357548,520.0,-20.57319827,-10.286599135,"{'tags': ['Niobium nitride (1/1)', 'Niobium nitride', 'Niobium nitride (1/1) - gamma']}",-20.57319827,-10.286599135,-1.2481991524999998,"['xas', 'elasticity', 'bandstructure']",True,"[185569, 644536, 76385, 191062]",True,2021-05-12 10:56:18.721000,NM,2,17,mp-2634,,NbN,"{'functional': 'PBE', 'labels': ['Nb_pv', 'N'], 'pot_type': 'paw'}","{'Nb': 1.0, 'N': 1.0}",GGA,mp-2634,"['mp-926732', 'mp-910421', 'mp-926222', 'mp-2634', 'mp-1058402', 'mp-1058440', 'mp-1058487', 'mp-1061535', 'mp-1061589', 'mp-1061648', 'mp-1116126', 'mp-1442283', 'mp-1671304', 'mp-1924826', 'mp-1594881', 'mp-1061618', 'mp-1058457']",0.0002504,"{'Nb': 1.0, 'N': 1.0}",22.23561881453577,[],NM,False,187,0,"[0, 0]",1.1261211216496917e-05,0.0002504,0,0.0002504,MP,data/source/MP/cleaned/cifs/MP-mp-2634.cif,True,,data/final/MP/graphs/N0.8Nb1-MP-mp-2634-synth_doped.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
B2Mg0.85Na0.15,3,0.1,1.0,True,B2Mg0.85Na0.15,B2Mg1,38.0,Other,True,B66.667Mg28.333Na5,B-Mg-Na,3,Supercon,Mg0.85Na0.15B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B2Mg0.85Na0.15-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B2Mg0.85Na0.15-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
As2F2Sr2Ti2O1,1,0.0,1.0,True,As2F2Sr2Ti2O1,As2F2Sr2Ti2O1,0.0,Oxide,True,As22.222F22.222Sr22.222Ti22.222O11.11111111111111,As-F-Sr-Ti-O,5,Supercon,Sr2F2Ti2As2O1,MP-mp-1079747,Sr2Ti2As2O1F2,As-F-Sr-Ti-O,As22.222F22.222Sr22.222Ti22.222O11.11111111111111,I 4/m m m,tetragonal,4.05970400029269,4.05970400029269,10.27223323,data/final/MP/cifs/As2F2Sr2Ti2O1-MP-mp-1079747.cif,data/source/MP/raw/cifs/mp-1079747.cif,mp-1079747,0.0,,2018-04-16 04:44:32,4.850378375112182,,,{'GGA': {'task_id': 'mp-1698082'}},0.0,4.53892466,520.0,-58.59595561,-6.510661734444444,{'tags': []},-58.59595561,-6.510661734444444,-2.5497587688888887,['bandstructure'],True,[167013],True,2021-05-12 10:58:16.596000,NM,9,5,mp-1079747,oxide,Sr2Ti2As2OF2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ti_pv', 'As', 'O', 'F'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ti': 2.0, 'As': 2.0, 'O': 1.0, 'F': 2.0}",GGA,mp-1079747,"['mp-1079747', 'mp-1426549', 'mp-1698082', 'mp-1780767', 'mp-1602295']",0.0036781,"{'Sr': 2.0, 'Ti': 2.0, 'As': 2.0, 'O': 1.0, 'F': 2.0}",162.5535473104996,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0]",2.262700544439257e-05,0.0036781,0,0.0036781,MP,data/source/MP/cleaned/cifs/MP-mp-1079747.cif,False,,data/final/MP/graphs/As2F2Sr2Ti2O1-MP-mp-1079747.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ge10Os4Y5,1,0.0,2.0,False,Ge20Os8Y10,Ge20Os8Y10,8.946666667,Other,True,Ge52.632Os21.053Y26.316,Ge-Os-Y,3,Supercon,Y5Os4Ge10,MP-mp-1195689,Y10Ge20Os8,Ge-Os-Y,Ge52.632Os21.053Y26.316,P 4/m b m,tetragonal,4.288046,13.204189,13.204189,data/final/MP/cifs/Ge10Os4Y5-MP-mp-1195689.cif,data/source/MP/raw/cifs/mp-1195689.cif,mp-1195689,0.0,,2019-01-12 01:00:39.670000,8.581622911323853,,,,0.0,4.73412716,520.0,-267.92733239,-7.050719273421053,"{'tags': ['Sc5Co4Si10', 'Y5Os4Ge10', 'Yttrium osmium germanide (5/4/10)']}",-267.92733239,-7.050719273421053,-0.5521877399122813,[],False,"[637485, 637487]",True,2021-05-12 10:59:59.077000,NM,38,3,mp-1195689,,Y5(Ge5Os2)2,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ge_d', 'Os_pv'], 'pot_type': 'paw'}","{'Y': 5.0, 'Ge': 10.0, 'Os': 4.0}",GGA,mp-1195689,"['mp-1195689', 'mp-1202448', 'mp-1323727']",0.0092948,"{'Y': 10.0, 'Ge': 20.0, 'Os': 8.0}",747.6234235773563,[],NM,False,6,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, 0.0, -0.0, -0.0, 0.0, -0.0, 0.0, 0.0]",2.4864924524501e-05,0.0092948,0,0.0185896,MP,data/source/MP/cleaned/cifs/MP-mp-1195689.cif,False,,data/final/MP/graphs/Ge10Os4Y5-MP-mp-1195689.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
As1Hf1,1,0.0,4.0,False,As4Hf4,As4Hf4,0.0,Other,True,As50Hf50,As-Hf,2,Supercon,As1Hf1,MP-mp-9954,Hf4As4,As-Hf,As50Hf50,P 63/m m c,hexagonal,3.800690003544777,3.80069079,12.805168,data/final/MP/cifs/As1Hf1-MP-mp-9954.cif,data/source/MP/raw/cifs/mp-9954.cif,mp-9954,0.0,,2011-05-28 10:19:26,10.507385138519636,10.17188/1317054,"@misc{osti_1317054,
    author = ""Persson, Kristin"",
    title = ""Materials Data on HfAs (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1317054"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701956'}},0.0,6.28483671,520.0,-66.44556859,-8.30569607375,"{'tags': ['Hafnium arsenide', 'Hafnium arsenide (1/1)']}",-66.44556859,-8.30569607375,-0.9975424462499998,"['xas', 'elasticity', 'bandstructure']",True,"[42915, 610635]",True,2021-05-12 10:56:37.246000,NM,8,8,mp-9954,,HfAs,"{'functional': 'PBE', 'labels': ['Hf_pv', 'As'], 'pot_type': 'paw'}","{'Hf': 1.0, 'As': 1.0}",GGA,mp-9954,"['mp-909868', 'mp-924888', 'mp-925856', 'mp-9954', 'mp-1431590', 'mp-1701956', 'mp-1921028', 'mp-1592760']",0.00137695,"{'Hf': 4.0, 'As': 4.0}",160.19203871645584,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",3.4382482700959645e-05,0.00137695,0,0.0055078,MP,data/source/MP/cleaned/cifs/MP-mp-9954.cif,False,,data/final/MP/graphs/As1Hf1-MP-mp-9954.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
H0.938Pd1,2,0.0319917440660475,2.0,False,H1.876Pd2,H2Pd2,5.523,Other,True,H48.4Pd51.6,H-Pd,2,Supercon,H0.938Pd1,MP-mp-1184548,H2Pd2,H-Pd,H50Pd50,P 63 m c,hexagonal,2.968136003881316,2.96813585,5.040799,data/final/MP/cifs/H0.938Pd1-MP-mp-1184548-synth_doped.cif,data/source/MP/raw/cifs/mp-1184548.cif,mp-1184548,0.0,,2019-01-11 12:52:40.348000,9.276812227294194,,,{'GGA': {'task_id': 'mp-1734957'}},0.0,3.52113336,520.0,-17.47744839,-4.3693620975,{'tags': []},-17.47744839,-4.3693620975,-0.0830581699999992,['bandstructure'],True,[],True,2021-05-12 10:58:27.755000,NM,4,5,mp-1184548,,HPd,"{'functional': 'PBE', 'labels': ['H', 'Pd'], 'pot_type': 'paw'}","{'H': 1.0, 'Pd': 1.0}",GGA,mp-1184548,"['mp-1184548', 'mp-1426775', 'mp-1734957', 'mp-1792734', 'mp-1612181']",3.7e-05,"{'H': 2.0, 'Pd': 2.0}",38.45896345503417,[],NM,False,186,0,"[0, 0, 0, 0]",1.924128820749941e-06,3.7e-05,0,7.4e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1184548.cif,True,,data/final/MP/graphs/H0.938Pd1-MP-mp-1184548-synth_doped.json,0,True,6mm,0,5,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Ca2Cu3Hg0.9Pb0.1O8,2,0.0124999999999999,1.0,True,Ba2Ca2Cu3Hg0.9Pb0.1O8,Ba2Ca2Cu3Hg1O8,130.0,Cuprate,True,Ba12.5Ca12.5Cu18.75Hg5.625Pb0.625O50,Ba-Ca-Cu-Hg-Pb-O,6,Supercon,Hg0.9Pb0.1Ba2Ca2Cu3O8,MP-mp-22601,Ba2Ca2Cu3Hg1O8,Ba-Ca-Cu-Hg-O,Ba12.5Ca12.5Cu18.75Hg6.25O50,P 4/m m m,tetragonal,3.892682,3.892682,16.248444,data/final/MP/cifs/Ba2Ca2Cu3Hg0.9Pb0.1O8-MP-mp-22601-synth_doped.cif,data/source/MP/raw/cifs/mp-22601.cif,mp-22601,0.0,,2014-02-22 21:26:14,5.894777202717408,10.17188/1198815,"@misc{osti_1198815,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Ca2Cu3HgO8 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198815"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702575'}},0.017646669895833,3.3485087,520.0,-87.2132649,-5.45082905625,{'tags': ['High pressure experimental phase']},-87.2132649,-5.45082905625,-2.0421959415624995,"['xas', 'bandstructure']",True,"[75735, 75731, 75736, 75733, 75734, 75737, 75730, 75732]",True,2021-05-12 10:58:03.426000,NM,16,11,mp-22601,oxide,Ba2Ca2Cu3HgO8,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ca_sv', 'Cu_pv', 'Hg', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Ca': 2.0, 'Cu': 3.0, 'Hg': 1.0, 'O': 8.0}",GGA,mp-22601,"['mp-1001293', 'mp-1007610', 'mp-22601', 'mp-1045042', 'mp-1045054', 'mvc-16317', 'mp-1433925', 'mp-1702575', 'mp-1776236', 'mp-1597784', 'mp-1045058']",0.0379919,"{'Ba': 2.0, 'Ca': 2.0, 'Cu': 3.0, 'Hg': 1.0, 'O': 8.0}",246.2122357120388,[],NM,False,123,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001543054913177,0.0379919,0,0.0379919,MP,data/source/MP/cleaned/cifs/MP-mp-22601.cif,True,,data/final/MP/graphs/Ba2Ca2Cu3Hg0.9Pb0.1O8-MP-mp-22601-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Bi1K0.9La0.1O3,2,0.0399999999999999,1.0,True,Bi1K0.9La0.1O3,Bi1K1O3,5.74,Oxide,True,Bi20K18La2O60,Bi-K-La-O,4,Supercon,K0.9La0.1Bi1O3,MP-mp-982040,K1Bi1O3,Bi-K-O,Bi20K20O60,P m -3 m,cubic,4.284204,4.284204,4.284204,data/final/MP/cifs/Bi1K0.9La0.1O3-MP-mp-982040-synth_doped.cif,data/source/MP/raw/cifs/mp-982040.cif,mp-982040,0.0,,2015-10-12 11:25:13,6.252348761231978,10.17188/1316390,"@misc{osti_1316390,
    author = ""Persson, Kristin"",
    title = ""Materials Data on KBiO3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1316390"",
    place = ""United States"",
    year = ""2016"",
    month = ""9"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1717462'}},0.0928686834999998,1.80216133,520.0,-25.20286901,-5.040573802,{'tags': []},-25.20286901,-5.040573802,-1.4839105476,"['xas', 'elasticity']",False,[],True,2021-05-12 10:56:37.246000,NM,5,9,mp-982040,oxide,KBiO3,"{'functional': 'PBE', 'labels': ['K_sv', 'Bi', 'O'], 'pot_type': 'paw'}","{'K': 1.0, 'Bi': 1.0, 'O': 3.0}",GGA,mp-982040,"['mp-982222', 'mp-1006156', 'mp-982040', 'mp-1006117', 'mp-1431172', 'mp-1717462', 'mp-1798749', 'mp-1011221', 'mp-1585048']",0.0005425,"{'K': 1.0, 'Bi': 1.0, 'O': 3.0}",78.63401066432932,[],NM,False,221,0,"[0, 0, 0, 0, 0]",6.899050365315956e-06,0.0005425,0,0.0005425,MP,data/source/MP/cleaned/cifs/MP-mp-982040.cif,True,,data/final/MP/graphs/Bi1K0.9La0.1O3-MP-mp-982040-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Cu3Tm1O7,1,0.0,1.0,True,Ba2Cu3Tm1O7,Ba2Cu3Tm1O7,90.83333333,Cuprate,True,Ba15.385Cu23.077Tm7.692O53.84615384615385,Ba-Cu-Tm-O,4,Supercon,Tm1Ba2Cu3O7,MP-mp-622108,Ba2Tm1Cu3O7,Ba-Cu-Tm-O,Ba15.385Cu23.077Tm7.692O53.84615384615385,P m m m,orthorhombic,3.821938,3.925934,11.73833,data/final/MP/cifs/Ba2Cu3Tm1O7-MP-mp-622108.cif,data/source/MP/raw/cifs/mp-622108.cif,mp-622108,0.0,,2014-02-16 03:37:00,7.035325660398206,10.17188/1278093,"@misc{osti_1278093,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2TmCu3O7 (SG:47) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278093"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702789'}},0.0360076917307745,3.26053774,520.0,-78.99037859,-6.076182968461539,{'tags': ['Thulium dibarium dicopper copper(III) oxide']},-78.99037859,-6.076182968461539,-2.196327266282052,['bandstructure'],True,[81177],True,2021-05-12 10:58:51.532000,NM,13,10,mp-622108,oxide,Ba2TmCu3O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Tm_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Tm': 1.0, 'Cu': 3.0, 'O': 7.0}",GGA,mp-622108,"['mp-932739', 'mp-622108', 'mp-916327', 'mp-931663', 'mp-1182602', 'mp-1238995', 'mp-1420833', 'mp-1702789', 'mp-1779738', 'mp-1600103']",1.21e-05,"{'Ba': 2.0, 'Tm': 1.0, 'Cu': 3.0, 'O': 7.0}",176.12984242319212,[],NM,False,47,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.869931769385786e-08,1.21e-05,0,1.21e-05,MP,data/source/MP/cleaned/cifs/MP-mp-622108.cif,False,,data/final/MP/graphs/Ba2Cu3Tm1O7-MP-mp-622108.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Cu1Rh1.78Se4Sn0.22,3,0.0628571428571428,2.0,False,Cu2Rh3.56Se8Sn0.44,Cu2Rh4Se8,1.92,Other,True,Cu14.286Rh25.429Se57.143Sn3.143,Cu-Rh-Se-Sn,4,Supercon,Cu1Rh1.78Sn0.22Se4,MP-mp-15614,Cu2Rh4Se8,Cu-Rh-Se,Cu14.286Rh28.571Se57.143,F d -3 m,cubic,7.355548180000001,7.35554818,7.35554818,data/final/MP/cifs/Cu1Rh1.78Se4Sn0.22-MP-mp-15614-synth_doped.cif,data/source/MP/raw/cifs/mp-15614.cif,mp-15614,0.0,,2011-06-05 07:24:52,6.906389184589765,10.17188/1191272,"@misc{osti_1191272,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Cu(RhSe2)2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191272"",
    place = ""United States"",
    year = ""2015"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696606'}},0.0,4.3275914,520.0,-70.96322011,-5.068801436428571,"{'tags': ['Copper rhodium selenide (1/2/4)', 'Copper dirhodium tetraselenide']}",-70.96322011,-5.068801436428571,-0.6511631049107142,"['xas', 'bandstructure']",True,"[41903, 628775, 628777, 602898]",True,2021-05-12 10:56:53.126000,NM,14,8,mp-15614,,Cu(RhSe2)2,"{'functional': 'PBE', 'labels': ['Cu_pv', 'Rh_pv', 'Se'], 'pot_type': 'paw'}","{'Cu': 1.0, 'Rh': 2.0, 'Se': 4.0}",GGA,mp-15614,"['mp-920967', 'mp-942426', 'mp-942820', 'mp-15614', 'mp-1422873', 'mp-1696606', 'mp-1860746', 'mp-1604721']",0.00066735,"{'Cu': 2.0, 'Rh': 4.0, 'Se': 8.0}",281.40391576118253,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.743004362216169e-06,0.00066735,0,0.0013347,MP,data/source/MP/cleaned/cifs/MP-mp-15614.cif,True,,data/final/MP/graphs/Cu1Rh1.78Se4Sn0.22-MP-mp-15614-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ce0.12Si1V2.88,3,0.06,2.0,False,Ce0.24Si2V5.76,Si2V6,15.32,Other,True,Ce3Si25V72,Ce-Si-V,3,Supercon,Ce0.12Si1V2.88,MP-mp-2567,V6Si2,Si-V,Si25V75,P m -3 n,cubic,4.702381,4.702381,4.702381,data/final/MP/cifs/Ce0.12Si1V2.88-MP-mp-2567-synth_doped.cif,data/source/MP/raw/cifs/mp-2567.cif,mp-2567,0.0,,2011-05-13 19:15:43,5.778142190030859,10.17188/1200874,"@misc{osti_1200874,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Si (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1200874"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668672'}},0.0,7.30599425,520.0,-69.05773321,-8.63221665125,{'tags': ['Vanadium silicide (3/1)']},-69.05773321,-8.63221665125,-0.4452085937499994,"['xas', 'elasticity', 'bandstructure']",True,"[652491, 87328, 652522, 652502, 652510, 652520, 600518, 186003, 652507, 652513, 652497, 601150, 652514, 652487, 22412, 652509, 652529, 652532, 652499, 652539, 652537, 652533, 652512, 652538, 652490, 652493, 652494, 652511, 652519, 87329, 652526, 652500]",True,2021-05-12 10:56:18.721000,FM,8,13,mp-2567,,V3Si,"{'functional': 'PBE', 'labels': ['V_pv', 'Si'], 'pot_type': 'paw'}","{'V': 3.0, 'Si': 1.0}",GGA,mp-2567,"['mp-920081', 'mp-906309', 'mp-919083', 'mp-2567', 'mp-1078474', 'mp-1078852', 'mp-1138781', 'mp-1145907', 'mp-1440678', 'mp-1668672', 'mp-1795955', 'mp-1593554', 'mp-1596575']",0.8382519,"{'V': 6.0, 'Si': 2.0}",103.98086881866836,[],FM,True,131,1,"[0.2, 0.3, 0.3, 0.2, 0.3, 0.3, 0.0, 0.0]",0.0161231947669493,0.8382519,6,1.6765038,MP,data/source/MP/cleaned/cifs/MP-mp-2567.cif,True,,data/final/MP/graphs/Ce0.12Si1V2.88-MP-mp-2567-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba0.59Bi1K0.41O3,2,0.0306666666666666,3.0,False,Ba1.77Bi3K1.23O9,Ba2Bi3K1O9,31.0,Oxide,True,Ba11.8Bi20K8.2O60,Ba-Bi-K-O,4,Supercon,Ba0.59K0.41Bi1O3,MP-mp-1223518,K1Ba2Bi3O9,Ba-Bi-K-O,Ba13.333Bi20K6.667O60,P -3 m 1,trigonal,6.18756400330999,6.187564340000001,7.581401,data/final/MP/cifs/Ba0.59Bi1K0.41O3-MP-mp-1223518-synth_doped.cif,data/source/MP/raw/cifs/mp-1223518.cif,mp-1223518,0.0,,2019-01-12 23:54:06.965000,7.16530091201999,,,{'GGA': {'task_id': 'mp-1729135'}},0.001551682833333,3.46143017,520.0,-85.22271396,-5.681514264,{'tags': []},-85.22271396,-5.681514264,-2.0170414252000004,[],False,[],True,2021-05-12 11:00:52.054000,NM,15,4,mp-1223518,oxide,KBa2(BiO3)3,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Bi', 'O'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 2.0, 'Bi': 3.0, 'O': 9.0}",GGA,mp-1223518,"['mp-1223518', 'mp-1391182', 'mp-1729135', 'mp-1775199']",4.99e-05,"{'K': 1.0, 'Ba': 2.0, 'Bi': 3.0, 'O': 9.0}",251.37352739849624,[],NM,False,164,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.9850936777799505e-07,4.99e-05,0,4.99e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1223518.cif,True,,data/final/MP/graphs/Ba0.59Bi1K0.41O3-MP-mp-1223518-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Si1Ti1,1,0.0,4.0,False,Si4Ti4,Si4Ti4,0.0,Other,True,Si50Ti50,Si-Ti,2,Supercon,Si1Ti1,MP-mp-7092,Ti4Si4,Si-Ti,Si50Ti50,P n m a,orthorhombic,3.641735,5.010799,6.544556,data/final/MP/cifs/Si1Ti1-MP-mp-7092.cif,data/source/MP/raw/cifs/mp-7092.cif,mp-7092,0.0,,2011-05-28 07:55:31,4.224308740491082,10.17188/1286574,"@misc{osti_1286574,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TiSi (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1286574"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701827'}},0.0,8.21958673,520.0,-59.43398614,-7.4292482675,"{'tags': ['Titanium silicide', 'Silicon titanium (1/1)']}",-59.43398614,-7.4292482675,-0.7333452491666668,"['bandstructure', 'elasticity']",True,"[168416, 652414, 43494]",True,2021-05-12 10:56:29.056000,NM,8,11,mp-7092,,TiSi,"{'functional': 'PBE', 'labels': ['Ti_pv', 'Si'], 'pot_type': 'paw'}","{'Ti': 1.0, 'Si': 1.0}",GGA,mp-7092,"['mp-925530', 'mp-925971', 'mp-7092', 'mp-910007', 'mp-1125111', 'mp-1133322', 'mp-1248127', 'mp-1430942', 'mp-1701827', 'mp-1803008', 'mp-1595422']",1.08e-05,"{'Ti': 4.0, 'Si': 4.0}",119.42507160712368,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0]",3.61733088526975e-07,1.08e-05,0,4.32e-05,MP,data/source/MP/cleaned/cifs/MP-mp-7092.cif,False,,data/final/MP/graphs/Si1Ti1-MP-mp-7092.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Cr0.21Si1V2.79,3,0.1049999999999999,2.0,False,Cr0.42Si2V5.58,Si2V6,0.0,Other,True,Cr5.25Si25V69.75,Cr-Si-V,3,Supercon,Cr0.21Si1V2.79,MP-mp-2567,V6Si2,Si-V,Si25V75,P m -3 n,cubic,4.702381,4.702381,4.702381,data/final/MP/cifs/Cr0.21Si1V2.79-MP-mp-2567-synth_doped.cif,data/source/MP/raw/cifs/mp-2567.cif,mp-2567,0.0,,2011-05-13 19:15:43,5.778142190030859,10.17188/1200874,"@misc{osti_1200874,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Si (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1200874"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668672'}},0.0,7.30599425,520.0,-69.05773321,-8.63221665125,{'tags': ['Vanadium silicide (3/1)']},-69.05773321,-8.63221665125,-0.4452085937499994,"['xas', 'elasticity', 'bandstructure']",True,"[652491, 87328, 652522, 652502, 652510, 652520, 600518, 186003, 652507, 652513, 652497, 601150, 652514, 652487, 22412, 652509, 652529, 652532, 652499, 652539, 652537, 652533, 652512, 652538, 652490, 652493, 652494, 652511, 652519, 87329, 652526, 652500]",True,2021-05-12 10:56:18.721000,FM,8,13,mp-2567,,V3Si,"{'functional': 'PBE', 'labels': ['V_pv', 'Si'], 'pot_type': 'paw'}","{'V': 3.0, 'Si': 1.0}",GGA,mp-2567,"['mp-920081', 'mp-906309', 'mp-919083', 'mp-2567', 'mp-1078474', 'mp-1078852', 'mp-1138781', 'mp-1145907', 'mp-1440678', 'mp-1668672', 'mp-1795955', 'mp-1593554', 'mp-1596575']",0.8382519,"{'V': 6.0, 'Si': 2.0}",103.98086881866836,[],FM,True,131,1,"[0.2, 0.3, 0.3, 0.2, 0.3, 0.3, 0.0, 0.0]",0.0161231947669493,0.8382519,6,1.6765038,MP,data/source/MP/cleaned/cifs/MP-mp-2567.cif,True,,data/final/MP/graphs/Cr0.21Si1V2.79-MP-mp-2567-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
In2Te3,1,0.0,1.0,True,In2Te3,In2Te3,0.0,Other,True,In40Te60,In-Te,2,Supercon,In2Te3,MP-mp-1068510,In2Te3,In-Te,In40Te60,R -3 m,trigonal,4.34819722568326,4.34819722568326,10.10580354,data/final/MP/cifs/In2Te3-MP-mp-1068510.cif,data/source/MP/raw/cifs/mp-1068510.cif,mp-1068510,0.0,,2018-03-21 23:14:38,6.344848636998901,,,{'GGA': {'task_id': 'mp-1671188'}},0.0754010729777774,5.55310562,520.0,-16.07713617,-3.215427234,"{'tags': ['Indium telluride (2/3)', 'Indium sesquitelluride', 'High pressure experimental phase']}",-16.07713617,-3.215427234,-0.4819731840000003,['bandstructure'],True,"[657607, 640609]",True,2021-05-12 10:58:14.654000,NM,5,12,mp-1068510,,In2Te3,"{'functional': 'PBE', 'labels': ['In_d', 'Te'], 'pot_type': 'paw'}","{'In': 2.0, 'Te': 3.0}",GGA,mp-1068510,"['mp-1068603', 'mp-1068510', 'mp-1068541', 'mp-1069025', 'mp-1068936', 'mp-1068971', 'mp-1300038', 'mp-1671188', 'mp-1939459', 'mp-1588015', 'mp-1069016', 'mp-1068595']",0.0003781,"{'In': 2.0, 'Te': 3.0}",160.2833987026779,[],NM,False,166,0,"[0, 0, 0, 0, 0]",2.3589467347230823e-06,0.0003781,0,0.0003781,MP,data/source/MP/cleaned/cifs/MP-mp-1068510.cif,False,,data/final/MP/graphs/In2Te3-MP-mp-1068510.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Fe1.68K0.75Se2,3,0.1029345372460496,1.0,True,Fe1.68K0.75Se2,Fe2K1Se2,31.0,Ferrite,True,Fe37.923K16.93Se45.147,Fe-K-Se,3,Supercon,K0.75Fe1.68Se2,MP-mp-1070735,K1Fe2Se2,Fe-K-Se,Fe40K20Se40,I 4/m m m,tetragonal,3.783558000712664,3.783558000712664,7.91886339,data/final/MP/cifs/Fe1.68K0.75Se2-MP-mp-1070735-synth_doped.cif,data/source/MP/raw/cifs/mp-1070735.cif,mp-1070735,0.0,,2018-03-22 03:52:22,4.804538531009527,,,{'GGA': {'task_id': 'mp-1761650'}},0.0327827750000011,3.42423866,520.0,-27.50456218,-5.500912436,{'tags': ['Potassium iron selenide (1/2/2)']},-27.50456218,-5.500912436,-0.6812646755374999,['bandstructure'],True,[186573],True,2021-05-12 10:58:14.654000,FM,5,8,mp-1070735,,K(FeSe)2,"{'functional': 'PBE', 'labels': ['K_sv', 'Fe_pv', 'Se'], 'pot_type': 'paw'}","{'K': 1.0, 'Fe': 2.0, 'Se': 2.0}",GGA,mp-1070735,"['mp-1070735', 'mp-1070765', 'mp-1070841', 'mp-1416829', 'mp-1761650', 'mp-1797161', 'mp-1585994', 'mp-1070830']",6.0503851,"{'K': 1.0, 'Fe': 2.0, 'Se': 2.0}",106.69540665041993,[],FM,True,139,1,"[0.0, 2.8, 2.8, 0.0, 0.0]",0.0567070813069176,6.0503851,2,6.0503851,MP,data/source/MP/cleaned/cifs/MP-mp-1070735.cif,True,,data/final/MP/graphs/Fe1.68K0.75Se2-MP-mp-1070735-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As1Fe0.98Li1Ni0.02,2,0.0133333333333333,2.0,False,As2Fe1.96Li2Ni0.04,As2Fe2Li2,10.58,Ferrite,True,As33.333Fe32.667Li33.333Ni0.667,As-Fe-Li-Ni,4,Supercon,Li1Fe0.98Ni0.02As1,MP-mp-21471,Li2Fe2As2,As-Fe-Li,As33.333Fe33.333Li33.333,P 4/n m m,tetragonal,3.790629,3.790629,6.107451,data/final/MP/cifs/As1Fe0.98Li1Ni0.02-MP-mp-21471-synth_doped.cif,data/source/MP/raw/cifs/mp-21471.cif,mp-21471,0.0,,2013-10-29 11:57:13,5.21140049061562,10.17188/1196927,"@misc{osti_1196927,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LiFeAs (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196927"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686578'}},0.0,4.20304559,520.0,-32.72438031,-5.454063385,"{'tags': ['Lithium iron arsenide', 'Iron lithium arsenide']}",-32.72438031,-5.454063385,-0.4413801444444445,"['xas', 'elasticity']",False,"[290700, 168206, 610480, 169175, 162250, 162056, 166457, 163870]",True,2021-05-12 10:56:16.728000,FM,6,18,mp-21471,,LiFeAs,"{'functional': 'PBE', 'labels': ['Li_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Li': 1.0, 'Fe': 1.0, 'As': 1.0}",GGA,mp-21471,"['mp-917215', 'mp-674647', 'mp-919059', 'mp-920059', 'mp-1071407', 'mp-21471', 'mp-1071451', 'mp-38403', 'mp-33848', 'mp-37001', 'mp-34336', 'mp-36599', 'mp-36822', 'mp-36276', 'mp-1439936', 'mp-1686578', 'mp-1784376', 'mp-1071444']",0.2682074,"{'Li': 2.0, 'Fe': 2.0, 'As': 2.0}",87.75715855248485,[],FM,True,129,1,"[-0.0, -0.0, 0.3, 0.3, -0.0, -0.0]",0.0061124905232567,0.2682074,2,0.5364148,MP,data/source/MP/cleaned/cifs/MP-mp-21471.cif,True,,data/final/MP/graphs/As1Fe0.98Li1Ni0.02-MP-mp-21471-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Rh2Th1,1,0.0,2.0,False,Rh4Th2,Rh4Th2,0.0,Other,True,Rh66.667Th33.333,Rh-Th,2,Supercon,Rh2Th1,MP-mp-568337,Th2Rh4,Rh-Th,Rh66.667Th33.333,P 63/m m c,hexagonal,4.752658002140499,4.75265838,5.962755,data/final/MP/cifs/Rh2Th1-MP-mp-568337.cif,data/source/MP/raw/cifs/mp-568337.cif,mp-568337,0.0,,2014-02-16 12:27:05,12.466735471512004,10.17188/1274374,"@misc{osti_1274374,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ThRh2 (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1274374"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672852'}},0.0,7.45321586,520.0,-49.21029996,-8.20171666,{'tags': ['Rhodium thorium (2/1) - HT']},-49.21029996,-8.20171666,-0.820891996666667,"['xas', 'elasticity', 'bandstructure']",True,[105948],True,2021-05-12 10:56:22.739000,NM,6,8,mp-568337,,ThRh2,"{'functional': 'PBE', 'labels': ['Th', 'Rh_pv'], 'pot_type': 'paw'}","{'Th': 1.0, 'Rh': 2.0}",GGA,mp-568337,"['mp-929512', 'mp-912807', 'mp-929122', 'mp-568337', 'mp-1300444', 'mp-1672852', 'mp-1786971', 'mp-1595900']",4.51e-05,"{'Th': 2.0, 'Rh': 4.0}",116.6408754024692,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0]",7.733138120642957e-07,4.51e-05,0,9.02e-05,MP,data/source/MP/cleaned/cifs/MP-mp-568337.cif,False,,data/final/MP/graphs/Rh2Th1-MP-mp-568337.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ge2Ni0.2Pd1.8Sr1,3,0.0799999999999999,1.0,True,Ge2Ni0.2Pd1.8Sr1,Ge2Pd2Sr1,3.15,Other,True,Ge40Ni4Pd36Sr20,Ge-Ni-Pd-Sr,4,Supercon,Sr1Pd1.8Ni0.2Ge2,MP-mp-978986,Sr1Ge2Pd2,Ge-Pd-Sr,Ge40Pd40Sr20,I 4/m m m,tetragonal,4.438671999438209,4.438671999438209,6.03054834,data/final/MP/cifs/Ge2Ni0.2Pd1.8Sr1-MP-mp-978986-synth_doped.cif,data/source/MP/raw/cifs/mp-978986.cif,mp-978986,0.0,,2015-10-09 03:56:43,7.295677176868866,10.17188/1316057,"@misc{osti_1316057,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr(GePd)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1316057"",
    place = ""United States"",
    year = ""2016"",
    month = ""9"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688092'}},0.0,4.0155429,520.0,-24.8627221,-4.97254442,"{'tags': ['Strontium palladium germanide (1/2/2)', 'Strontium palladium germanium (1/2/2)', 'High pressure experimental phase']}",-24.8627221,-4.97254442,-0.7134818633333324,"['xas', 'elasticity', 'bandstructure']",True,"[165985, 181157, 181155, 181156, 168133]",True,2021-05-12 10:56:37.246000,NM,5,9,mp-978986,,Sr(GePd)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ge_d', 'Pd'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Ge': 2.0, 'Pd': 2.0}",GGA,mp-978986,"['mp-1005776', 'mp-978986', 'mp-1005866', 'mp-979737', 'mp-1438850', 'mp-1688092', 'mp-1782349', 'mp-1011093', 'mp-1589601']",0.0012593,"{'Sr': 1.0, 'Ge': 2.0, 'Pd': 2.0}",101.45304755163892,[],NM,False,139,0,"[0, 0, 0, 0, 0]",1.2412638460752248e-05,0.0012593,0,0.0012593,MP,data/source/MP/cleaned/cifs/MP-mp-978986.cif,True,,data/final/MP/graphs/Ge2Ni0.2Pd1.8Sr1-MP-mp-978986-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ba2Ca0.12Cu4Y0.88O8,2,0.016,1.0,True,Ba2Ca0.12Cu4Y0.88O8,Ba2Cu4Y1O8,88.5,Cuprate,True,Ba13.333Ca0.8Cu26.667Y5.867O53.333333333333336,Ba-Ca-Cu-Y-O,5,Supercon,Y0.88Ca0.12Ba2Cu4O8,MP-mp-6790,Ba2Y1Cu4O8,Ba-Cu-Y-O,Ba13.333Cu26.667Y6.667O53.333333333333336,C m m m,orthorhombic,3.889922,3.899603999537882,13.88942687,data/final/MP/cifs/Ba2Ca0.12Cu4Y0.88O8-MP-mp-6790-synth_doped.cif,data/source/MP/raw/cifs/mp-6790.cif,mp-6790,0.0,,2011-05-16 03:21:24,5.936250568336678,10.17188/1283441,"@misc{osti_1283441,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Y(CuO2)4 (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1283441"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686864'}},0.0,3.31391536,520.0,-91.58381472,-6.105587648,"{'tags': ['Yttrium barium copper oxide (1/2/4/8)', 'High pressure experimental phase']}",-91.58381472,-6.105587648,-2.0529924817777783,"['xas', 'bandstructure']",True,"[72261, 85273, 74251, 400273, 85277, 85275, 400280, 67632, 85272, 67631, 83920, 66613, 85279, 400277, 75689, 74259, 85278, 85280, 66603, 94265, 400276, 88873, 71417, 75712, 97052, 66605, 72258, 85281, 85274, 400279, 66604, 69698]",True,2021-05-12 10:57:34.594000,NM,15,10,mp-6790,oxide,Ba2Y(CuO2)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-6790,"['mp-1000664', 'mp-6790', 'mp-1007136', 'mp-1237713', 'mp-1440937', 'mp-1686864', 'mp-1834179', 'mp-1011883', 'mp-1590064', 'mp-1590433']",0.0004643,"{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",208.60454115924333,[],NM,False,65,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.225742533790601e-06,0.0004643,0,0.0004643,MP,data/source/MP/cleaned/cifs/MP-mp-6790.cif,True,,data/final/MP/graphs/Ba2Ca0.12Cu4Y0.88O8-MP-mp-6790-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
C1In1La3,1,0.0,1.0,True,C1In1La3,C1In1La3,0.0,Other,True,C20In20La60,C-In-La,3,Supercon,La3In1C1,MP-mp-29056,La3In1C1,C-In-La,C20In20La60,P m -3 m,cubic,5.250051,5.250051,5.250051,data/final/MP/cifs/C1In1La3-MP-mp-29056.cif,data/source/MP/raw/cifs/mp-29056.cif,mp-29056,0.0,,2014-02-24 04:05:16,6.237263959758519,10.17188/1203130,"@misc{osti_1203130,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La3InC (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1203130"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678460'}},0.0,7.29935102,520.0,-28.38873353,-5.677746706,{'tags': ['Lanthanum indium carbide (3/1/1)']},-28.38873353,-5.677746706,-0.3204495569999999,"['xas', 'elasticity', 'bandstructure']",True,[80956],True,2021-05-12 10:56:18.721000,NM,5,8,mp-29056,,La3InC,"{'functional': 'PBE', 'labels': ['La', 'In_d', 'C'], 'pot_type': 'paw'}","{'La': 3.0, 'In': 1.0, 'C': 1.0}",GGA,mp-29056,"['mp-924564', 'mp-909025', 'mp-923931', 'mp-29056', 'mp-1348757', 'mp-1678460', 'mp-1779570', 'mp-1588197']",0.0018695,"{'La': 3.0, 'In': 1.0, 'C': 1.0}",144.7073421034659,[],NM,False,221,0,"[0, 0, 0, 0, 0]",1.2919178618202426e-05,0.0018695,0,0.0018695,MP,data/source/MP/cleaned/cifs/MP-mp-29056.cif,False,,data/final/MP/graphs/C1In1La3-MP-mp-29056.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba0.557Bi1K0.443O3,2,0.0438666666666666,3.0,False,Ba1.671Bi3K1.329O9,Ba2Bi3K1O9,25.0,Oxide,True,Ba11.14Bi20K8.86O60,Ba-Bi-K-O,4,Supercon,Ba0.557K0.443Bi1O3,MP-mp-1223518,K1Ba2Bi3O9,Ba-Bi-K-O,Ba13.333Bi20K6.667O60,P -3 m 1,trigonal,6.18756400330999,6.187564340000001,7.581401,data/final/MP/cifs/Ba0.557Bi1K0.443O3-MP-mp-1223518-synth_doped.cif,data/source/MP/raw/cifs/mp-1223518.cif,mp-1223518,0.0,,2019-01-12 23:54:06.965000,7.16530091201999,,,{'GGA': {'task_id': 'mp-1729135'}},0.001551682833333,3.46143017,520.0,-85.22271396,-5.681514264,{'tags': []},-85.22271396,-5.681514264,-2.0170414252000004,[],False,[],True,2021-05-12 11:00:52.054000,NM,15,4,mp-1223518,oxide,KBa2(BiO3)3,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Bi', 'O'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 2.0, 'Bi': 3.0, 'O': 9.0}",GGA,mp-1223518,"['mp-1223518', 'mp-1391182', 'mp-1729135', 'mp-1775199']",4.99e-05,"{'K': 1.0, 'Ba': 2.0, 'Bi': 3.0, 'O': 9.0}",251.37352739849624,[],NM,False,164,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.9850936777799505e-07,4.99e-05,0,4.99e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1223518.cif,True,,data/final/MP/graphs/Ba0.557Bi1K0.443O3-MP-mp-1223518-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Cu2Fe1Sr2Y1O7.68,2,0.0458839406207827,1.8229833333333327,False,Cu3.646Fe1.823Sr3.646Y1.823O14,Cu4Fe2Sr4Y2O14,53.0,Cuprate,True,Cu14.62Fe7.31Sr14.62Y7.31O56.14035087719298,Cu-Fe-Sr-Y-O,5,Supercon,Fe1Sr2Y1Cu2O7.68,MP-mvc-771,Sr4Y2Fe2Cu4O14,Cu-Fe-Sr-Y-O,Cu15.385Fe7.692Sr15.385Y7.692O53.84615384615385,I m a 2,orthorhombic,5.428009999807786,5.524618000554629,12.28734132,data/final/MP/cifs/Cu2Fe1Sr2Y1O7.68-MP-mvc-771-synth_doped.cif,data/source/MP/raw/cifs/mvc-771.cif,mvc-771,0.0,,2017-12-02 01:24:31,5.309669206142082,10.17188/1322699,"@misc{osti_1322699,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr2YFeCu2O7 (SG:46) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1322699"",
    place = ""United States"",
    year = ""2014"",
    month = ""9"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-1680490'}},0.0199638557692258,3.37539656,520.0,-169.36345348,-6.51397898,{'tags': []},-169.36345348,-6.51397898,-2.353624607307692,"['xas', 'bandstructure']",True,[],True,2021-05-12 10:58:07.127000,FM,26,8,mvc-771,oxide,Sr2YFeCu2O7,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Y_sv', 'Fe_pv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Y': 1.0, 'Fe': 1.0, 'Cu': 2.0, 'O': 7.0}",GGA+U,mvc-771,"['mvc-771', 'mp-1042547', 'mp-1042574', 'mp-1345426', 'mp-1655657', 'mp-1680490', 'mp-1836639', 'mp-1042570']",4.95893815,"{'Sr': 4.0, 'Y': 2.0, 'Fe': 2.0, 'Cu': 4.0, 'O': 14.0}",349.6910649548837,[],FM,True,5,5,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 4.2, 4.2, -0.0, -0.0, 0.0, 0.0, 0.2, 0.2, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0283618236035844,4.95893815,4,9.9178763,MP,data/source/MP/cleaned/cifs/MP-mvc-771.cif,True,,data/final/MP/graphs/Cu2Fe1Sr2Y1O7.68-MP-mvc-771-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,0,1,0,1.0,False
Gd0.06In1La2.94,2,0.03,1.0,True,Gd0.06In1La2.94,In1La3,4.1,Other,True,Gd1.5In25La73.5,Gd-In-La,3,Supercon,Gd0.06In1La2.94,MP-mp-20909,La3In1,In-La,In25La75,P m -3 m,cubic,5.076766,5.076766,5.076766,data/final/MP/cifs/Gd0.06In1La2.94-MP-mp-20909-synth_doped.cif,data/source/MP/raw/cifs/mp-20909.cif,mp-20909,0.0,,2014-02-21 06:52:52,6.7455760598452565,10.17188/1196104,"@misc{osti_1196104,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La3In (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196104"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671685'}},0.0,8.16935076,520.0,-18.73796121,-4.6844903025,"{'tags': ['Indium lanthanum (1/3)', 'Lanthanum indium (3/1)']}",-18.73796121,-4.6844903025,-0.2945640412500001,"['xas', 'bandstructure']",True,"[639844, 51950, 639851, 639840, 603208, 107019]",True,2021-05-12 10:56:57.051000,NM,4,8,mp-20909,,La3In,"{'functional': 'PBE', 'labels': ['La', 'In_d'], 'pot_type': 'paw'}","{'La': 3.0, 'In': 1.0}",GGA,mp-20909,"['mp-906743', 'mp-921394', 'mp-920373', 'mp-20909', 'mp-1476042', 'mp-1671685', 'mp-1778647', 'mp-1590323']",0.0489742,"{'La': 3.0, 'In': 1.0}",130.84629766481785,[],NM,False,221,0,"[0, 0, 0, 0]",0.0003742880071811,0.0489742,0,0.0489742,MP,data/source/MP/cleaned/cifs/MP-mp-20909.cif,True,,data/final/MP/graphs/Gd0.06In1La2.94-MP-mp-20909-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
As1Nb3,1,0.0,8.0,False,As8Nb24,As8Nb24,2.353333333,Other,True,As25Nb75,As-Nb,2,Supercon,As1Nb3,MP-mp-504425,Nb24As8,As-Nb,As25Nb75,P 42/n,tetragonal,5.24186,10.375627,10.375627,data/final/MP/cifs/As1Nb3-MP-mp-504425.cif,data/source/MP/raw/cifs/mp-504425.cif,mp-504425,0.0,,2014-02-26 00:47:00,8.325057777430253,10.17188/1261738,"@misc{osti_1261738,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3As (SG:86) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1261738"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1744595'}},0.0,6.09918266,520.0,-293.13685932,-9.16052685375,{'tags': ['Niobium arsenide (3/1)']},-293.13685932,-9.16052685375,-0.4197684724999995,"['xas', 'bandstructure']",True,"[1998, 610989]",True,2021-05-12 10:57:08.928000,NM,32,11,mp-504425,,Nb3As,"{'functional': 'PBE', 'labels': ['Nb_pv', 'As'], 'pot_type': 'paw'}","{'Nb': 3.0, 'As': 1.0}",GGA,mp-504425,"['mp-932308', 'mp-931330', 'mp-915701', 'mp-504425', 'mp-1182057', 'mp-1204816', 'mp-1237885', 'mp-1395435', 'mp-1744595', 'mp-1883455', 'mp-1620849']",0.000286475,"{'Nb': 24.0, 'As': 8.0}",564.3052865322921,[],NM,False,86,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.061276856155862e-06,0.000286475,0,0.0022918,MP,data/source/MP/cleaned/cifs/MP-mp-504425.cif,False,,data/final/MP/graphs/As1Nb3-MP-mp-504425.json,0,True,4/m,0,0,0,0,3,0,0,1,0,0,0,1.0,False
Al1C1Cr2,1,0.0,2.0,False,Al2C2Cr4,Al2C2Cr4,0.0,Other,True,Al25C25Cr50,Al-C-Cr,3,Supercon,Al1C1Cr2,MP-mp-9956,Al2Cr4C2,Al-C-Cr,Al25C25Cr50,P 63/m m c,hexagonal,2.843003998846711,2.8430042700000007,12.707956,data/final/MP/cifs/Al1C1Cr2-MP-mp-9956.cif,data/source/MP/raw/cifs/mp-9956.cif,mp-9956,0.0,,2011-05-28 11:14:42,5.338343764116955,10.17188/1317056,"@misc{osti_1317056,
    author = ""Persson, Kristin"",
    title = ""Materials Data on AlCr2C (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1317056"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672919'}},0.0,7.92382914,520.0,-65.94314,-8.2428925,"{'tags': ['Chromium aluminium carbide (2/1/1)', 'Chromium aluminum carbide (2/1/1)']}",-65.94314,-8.2428925,-0.1732796324999999,"['xas', 'elasticity', 'bandstructure']",True,"[42918, 606181]",True,2021-05-12 10:56:37.246000,NM,8,9,mp-9956,,AlCr2C,"{'functional': 'PBE', 'labels': ['Al', 'Cr_pv', 'C'], 'pot_type': 'paw'}","{'Al': 1.0, 'Cr': 2.0, 'C': 1.0}",GGA,mp-9956,"['mp-924891', 'mp-909876', 'mp-925864', 'mp-9956', 'mp-1265377', 'mp-1300420', 'mp-1672919', 'mp-1928169', 'mp-1592826']",0.01895175,"{'Al': 2.0, 'Cr': 4.0, 'C': 2.0}",88.95314977919703,[],NM,False,194,0,"[0.0, 0.0, -0.0, -0.0, -0.0, -0.0, 0.0, 0.0]",0.000426106327815,0.01895175,0,0.0379035,MP,data/source/MP/cleaned/cifs/MP-mp-9956.cif,False,,data/final/MP/graphs/Al1C1Cr2-MP-mp-9956.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ce1Co0.2Ir0.8Si3,3,0.0799999999999999,1.0,True,Ce1Co0.2Ir0.8Si3,Ce1Ir1Si3,0.62,Heavy_fermion,True,Ce20Co4Ir16Si60,Ce-Co-Ir-Si,4,Supercon,Ce1Ir0.8Co0.2Si3,MP-mp-1068906,Ce1Si3Ir1,Ce-Ir-Si,Ce20Ir20Si60,I 4 m m,tetragonal,4.234129999702719,4.234129999702719,5.74890503,data/final/MP/cifs/Ce1Co0.2Ir0.8Si3-MP-mp-1068906-synth_doped.cif,data/source/MP/raw/cifs/mp-1068906.cif,mp-1068906,0.0,,2018-03-21 23:52:58,7.8622504627962035,,,{'GGA': {'task_id': 'mp-1697688'}},0.0,9.26380379,520.0,-35.24129872,-7.048259744000001,"{'tags': ['BaNiSn3', 'Cerium iridium silicide (1/1/3)', 'CeIrSi3']}",-35.24129872,-7.048259744000001,-0.8387674170000011,['bandstructure'],True,[621428],True,2021-05-12 10:58:14.654000,FM,5,8,mp-1068906,,CeSi3Ir,"{'functional': 'PBE', 'labels': ['Ce', 'Si', 'Ir'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Si': 3.0, 'Ir': 1.0}",GGA,mp-1068906,"['mp-1069059', 'mp-1068906', 'mp-1068980', 'mp-1436934', 'mp-1697688', 'mp-1798320', 'mp-1590007', 'mp-1069036']",0.3841196,"{'Ce': 1.0, 'Si': 3.0, 'Ir': 1.0}",87.9853857058804,[],FM,True,107,1,"[0.3, 0.0, 0.0, 0.0, 0.0]",0.0043657204763987,0.3841196,1,0.3841196,MP,data/source/MP/cleaned/cifs/MP-mp-1068906.cif,True,,data/final/MP/graphs/Ce1Co0.2Ir0.8Si3-MP-mp-1068906-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,0,0,1,0,1.0,False
Ge2Rh5,3,0.0952380952380952,1.6,False,Ge3.2Rh8,Ge4Rh8,2.12,Other,True,Ge28.571Rh71.429,Ge-Rh,2,Supercon,Ge2Rh5,MP-mp-22585,Ge4Rh8,Ge-Rh,Ge33.333Rh66.667,P n m a,orthorhombic,4.062544,5.532183,7.67231,data/final/MP/cifs/Ge2Rh5-MP-mp-22585-synth_doped.cif,data/source/MP/raw/cifs/mp-22585.cif,mp-22585,0.0,,2014-02-23 03:04:08,10.725983215375456,10.17188/1198804,"@misc{osti_1198804,
    author = ""Persson, Kristin"",
    title = ""Materials Data on GeRh2 (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198804"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704216'}},0.0,6.51814066,520.0,-82.90329563,-6.908607969166667,"{'tags': ['Rhodium germanide (2/1)', 'Germanium rhodium (1/2)']}",-82.90329563,-6.908607969166667,-0.4580601041666672,"['xas', 'elasticity', 'bandstructure']",True,"[44860, 637674]",True,2021-05-12 10:56:16.728000,NM,12,8,mp-22585,,GeRh2,"{'functional': 'PBE', 'labels': ['Ge_d', 'Rh_pv'], 'pot_type': 'paw'}","{'Ge': 1.0, 'Rh': 2.0}",GGA,mp-22585,"['mp-910405', 'mp-926790', 'mp-926240', 'mp-22585', 'mp-1418906', 'mp-1704216', 'mp-1780930', 'mp-1600134']",0.01005555,"{'Ge': 4.0, 'Rh': 8.0}",172.43314830887556,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0002332625738987,0.01005555,0,0.0402222,MP,data/source/MP/cleaned/cifs/MP-mp-22585.cif,True,,data/final/MP/graphs/Ge2Rh5-MP-mp-22585-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ba0.95Rb0.05Sb2Ti2O1,2,0.0166666666666666,1.0,True,Ba0.95Rb0.05Sb2Ti2O1,Ba1Sb2Ti2O1,4.25,Oxide,True,Ba15.833Rb0.833Sb33.333Ti33.333O16.666666666666668,Ba-Rb-Sb-Ti-O,5,Supercon,Ba0.95Rb0.05Ti2Sb2O1,MP-mp-1070806,Ba1Ti2Sb2O1,Ba-Sb-Ti-O,Ba16.667Sb33.333Ti33.333O16.666666666666668,P 4/m m m,tetragonal,4.113474,4.113474,8.312382,data/final/MP/cifs/Ba0.95Rb0.05Sb2Ti2O1-MP-mp-1070806-synth_doped.cif,data/source/MP/raw/cifs/mp-1070806.cif,mp-1070806,0.0,,2018-03-22 04:02:04,5.8154485533321445,,,{'GGA': {'task_id': 'mp-1702174'}},0.0,5.89751533,520.0,-39.14932631,-6.524887718333333,{'tags': []},-39.14932631,-6.524887718333333,-1.5507346602777776,['bandstructure'],True,"[430061, 237789, 430060]",True,2021-05-12 10:58:14.654000,NM,6,16,mp-1070806,oxide,BaTi2Sb2O,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ti_pv', 'Sb', 'O'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Ti': 2.0, 'Sb': 2.0, 'O': 1.0}",GGA,mp-1070806,"['mp-1071055', 'mp-1071068', 'mp-1071083', 'mp-1071088', 'mp-1070806', 'mp-1071124', 'mp-1070846', 'mp-1070900', 'mp-1071137', 'mp-1423542', 'mp-1702174', 'mp-1785425', 'mp-1588663', 'mp-1070899', 'mp-1071129', 'mp-1071119']",0.001055,"{'Ba': 1.0, 'Ti': 2.0, 'Sb': 2.0, 'O': 1.0}",140.65105900950408,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0]",7.500832254158225e-06,0.001055,0,0.001055,MP,data/source/MP/cleaned/cifs/MP-mp-1070806.cif,True,,data/final/MP/graphs/Ba0.95Rb0.05Sb2Ti2O1-MP-mp-1070806-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ba2Cu3Eu0.6Pr0.4O7,2,0.0153846153846153,2.0,False,Ba4Cu6Eu1.2Pr0.8O14,Ba4Cu6Eu1Pr1O14,37.8,Cuprate,True,Ba15.385Cu23.077Eu4.615Pr3.077O53.84615384615385,Ba-Cu-Eu-Pr-O,5,Supercon,Eu0.6Pr0.4Ba2Cu3O7,MP-mp-1228601,Ba4Pr1Eu1Cu6O14,Ba-Cu-Eu-Pr-O,Ba15.385Cu23.077Eu3.846Pr3.846O53.84615384615385,C m m m,orthorhombic,3.879178,7.885327998393908,12.58992067,data/final/MP/cifs/Ba2Cu3Eu0.6Pr0.4O7-MP-mp-1228601-synth_doped.cif,data/source/MP/raw/cifs/mp-1228601.cif,mp-1228601,0.0,,2019-01-13 04:17:40.184000,6.571777011913311,,,,0.0156188576201969,3.16956422,520.0,-161.67470258,-6.218257791538462,{'tags': []},-161.67470258,-6.218257791538462,-2.1029685596153844,[],False,[],True,2021-05-12 11:00:59.151000,FM,26,3,mp-1228601,oxide,Ba4PrEu(Cu3O7)2,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Pr_3', 'Eu', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 4.0, 'Pr': 1.0, 'Eu': 1.0, 'Cu': 6.0, 'O': 14.0}",GGA,mp-1228601,"['mp-1228601', 'mp-1347083', 'mp-1836684']",6.3399007,"{'Ba': 4.0, 'Pr': 1.0, 'Eu': 1.0, 'Cu': 6.0, 'O': 14.0}",365.73710597766734,[],FM,True,65,1,"[0.0, 0.0, 0.0, 0.0, 0.0, 6.3, -0.0, -0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0173345843131025,6.3399007,1,6.3399007,MP,data/source/MP/cleaned/cifs/MP-mp-1228601.cif,True,,data/final/MP/graphs/Ba2Cu3Eu0.6Pr0.4O7-MP-mp-1228601-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Mo0.45Tc0.55,3,0.1,2.0,False,Mo0.9Tc1.1,Mo1Tc1,14.0,Other,True,Mo45Tc55,Mo-Tc,2,Supercon,Mo0.45Tc0.55,MP-mp-1217398,Tc1Mo1,Mo-Tc,Mo50Tc50,C m m m,orthorhombic,2.72374391,2.72374391,4.422491,data/final/MP/cifs/Mo0.45Tc0.55-MP-mp-1217398-synth_doped.cif,data/source/MP/raw/cifs/mp-1217398.cif,mp-1217398,0.0,,2019-01-12 18:44:28.463000,10.491452558143276,,,{'GGA': {'task_id': 'mp-1675682'}},0.1079645950000003,8.63782404,520.0,-20.99033375,-10.495166875,{'tags': []},-20.99033375,-10.495166875,0.1079645950000003,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,2,5,mp-1217398,,TcMo,"{'functional': 'PBE', 'labels': ['Tc_pv', 'Mo_pv'], 'pot_type': 'paw'}","{'Tc': 1.0, 'Mo': 1.0}",GGA,mp-1217398,"['mp-1217398', 'mp-1504881', 'mp-1675682', 'mp-1790659', 'mp-1611142']",0.0013419,"{'Tc': 1.0, 'Mo': 1.0}",30.69593507587645,[],NM,False,65,0,"[0, 0]",4.37158860508075e-05,0.0013419,0,0.0013419,MP,data/source/MP/cleaned/cifs/MP-mp-1217398.cif,True,,data/final/MP/graphs/Mo0.45Tc0.55-MP-mp-1217398-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
As2Co0.268Fe1.732Sr1,3,0.1072,1.0,True,As2Co0.268Fe1.732Sr1,As2Fe2Sr1,11.0,Ferrite,True,As40Co5.36Fe34.64Sr20,As-Co-Fe-Sr,4,Supercon,Sr1Fe1.732Co0.268As2,MP-mp-4488,Sr1Fe2As2,As-Fe-Sr,As40Fe40Sr20,I 4/m m m,tetragonal,3.9729799997357778,3.9729799997357778,6.45523327,data/final/MP/cifs/As2Co0.268Fe1.732Sr1-MP-mp-4488-synth_doped.cif,data/source/MP/raw/cifs/mp-4488.cif,mp-4488,0.0,,2011-05-13 03:37:13,6.319998834487784,10.17188/1208187,"@misc{osti_1208187,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr(FeAs)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208187"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672865'}},0.0,5.13397273,520.0,-30.61898897,-6.123797794,"{'tags': ['Strontium diiron arsenide - HT', 'Strontium diiron arsenide', 'Strontium diiron diarsenide', 'Iron strontium arsenide (2/1/2)', 'Strontium diiron arsenide - LT']}",-30.61898897,-6.123797794,-0.5342483613333335,"['xas', 'elasticity', 'bandstructure']",True,"[182330, 181993, 610527, 163209, 163208, 163869]",True,2021-05-12 10:56:20.740000,NM,5,8,mp-4488,,Sr(FeAs)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Fe': 2.0, 'As': 2.0}",GGA,mp-4488,"['mp-906356', 'mp-920135', 'mp-919110', 'mp-4488', 'mp-1439153', 'mp-1672865', 'mp-1873948', 'mp-1592272']",0.0029206,"{'Sr': 1.0, 'Fe': 2.0, 'As': 2.0}",91.7377588211838,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",3.183640016422098e-05,0.0029206,0,0.0029206,MP,data/source/MP/cleaned/cifs/MP-mp-4488.cif,True,,data/final/MP/graphs/As2Co0.268Fe1.732Sr1-MP-mp-4488-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B4Er0.8Gd0.2Rh4,3,0.0444444444444444,2.0,False,B8Er1.6Gd0.4Rh8,B8Er2Rh8,4.41,Other,True,B44.444Er8.889Gd2.222Rh44.444,B-Er-Gd-Rh,4,Supercon,Er0.8Gd0.2Rh4B4,MP-mp-8408,Er2B8Rh8,B-Er-Rh,B44.444Er11.111Rh44.444,P 42/n m c,tetragonal,5.336304,5.336304,7.44528,data/final/MP/cifs/B4Er0.8Gd0.2Rh4-MP-mp-8408-synth_doped.cif,data/source/MP/raw/cifs/mp-8408.cif,mp-8408,0.0,,2011-06-07 02:27:50,9.745285939793032,10.17188/1308086,"@misc{osti_1308086,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Er(BRh)4 (SG:137) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1308086"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1673724'}},0.0133402750000009,6.84272912,520.0,-131.92031901,-7.328906611666666,{'tags': ['Erbium rhodium boride (1/4/4)']},-131.92031901,-7.328906611666666,-0.5797380146296286,"['xas', 'bandstructure']",True,"[613809, 601530, 49631]",True,2021-05-12 10:57:51.871000,NM,18,8,mp-8408,,Er(BRh)4,"{'functional': 'PBE', 'labels': ['Er_3', 'B', 'Rh_pv'], 'pot_type': 'paw'}","{'Er': 1.0, 'B': 4.0, 'Rh': 4.0}",GGA,mp-8408,"['mp-932384', 'mp-931412', 'mp-8408', 'mp-915879', 'mp-1434188', 'mp-1673724', 'mp-1785064', 'mp-1597242']",7.985e-05,"{'Er': 2.0, 'B': 8.0, 'Rh': 8.0}",212.01283845150363,[],NM,False,137,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",7.532562705467018e-07,7.985e-05,0,0.0001597,MP,data/source/MP/cleaned/cifs/MP-mp-8408.cif,True,,data/final/MP/graphs/B4Er0.8Gd0.2Rh4-MP-mp-8408-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Hf0.78W0.22,2,0.04,10.0,False,Hf7.8W2.2,Hf8W2,2.77,Other,True,Hf78W22,Hf-W,2,Supercon,Hf0.78W0.22,MP-mp-1212292,Hf8W2,Hf-W,Hf80W20,F d -3 m,cubic,7.04020543,7.040205429999999,7.040205429999999,data/final/MP/cifs/Hf0.78W0.22-MP-mp-1212292-synth_doped.cif,data/source/MP/raw/cifs/mp-1212292.cif,mp-1212292,0.0,,2019-01-12 14:30:23.904000,12.084194216893009,,,,1.2247772025000003,3.95269774,520.0,-93.8430902,-9.38430902,"{'tags': ['MgCu2', 'HfW2 rt', 'Friauf-Laves phase, Frank-Kasper phase']}",-93.8430902,-9.38430902,1.1730673539999998,[],False,[],True,2021-05-12 11:00:28.874000,NM,10,2,mp-1212292,,Hf4W,"{'functional': 'PBE', 'labels': ['Hf_pv', 'W_pv'], 'pot_type': 'paw'}","{'Hf': 4.0, 'W': 1.0}",GGA,mp-1212292,"['mp-1212292', 'mp-1932605']",0.09431145,"{'Hf': 8.0, 'W': 2.0}",246.7408165137536,[],NM,False,227,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0007644576307442,0.09431145,0,0.1886229,MP,data/source/MP/cleaned/cifs/MP-mp-1212292.cif,True,,data/final/MP/graphs/Hf0.78W0.22-MP-mp-1212292-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
As1Fe1Na0.86,3,0.0652680652680653,2.0,False,As2Fe2Na1.72,As2Fe2Na2,26.0,Ferrite,True,As34.965Fe34.965Na30.07,As-Fe-Na,3,Supercon,Na0.86Fe1As1,MP-mp-22152,Na2Fe2As2,As-Fe-Na,As33.333Fe33.333Na33.333,P 4/n m m,tetragonal,3.923688,3.923688,6.918844,data/final/MP/cifs/As1Fe1Na0.86-MP-mp-22152-synth_doped.cif,data/source/MP/raw/cifs/mp-22152.cif,mp-22152,0.0,,2014-02-21 10:51:39,4.793908463406792,10.17188/1197381,"@misc{osti_1197381,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NaFeAs (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197381"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704688'}},0.0,4.10723066,520.0,-30.57538864,-5.095898106666667,{'tags': ['Sodium iron arsenide']},-30.57538864,-5.095898106666667,-0.2786807238505749,"['xas', 'elasticity', 'bandstructure']",True,"[163144, 163143]",True,2021-05-12 10:56:16.728000,FM,6,8,mp-22152,,NaFeAs,"{'functional': 'PBE', 'labels': ['Na_pv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Na': 1.0, 'Fe': 1.0, 'As': 1.0}",GGA,mp-22152,"['mp-906352', 'mp-920130', 'mp-919102', 'mp-22152', 'mp-1413190', 'mp-1704688', 'mp-1797758', 'mp-1594769']",0.0693226,"{'Na': 2.0, 'Fe': 2.0, 'As': 2.0}",106.5178694490858,[],FM,True,129,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.0]",0.0013016144682303,0.0693226,2,0.1386452,MP,data/source/MP/cleaned/cifs/MP-mp-22152.cif,True,,data/final/MP/graphs/As1Fe1Na0.86-MP-mp-22152-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
As1Cu0.02Fe0.98Li1,2,0.0133333333333333,2.0,False,As2Cu0.04Fe1.96Li2,As2Fe2Li2,9.3,Ferrite,True,As33.333Cu0.667Fe32.667Li33.333,As-Cu-Fe-Li,4,Supercon,Li1Fe0.98Cu0.02As1,MP-mp-21471,Li2Fe2As2,As-Fe-Li,As33.333Fe33.333Li33.333,P 4/n m m,tetragonal,3.790629,3.790629,6.107451,data/final/MP/cifs/As1Cu0.02Fe0.98Li1-MP-mp-21471-synth_doped.cif,data/source/MP/raw/cifs/mp-21471.cif,mp-21471,0.0,,2013-10-29 11:57:13,5.21140049061562,10.17188/1196927,"@misc{osti_1196927,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LiFeAs (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196927"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686578'}},0.0,4.20304559,520.0,-32.72438031,-5.454063385,"{'tags': ['Lithium iron arsenide', 'Iron lithium arsenide']}",-32.72438031,-5.454063385,-0.4413801444444445,"['xas', 'elasticity']",False,"[290700, 168206, 610480, 169175, 162250, 162056, 166457, 163870]",True,2021-05-12 10:56:16.728000,FM,6,18,mp-21471,,LiFeAs,"{'functional': 'PBE', 'labels': ['Li_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Li': 1.0, 'Fe': 1.0, 'As': 1.0}",GGA,mp-21471,"['mp-917215', 'mp-674647', 'mp-919059', 'mp-920059', 'mp-1071407', 'mp-21471', 'mp-1071451', 'mp-38403', 'mp-33848', 'mp-37001', 'mp-34336', 'mp-36599', 'mp-36822', 'mp-36276', 'mp-1439936', 'mp-1686578', 'mp-1784376', 'mp-1071444']",0.2682074,"{'Li': 2.0, 'Fe': 2.0, 'As': 2.0}",87.75715855248485,[],FM,True,129,1,"[-0.0, -0.0, 0.3, 0.3, -0.0, -0.0]",0.0061124905232567,0.2682074,2,0.5364148,MP,data/source/MP/cleaned/cifs/MP-mp-21471.cif,True,,data/final/MP/graphs/As1Cu0.02Fe0.98Li1-MP-mp-21471-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ba1Ge3,1,0.0,2.0,False,Ba2Ge6,Ba2Ge6,4.0,Other,True,Ba25Ge75,Ba-Ge,2,Supercon,Ba1Ge3,MP-mp-1078234,Ba2Ge6,Ba-Ge,Ba25Ge75,P 63/m m c,hexagonal,5.261891,6.856724001779238,6.85672472,data/final/MP/cifs/Ba1Ge3-MP-mp-1078234.cif,data/source/MP/raw/cifs/mp-1078234.cif,mp-1078234,0.0,,2018-04-11 01:13:55,5.506854927998177,,,{'GGA': {'task_id': 'mp-1695460'}},0.038019482187499,3.11124297,520.0,-34.45350014,-4.3066875175,"{'tags': ['Barium germanide (1/3)', 'Barium trigermanide - hP8']}",-34.45350014,-4.3066875175,-0.3596739187500004,['bandstructure'],True,"[239562, 261651]",True,2021-05-12 10:58:14.654000,NM,8,6,mp-1078234,,BaGe3,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ge_d'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Ge': 3.0}",GGA,mp-1078234,"['mp-1078234', 'mp-1080822', 'mp-1415331', 'mp-1695460', 'mp-1834108', 'mp-1602597']",0.0004604,"{'Ba': 2.0, 'Ge': 6.0}",214.2426228783507,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",4.297930951502775e-06,0.0004604,0,0.0009208,MP,data/source/MP/cleaned/cifs/MP-mp-1078234.cif,False,,data/final/MP/graphs/Ba1Ge3-MP-mp-1078234.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
La1P1,1,0.0,1.0,True,La1P1,La1P1,0.0,Other,True,La50P50,La-P,2,Supercon,La1P1,MP-mp-2384,La1P1,La-P,La50P50,F m -3 m,cubic,4.27863808,4.27863808,4.27863808,data/final/MP/cifs/La1P1-MP-mp-2384.cif,data/source/MP/raw/cifs/mp-2384.cif,mp-2384,0.0,,2011-05-12 17:49:31,5.093164792301468,10.17188/1199756,"@misc{osti_1199756,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaP (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199756"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686398'}},0.0,6.38853903,520.0,-13.48584123,-6.742920615,"{'tags': ['Lanthanum phosphide', 'Lanthanum phosphide - B1']}",-13.48584123,-6.742920615,-1.5682658091666672,"['xas', 'elasticity', 'bandstructure']",True,"[163360, 52005, 44693, 641626]",True,2021-05-12 10:56:16.728000,NM,2,8,mp-2384,,LaP,"{'functional': 'PBE', 'labels': ['La', 'P'], 'pot_type': 'paw'}","{'La': 1.0, 'P': 1.0}",GGA,mp-2384,"['mp-906370', 'mp-919116', 'mp-920145', 'mp-2384', 'mp-1439948', 'mp-1686398', 'mp-1793426', 'mp-1591231']",5.9e-06,"{'La': 1.0, 'P': 1.0}",55.38621129369255,[],NM,False,225,0,"[0, 0]",1.0652470826564553e-07,5.9e-06,0,5.9e-06,MP,data/source/MP/cleaned/cifs/MP-mp-2384.cif,False,,data/final/MP/graphs/La1P1-MP-mp-2384.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ir0.9Nb3Rh0.1,2,0.0499999999999999,2.0,False,Ir1.8Nb6Rh0.2,Ir2Nb6,0.0,Other,True,Ir22.5Nb75Rh2.5,Ir-Nb-Rh,3,Supercon,Nb3Rh0.1Ir0.9,MP-mp-1458,Nb6Ir2,Ir-Nb,Ir25Nb75,P m -3 n,cubic,5.183769,5.183769,5.183769,data/final/MP/cifs/Ir0.9Nb3Rh0.1-MP-mp-1458-synth_doped.cif,data/source/MP/raw/cifs/mp-1458.cif,mp-1458,0.0,,2011-05-14 00:52:36,11.228046236687836,10.17188/1190735,"@misc{osti_1190735,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Ir (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1190735"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698594'}},0.0,6.13208274,520.0,-81.50600203,-10.18825025375,{'tags': ['Iridium niobium (1/3)']},-81.50600203,-10.18825025375,-0.4026638687500004,"['xas', 'elasticity', 'bandstructure']",True,"[640840, 640833, 104512, 640832]",True,2021-05-12 10:56:12.755000,NM,8,8,mp-1458,,Nb3Ir,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Ir'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Ir': 1.0}",GGA,mp-1458,"['mp-929024', 'mp-912590', 'mp-929391', 'mp-1458', 'mp-1426323', 'mp-1698594', 'mp-1784808', 'mp-1591057']",0.00018035,"{'Nb': 6.0, 'Ir': 2.0}",139.29544675164993,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",2.5894600894104784e-06,0.00018035,0,0.0003607,MP,data/source/MP/cleaned/cifs/MP-mp-1458.cif,True,,data/final/MP/graphs/Ir0.9Nb3Rh0.1-MP-mp-1458-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ir0.97Pd0.03Te2,2,0.02,4.0,False,Ir3.88Pd0.12Te8,Ir4Te8,2.7,Other,True,Ir32.333Pd1Te66.667,Ir-Pd-Te,3,Supercon,Pd0.03Ir0.97Te2,MP-mp-569322,Te8Ir4,Ir-Te,Ir33.333Te66.667,P n m a,orthorhombic,4.049805,5.441863,13.587474,data/final/MP/cifs/Ir0.97Pd0.03Te2-MP-mp-569322-synth_doped.cif,data/source/MP/raw/cifs/mp-569322.cif,mp-569322,0.0,,2014-02-16 04:48:25,9.924328423353325,10.17188/1275037,"@misc{osti_1275037,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Te2Ir (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1275037"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1746248'}},0.0123894575000003,7.60847828,520.0,-63.94410921,-5.3286757675,{'tags': ['Iridium telluride (1/2)']},-63.94410921,-5.3286757675,-0.5683316741666667,"['xas', 'bandstructure']",True,[93894],True,2021-05-12 10:57:24.969000,NM,12,7,mp-569322,,Te2Ir,"{'functional': 'PBE', 'labels': ['Te', 'Ir'], 'pot_type': 'paw'}","{'Te': 2.0, 'Ir': 1.0}",GGA,mp-569322,"['mp-927873', 'mp-927408', 'mp-569322', 'mp-911451', 'mp-1392626', 'mp-1746248', 'mp-1810340']",0.000153075,"{'Te': 8.0, 'Ir': 4.0}",299.44732816890644,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.0447669503153013e-06,0.000153075,0,0.0006123,MP,data/source/MP/cleaned/cifs/MP-mp-569322.cif,True,,data/final/MP/graphs/Ir0.97Pd0.03Te2-MP-mp-569322-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Li3Mo15Se19,1,0.0,2.0,False,Li6Mo30Se38,Li6Mo30Se38,3.5,Chevrel,True,Li8.108Mo40.541Se51.351,Li-Mo-Se,3,Supercon,Li3Mo15Se19,MP-mp-1223482,Li6Mo30Se38,Li-Mo-Se,Li8.108Mo40.541Se51.351,P 1 21/m 1,monoclinic,9.616275,9.68117491,19.846788,data/final/MP/cifs/Li3Mo15Se19-MP-mp-1223482.cif,data/source/MP/raw/cifs/mp-1223482.cif,mp-1223482,0.0,,2019-01-12 23:52:15.290000,6.113149631513512,,,,0.0432300784555952,4.17131289,520.0,-513.21083548,-6.935281560540541,{'tags': []},-513.21083548,-6.935281560540541,-0.8308023139062501,[],False,[],True,2021-05-12 11:00:52.054000,NM,74,2,mp-1223482,,Li3Mo15Se19,"{'functional': 'PBE', 'labels': ['Li_sv', 'Mo_pv', 'Se'], 'pot_type': 'paw'}","{'Li': 3.0, 'Mo': 15.0, 'Se': 19.0}",GGA,mp-1223482,"['mp-1223482', 'mp-1334464']",0.0006293,"{'Li': 6.0, 'Mo': 30.0, 'Se': 38.0}",1608.1616192296176,[],NM,False,11,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",7.826327807791648e-07,0.0006293,0,0.0012586,MP,data/source/MP/cleaned/cifs/MP-mp-1223482.cif,False,,data/final/MP/graphs/Li3Mo15Se19-MP-mp-1223482.json,0,True,2/m,0,0,3,0,0,0,0,1,0,0,0,1.0,False
Ba1Sb1.7Sn0.3Ti2O1,3,0.1,1.0,True,Ba1Sb1.7Sn0.3Ti2O1,Ba1Sb2Ti2O1,2.2,Oxide,True,Ba16.667Sb28.333Sn5Ti33.333O16.666666666666668,Ba-Sb-Sn-Ti-O,5,Supercon,Ba1Ti2Sb1.7Sn0.3O1,MP-mp-1070806,Ba1Ti2Sb2O1,Ba-Sb-Ti-O,Ba16.667Sb33.333Ti33.333O16.666666666666668,P 4/m m m,tetragonal,4.113474,4.113474,8.312382,data/final/MP/cifs/Ba1Sb1.7Sn0.3Ti2O1-MP-mp-1070806-synth_doped.cif,data/source/MP/raw/cifs/mp-1070806.cif,mp-1070806,0.0,,2018-03-22 04:02:04,5.8154485533321445,,,{'GGA': {'task_id': 'mp-1702174'}},0.0,5.89751533,520.0,-39.14932631,-6.524887718333333,{'tags': []},-39.14932631,-6.524887718333333,-1.5507346602777776,['bandstructure'],True,"[430061, 237789, 430060]",True,2021-05-12 10:58:14.654000,NM,6,16,mp-1070806,oxide,BaTi2Sb2O,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ti_pv', 'Sb', 'O'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Ti': 2.0, 'Sb': 2.0, 'O': 1.0}",GGA,mp-1070806,"['mp-1071055', 'mp-1071068', 'mp-1071083', 'mp-1071088', 'mp-1070806', 'mp-1071124', 'mp-1070846', 'mp-1070900', 'mp-1071137', 'mp-1423542', 'mp-1702174', 'mp-1785425', 'mp-1588663', 'mp-1070899', 'mp-1071129', 'mp-1071119']",0.001055,"{'Ba': 1.0, 'Ti': 2.0, 'Sb': 2.0, 'O': 1.0}",140.65105900950408,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0]",7.500832254158225e-06,0.001055,0,0.001055,MP,data/source/MP/cleaned/cifs/MP-mp-1070806.cif,True,,data/final/MP/graphs/Ba1Sb1.7Sn0.3Ti2O1-MP-mp-1070806-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ce1Ir5,1,0.0,1.0,True,Ce1Ir5,Ce1Ir5,1.82,Heavy_fermion,True,Ce16.667Ir83.333,Ce-Ir,2,Supercon,Ce1Ir5,MP-mp-30507,Ce1Ir5,Ce-Ir,Ce16.667Ir83.333,P 6/m m m,hexagonal,4.355152,5.308498000949157,5.30849876,data/final/MP/cifs/Ce1Ir5-MP-mp-30507.cif,data/source/MP/raw/cifs/mp-30507.cif,mp-30507,0.0,,2014-02-24 04:13:16,17.204353083718015,10.17188/1204911,"@misc{osti_1204911,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeIr5 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1204911"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696922'}},0.0562902313888891,8.34814345,520.0,-52.32476543,-8.720794238333333,{'tags': ['Cerium iridium (1/5)']},-52.32476543,-8.720794238333333,-0.3665873625,"['xas', 'elasticity', 'bandstructure']",True,[102195],True,2021-05-12 10:56:18.721000,NM,6,8,mp-30507,,CeIr5,"{'functional': 'PBE', 'labels': ['Ce', 'Ir'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Ir': 5.0}",GGA,mp-30507,"['mp-992056', 'mp-993749', 'mp-30507', 'mp-1415603', 'mp-1696922', 'mp-1929122', 'mp-995040', 'mp-1595277']",0.0067933,"{'Ce': 1.0, 'Ir': 5.0}",106.28631438688262,[],NM,False,191,0,"[-0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",6.39150961173831e-05,0.0067933,0,0.0067933,MP,data/source/MP/cleaned/cifs/MP-mp-30507.cif,False,,data/final/MP/graphs/Ce1Ir5-MP-mp-30507.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Co2P1,1,0.0,4.0,False,Co8P4,Co8P4,0.0,Other,True,Co66.667P33.333,Co-P,2,Supercon,Co2P1,MP-mp-22204,Co8P4,Co-P,Co66.667P33.333,P n m a,orthorhombic,3.509531,5.519077,6.591204,data/final/MP/cifs/Co2P1-MP-mp-22204.cif,data/source/MP/raw/cifs/mp-22204.cif,mp-22204,0.0,,2014-02-22 11:33:34,7.743706856846986,10.17188/1197421,"@misc{osti_1197421,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Co2P (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197421"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699911'}},0.0,8.42294391,520.0,-84.79976651,-7.066647209166667,"{'tags': ['Cobalt phosphide (2/1) - alpha', 'Cobalt phosphide (2/1)']}",-84.79976651,-7.066647209166667,-0.5233345102777776,"['bandstructure', 'elasticity']",True,"[25726, 94379, 624592, 43685, 624598, 94380]",True,2021-05-12 10:56:16.728000,FM,12,9,mp-22204,,Co2P,"{'functional': 'PBE', 'labels': ['Co', 'P'], 'pot_type': 'paw'}","{'Co': 2.0, 'P': 1.0}",GGA,mp-22204,"['mp-921510', 'mp-920487', 'mp-906892', 'mp-22204', 'mp-1102286', 'mp-1434098', 'mp-1699911', 'mp-1924946', 'mp-1594516']",0.2954556,"{'Co': 8.0, 'P': 4.0}",127.66748103650008,[],FM,True,62,2,"[0.2, 0.2, 0.2, 0.2, 0.1, 0.1, 0.1, 0.1, 0.0, 0.0, 0.0, 0.0]",0.00925703546749,0.2954556,8,1.1818224,MP,data/source/MP/cleaned/cifs/MP-mp-22204.cif,False,,data/final/MP/graphs/Co2P1-MP-mp-22204.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
P2Ti1,1,0.0,4.0,False,P8Ti4,P8Ti4,0.0,Other,True,P66.667Ti33.333,P-Ti,2,Supercon,P2Ti1,MP-mp-20327,Ti4P8,P-Ti,P66.667Ti33.333,P n m a,orthorhombic,3.349843,6.170371,8.27963,data/final/MP/cifs/P2Ti1-MP-mp-20327.cif,data/source/MP/raw/cifs/mp-20327.cif,mp-20327,0.0,,2014-02-21 15:43:45,4.2620860376972605,10.17188/1195449,"@misc{osti_1195449,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TiP2 (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195449"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701606'}},0.0,9.38991721,520.0,-84.70079041,-7.058399200833333,{'tags': ['Titanium phosphide (1/2)']},-84.70079041,-7.058399200833333,-0.8177001908333329,"['xas', 'elasticity', 'bandstructure']",True,"[648232, 24351]",True,2021-05-12 10:56:14.760000,NM,12,9,mp-20327,,TiP2,"{'functional': 'PBE', 'labels': ['Ti_pv', 'P'], 'pot_type': 'paw'}","{'Ti': 1.0, 'P': 2.0}",GGA,mp-20327,"['mp-913478', 'mp-929892', 'mp-930457', 'mp-20327', 'mp-1095531', 'mp-1436705', 'mp-1701606', 'mp-1789204', 'mp-1597676']",1.225e-06,"{'Ti': 4.0, 'P': 8.0}",171.13808174609716,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.8631850667052048e-08,1.225e-06,0,4.9e-06,MP,data/source/MP/cleaned/cifs/MP-mp-20327.cif,False,,data/final/MP/graphs/P2Ti1-MP-mp-20327.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
As2Ba0.7Fe2Na0.3,3,0.0799999999999999,2.0,False,As4Ba1.4Fe4Na0.6,As4Ba1Fe4Na1,23.8,Ferrite,True,As40Ba14Fe40Na6,As-Ba-Fe-Na,4,Supercon,Ba0.7Na0.3Fe2As2,MP-mp-1227868,Ba1Na1Fe4As4,As-Ba-Fe-Na,As40Ba10Fe40Na10,C m m m,orthorhombic,5.458732000131759,5.462821,6.96934908,data/final/MP/cifs/As2Ba0.7Fe2Na0.3-MP-mp-1227868-synth_doped.cif,data/source/MP/raw/cifs/mp-1227868.cif,mp-1227868,0.0,,2019-01-13 03:39:01.428000,5.934244973483095,,,{'GGA': {'task_id': 'mp-1731957'}},0.0195872770000011,4.30353274,520.0,-59.62394279,-5.962394279,{'tags': []},-59.62394279,-5.962394279,-0.3865939246551718,[],False,[],True,2021-05-12 11:00:59.151000,FM,10,4,mp-1227868,,BaNa(FeAs)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Na_pv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Na': 1.0, 'Fe': 4.0, 'As': 4.0}",GGA,mp-1227868,"['mp-1227868', 'mp-1396889', 'mp-1731957', 'mp-1827521']",0.9949323,"{'Ba': 1.0, 'Na': 1.0, 'Fe': 4.0, 'As': 4.0}",191.22642477974767,[],FM,True,65,1,"[0.0, 0.0, 0.3, 0.3, 0.3, 0.3, 0.0, 0.0, 0.0, 0.0]",0.0052029017493055,0.9949323,4,0.9949323,MP,data/source/MP/cleaned/cifs/MP-mp-1227868.cif,True,,data/final/MP/graphs/As2Ba0.7Fe2Na0.3-MP-mp-1227868-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
N1Y1,1,0.0,1.0,True,N1Y1,N1Y1,0.0,Other,True,N50Y50,N-Y,2,Supercon,N1Y1,MP-mp-2114,Y1N1,N-Y,N50Y50,F m -3 m,cubic,3.47832897,3.47832897,3.47832897,data/final/MP/cifs/N1Y1-MP-mp-2114.cif,data/source/MP/raw/cifs/mp-2114.cif,mp-2114,0.2858,,2011-05-12 17:49:33,5.74275745212572,10.17188/1196411,"@misc{osti_1196411,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YN (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196411"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687811'}},0.0,4.11017145,520.0,-18.17665959,-9.088329795,"{'tags': ['Yttrium nitride (1/1)', 'Yttrium nitride', 'Yttrium nitride (1/1) - RS-type', 'Yttrium nitride - B1']}",-18.17665959,-9.088329795,-1.867346775833333,"['diel', 'xas', 'elasticity', 'bandstructure']",True,"[191090, 76528, 190622, 183179, 644873, 185547, 161075, 185492, 290711, 290471, 644875, 37413]",True,2021-05-12 10:56:16.728000,NM,2,38,mp-2114,,YN,"{'functional': 'PBE', 'labels': ['Y_sv', 'N'], 'pot_type': 'paw'}","{'Y': 1.0, 'N': 1.0}",GGA,mp-2114,"['mp-655318', 'mp-655319', 'mp-655321', 'mp-2114', 'mp-1056962', 'mp-1056976', 'mp-1056997', 'mp-1057990', 'mp-1057878', 'mp-1058018', 'mp-1057891', 'mp-1057915', 'mp-1057974', 'mp-1058373', 'mp-1058382', 'mp-1058401', 'mp-1058984', 'mp-1059003', 'mp-1059035', 'mp-1060240', 'mp-1060248', 'mp-1060287', 'mp-1061223', 'mp-1061281', 'mp-1061236', 'mp-1141257', 'mp-1440999', 'mp-1687811', 'mp-1794617', 'mp-1591614', 'mp-1594920', 'mp-1059025', 'mp-1061275', 'mp-1057907', 'mp-1058394', 'mp-1060276', 'mp-1056995', 'mp-1058010']",4.59e-05,"{'Y': 1.0, 'N': 1.0}",29.75753566871776,[],NM,False,225,0,"[0, 0]",1.5424664364345131e-06,4.59e-05,0,4.59e-05,MP,data/source/MP/cleaned/cifs/MP-mp-2114.cif,False,,data/final/MP/graphs/N1Y1-MP-mp-2114.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Bi2Ca0.9Ce0.1Cu2Sr2O8,2,0.0133333333333333,2.0,False,Bi4Ca1.8Ce0.2Cu4Sr4O16,Bi4Ca2Cu4Sr4O16,75.455,Cuprate,True,Bi13.333Ca6Ce0.667Cu13.333Sr13.333O53.333333333333336,Bi-Ca-Ce-Cu-Sr-O,6,Supercon,Bi2Sr2Ca0.9Ce0.1Cu2O8,MP-mp-1218930,Sr4Ca2Cu4Bi4O16,Bi-Ca-Cu-Sr-O,Bi13.333Ca6.667Cu13.333Sr13.333O53.333333333333336,C c c 2,orthorhombic,5.417115,5.472898000129128,16.11398919,data/final/MP/cifs/Bi2Ca0.9Ce0.1Cu2Sr2O8-MP-mp-1218930-synth_doped.cif,data/source/MP/raw/cifs/mp-1218930.cif,mp-1218930,0.0,,2019-01-12 20:01:06.544000,6.266668983881059,,,,0.039252223722225,4.51768334,520.0,-173.15021002,-5.771673667333333,{'tags': []},-173.15021002,-5.771673667333333,-2.074956548222222,[],False,[],True,2021-05-12 11:00:42.526000,NM,30,3,mp-1218930,oxide,Sr2CaCu2(BiO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",GGA,mp-1218930,"['mp-1218930', 'mp-1359698', 'mp-1817714']",0.00011165,"{'Sr': 4.0, 'Ca': 2.0, 'Cu': 4.0, 'Bi': 4.0, 'O': 16.0}",470.7976286073367,[],NM,False,37,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.743014544498498e-07,0.00011165,0,0.0002233,MP,data/source/MP/cleaned/cifs/MP-mp-1218930.cif,True,,data/final/MP/graphs/Bi2Ca0.9Ce0.1Cu2Sr2O8-MP-mp-1218930-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
C0.47Ta1,2,0.0272108843537415,2.0,False,C0.94Ta2,C1Ta2,0.0,Other,True,C31.973Ta68.027,C-Ta,2,Supercon,C0.47Ta1,MP-mp-7088,Ta2C1,C-Ta,C33.333Ta66.667,P -3 m 1,trigonal,3.1250519978903206,3.1250525,4.97079,data/final/MP/cifs/C0.47Ta1-MP-mp-7088-synth_doped.cif,data/source/MP/raw/cifs/mp-7088.cif,mp-7088,0.0,,2011-05-27 16:38:17,14.768671437371712,10.17188/1286550,"@misc{osti_1286550,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ta2C (SG:164) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1286550"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687508'}},0.0,6.48100088,520.0,-34.73531553,-11.57843851,{'tags': ['Tantalum carbide (2/1)']},-34.73531553,-11.57843851,-0.5976598566666667,"['bandstructure', 'elasticity']",True,"[618840, 409555]",True,2021-05-12 10:56:29.056000,NM,3,8,mp-7088,,Ta2C,"{'functional': 'PBE', 'labels': ['Ta_pv', 'C'], 'pot_type': 'paw'}","{'Ta': 2.0, 'C': 1.0}",GGA,mp-7088,"['mp-910911', 'mp-927075', 'mp-926538', 'mp-7088', 'mp-1476064', 'mp-1687508', 'mp-1781409', 'mp-1590653']",2.24e-05,"{'Ta': 2.0, 'C': 1.0}",42.04076762876414,[],NM,False,164,0,"[0, 0, 0]",5.328161511654703e-07,2.24e-05,0,2.24e-05,MP,data/source/MP/cleaned/cifs/MP-mp-7088.cif,True,,data/final/MP/graphs/C0.47Ta1-MP-mp-7088-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ba2Cu2La2Sc0.3Ti1.7O10.81,3,0.0698564593301435,0.5,False,Ba1Cu1La1Sc0.15Ti0.85O5.405,Ba1Cu1La1Ti1O6,0.0,Cuprate,True,Ba10.633Cu10.633La10.633Sc1.595Ti9.038O57.46943115364167,Ba-Cu-La-Sc-Ti-O,6,Supercon,La2Ba2Cu2Ti1.7Sc0.3O10.81,MP-mp-1227852,Ba1La1Ti1Cu1O6,Ba-Cu-La-Ti-O,Ba10Cu10La10Ti10O60,F -4 3 m,cubic,5.61997722,5.619977219999999,5.619977219999999,data/final/MP/cifs/Ba2Cu2La2Sc0.3Ti1.7O10.81-MP-mp-1227852-synth_doped.cif,data/source/MP/raw/cifs/mp-1227852.cif,mp-1227852,0.0,,2019-01-13 03:38:10.917000,6.398590577851808,,,{'GGA': {'task_id': 'mp-1734188'}},0.1228187138579528,4.96777084,520.0,-72.7941219,-7.279412189999999,{'tags': []},-72.7941219,-7.279412189999999,-2.8378679248333327,['bandstructure'],True,[],True,2021-05-12 10:58:49.477000,FM,10,5,mp-1227852,oxide,BaLaTiCuO6,"{'functional': 'PBE', 'labels': ['Ba_sv', 'La', 'Ti_pv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 1.0, 'La': 1.0, 'Ti': 1.0, 'Cu': 1.0, 'O': 6.0}",GGA,mp-1227852,"['mp-1227852', 'mp-1389128', 'mp-1734188', 'mp-1805149', 'mp-1621737']",1.9113509,"{'Ba': 1.0, 'La': 1.0, 'Ti': 1.0, 'Cu': 1.0, 'O': 6.0}",125.51298752546604,[],FM,True,216,1,"[0.0, 0.0, 0.0, 0.9, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0152283117283954,1.9113509,1,1.9113509,MP,data/source/MP/cleaned/cifs/MP-mp-1227852.cif,True,,data/final/MP/graphs/Ba2Cu2La2Sc0.3Ti1.7O10.81-MP-mp-1227852-synth_doped.json,0,True,-43m,5,0,0,0,0,0,0,0,0,0,1,1.0,False
Ce0.925Co1In5La0.075,2,0.0214285714285714,1.0,True,Ce0.925Co1In5La0.075,Ce1Co1In5,1.31,Heavy_fermion,True,Ce13.214Co14.286In71.429La1.071,Ce-Co-In-La,4,Supercon,Ce0.925La0.075Co1In5,MP-mp-19961,Ce1In5Co1,Ce-Co-In,Ce14.286Co14.286In71.429,P 4/m m m,tetragonal,4.635989,4.635989,7.564124,data/final/MP/cifs/Ce0.925Co1In5La0.075-MP-mp-19961-synth_doped.cif,data/source/MP/raw/cifs/mp-19961.cif,mp-19961,0.0,,2014-02-21 14:08:25,7.897022127398995,10.17188/1195145,"@misc{osti_1195145,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeIn5Co (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195145"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701944'}},0.0,7.80626318,520.0,-28.52795357,-4.075421938571429,{'tags': ['Cerium cobalt indium (1/1/5)']},-28.52795357,-4.075421938571429,-0.2468754242857146,"['xas', 'bandstructure']",True,[102108],True,2021-05-12 10:56:57.051000,FM,7,8,mp-19961,,CeIn5Co,"{'functional': 'PBE', 'labels': ['Ce', 'In_d', 'Co'], 'pot_type': 'paw'}","{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",GGA,mp-19961,"['mp-928775', 'mp-912209', 'mp-928270', 'mp-19961', 'mp-1504062', 'mp-1701944', 'mp-1785253', 'mp-1593180']",0.9310323,"{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",162.57113333428427,[],FM,True,123,1,"[0.7, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0057269226147644,0.9310323,1,0.9310323,MP,data/source/MP/cleaned/cifs/MP-mp-19961.cif,True,,data/final/MP/graphs/Ce0.925Co1In5La0.075-MP-mp-19961-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Cu1S4Ti2,1,0.0,2.0,False,Cu2S8Ti4,Cu2S8Ti4,0.0,Other,True,Cu14.286S57.143Ti28.571,Cu-S-Ti,3,Supercon,Cu1S4Ti2,MP-mp-3951,Ti4Cu2S8,Cu-S-Ti,Cu14.286S57.143Ti28.571,F d -3 m,cubic,7.08157118,7.081571179999999,7.081571179999999,data/final/MP/cifs/Cu1S4Ti2-MP-mp-3951.cif,data/source/MP/raw/cifs/mp-3951.cif,mp-3951,0.0,,2011-05-15 06:20:16,3.802800004195373,10.17188/1207666,"@misc{osti_1207666,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ti2CuS4 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207666"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702484'}},0.0,5.6155435,520.0,-88.98467619,-6.356048299285715,"{'tags': ['Copper dititanium tetrasulfide', 'Spinel', 'Copper(I) titanium(III) titanium sulfide', 'Copper dititanium(III) sulfide', 'Copper titanium sulfide (1/2/4)']}",-88.98467619,-6.356048299285715,-1.4383354177380951,"['xas', 'bandstructure']",True,"[44609, 628916, 35269, 53336, 170227]",True,2021-05-12 10:57:08.928000,FM,14,8,mp-3951,,Ti2CuS4,"{'functional': 'PBE', 'labels': ['Ti_pv', 'Cu_pv', 'S'], 'pot_type': 'paw'}","{'Ti': 2.0, 'Cu': 1.0, 'S': 4.0}",GGA,mp-3951,"['mp-926180', 'mp-926736', 'mp-910325', 'mp-3951', 'mp-1416269', 'mp-1702484', 'mp-1879356', 'mp-1601217']",0.4913863,"{'Ti': 4.0, 'Cu': 2.0, 'S': 8.0}",251.1157056292215,[],FM,True,12,1,"[0.3, 0.2, -0.0, 0.3, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0039136245880657,0.4913863,3,0.9827726,MP,data/source/MP/cleaned/cifs/MP-mp-3951.cif,False,,data/final/MP/graphs/Cu1S4Ti2-MP-mp-3951.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Cu1Rh1.9Se4Sn0.1,2,0.0285714285714285,2.0,False,Cu2Rh3.8Se8Sn0.2,Cu2Rh4Se8,2.86,Other,True,Cu14.286Rh27.143Se57.143Sn1.429,Cu-Rh-Se-Sn,4,Supercon,Cu1Rh1.9Sn0.1Se4,MP-mp-15614,Cu2Rh4Se8,Cu-Rh-Se,Cu14.286Rh28.571Se57.143,F d -3 m,cubic,7.355548180000001,7.35554818,7.35554818,data/final/MP/cifs/Cu1Rh1.9Se4Sn0.1-MP-mp-15614-synth_doped.cif,data/source/MP/raw/cifs/mp-15614.cif,mp-15614,0.0,,2011-06-05 07:24:52,6.906389184589765,10.17188/1191272,"@misc{osti_1191272,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Cu(RhSe2)2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191272"",
    place = ""United States"",
    year = ""2015"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696606'}},0.0,4.3275914,520.0,-70.96322011,-5.068801436428571,"{'tags': ['Copper rhodium selenide (1/2/4)', 'Copper dirhodium tetraselenide']}",-70.96322011,-5.068801436428571,-0.6511631049107142,"['xas', 'bandstructure']",True,"[41903, 628775, 628777, 602898]",True,2021-05-12 10:56:53.126000,NM,14,8,mp-15614,,Cu(RhSe2)2,"{'functional': 'PBE', 'labels': ['Cu_pv', 'Rh_pv', 'Se'], 'pot_type': 'paw'}","{'Cu': 1.0, 'Rh': 2.0, 'Se': 4.0}",GGA,mp-15614,"['mp-920967', 'mp-942426', 'mp-942820', 'mp-15614', 'mp-1422873', 'mp-1696606', 'mp-1860746', 'mp-1604721']",0.00066735,"{'Cu': 2.0, 'Rh': 4.0, 'Se': 8.0}",281.40391576118253,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.743004362216169e-06,0.00066735,0,0.0013347,MP,data/source/MP/cleaned/cifs/MP-mp-15614.cif,True,,data/final/MP/graphs/Cu1Rh1.9Se4Sn0.1-MP-mp-15614-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
B2C1Ni2Pr0.25Y0.75,3,0.0833333333333333,1.0,True,B2C1Ni2Pr0.25Y0.75,B2C1Ni2Y1,7.7,Other,True,B33.333C16.667Ni33.333Pr4.167Y12.5,B-C-Ni-Pr-Y,5,Supercon,Y0.75Pr0.25Ni2B2C1,MP-mp-6576,Y1Ni2B2C1,B-C-Ni-Y,B33.333C16.667Ni33.333Y16.667,I 4/m m m,tetragonal,3.548790000501972,3.548790000501972,5.76144136,data/final/MP/cifs/B2C1Ni2Pr0.25Y0.75-MP-mp-6576-synth_doped.cif,data/source/MP/raw/cifs/mp-6576.cif,mp-6576,0.0,,2011-05-13 05:21:43,6.099730998852292,10.17188/1281366,"@misc{osti_1281366,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281366"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688230'}},0.0,6.81083016,520.0,-43.677878,-7.279646333333333,{'tags': []},-43.677878,-7.279646333333333,-0.5109282141666659,"['xas', 'bandstructure']",True,"[75816, 89142, 83231, 79574, 41549]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6576,,YNi2B2C,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6576,"['mp-6576', 'mp-1007054', 'mp-1000583', 'mp-1439516', 'mp-1688230', 'mp-1794280', 'mp-1011792', 'mp-1597064']",0.0006603,"{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.3152437079014,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",1.010943177297096e-05,0.0006603,0,0.0006603,MP,data/source/MP/cleaned/cifs/MP-mp-6576.cif,True,,data/final/MP/graphs/B2C1Ni2Pr0.25Y0.75-MP-mp-6576-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Be2Ru1,1,0.0,4.0,False,Be8Ru4,Be8Ru4,1.35,Other,True,Be66.667Ru33.333,Be-Ru,2,Supercon,Be2Ru1,MP-mp-1103315,Be8Ru4,Be-Ru,Be66.667Ru33.333,P 63/m m c,hexagonal,4.362685997572529,4.36268608,7.057683,data/final/MP/cifs/Be2Ru1-MP-mp-1103315.cif,data/source/MP/raw/cifs/mp-1103315.cif,mp-1103315,0.0,,2018-07-18 18:04:58,6.799854114795605,,,{'GGA': {'task_id': 'mp-1697162'}},0.0,6.35409534,520.0,-70.99796364,-5.91649697,"{'tags': ['Be2Ru', 'Ruthenium beryllide (1/2)', 'MgZn2', 'Friauf-Laves phase, Frank-Kasper phase']}",-70.99796364,-5.91649697,-0.332091841666666,['bandstructure'],True,[616410],True,2021-05-12 10:58:20.361000,NM,12,5,mp-1103315,,Be2Ru,"{'functional': 'PBE', 'labels': ['Be_sv', 'Ru_pv'], 'pot_type': 'paw'}","{'Be': 2.0, 'Ru': 1.0}",GGA,mp-1103315,"['mp-1103315', 'mp-1424540', 'mp-1697162', 'mp-1803960', 'mp-1600392']",0.00081035,"{'Be': 8.0, 'Ru': 4.0}",116.33240401647944,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.7863259832065617e-05,0.00081035,0,0.0032414,MP,data/source/MP/cleaned/cifs/MP-mp-1103315.cif,False,,data/final/MP/graphs/Be2Ru1-MP-mp-1103315.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
S1Y1,1,0.0,1.0,True,S1Y1,S1Y1,1.9,Other,True,S50Y50,S-Y,2,Supercon,S1Y1,MP-mp-1534,Y1S1,S-Y,S50Y50,F m -3 m,cubic,3.91828232,3.91828232,3.91828232,data/final/MP/cifs/S1Y1-MP-mp-1534.cif,data/source/MP/raw/cifs/mp-1534.cif,mp-1534,0.0,,2011-05-12 18:03:10,4.722344361434655,10.17188/1191112,"@misc{osti_1191112,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YS (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191112"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686720'}},0.0,6.71482256,520.0,-14.59072466,-7.29536233,"{'tags': ['Yttrium sulfide', 'Yttrium sulfide (1/1)', 'Yttrium(II) sulfide', 'High pressure experimental phase']}",-14.59072466,-7.29536233,-2.245401839895833,"['xas', 'elasticity', 'bandstructure']",True,"[44973, 183012, 183013, 651401, 52215, 183011, 651394, 651405]",True,2021-05-12 10:56:12.755000,NM,2,21,mp-1534,,YS,"{'functional': 'PBE', 'labels': ['Y_sv', 'S'], 'pot_type': 'paw'}","{'Y': 1.0, 'S': 1.0}",GGA,mp-1534,"['mp-1000799', 'mp-1007248', 'mp-1534', 'mp-1057579', 'mp-1057546', 'mp-1057554', 'mp-1059824', 'mp-1059811', 'mp-1059855', 'mp-1060595', 'mp-1060612', 'mp-1060647', 'mp-1440688', 'mp-1686720', 'mp-1793269', 'mp-1011988', 'mp-1591467', 'mp-1596971', 'mp-1060649', 'mp-1059863', 'mp-1057578']",0.0021389,"{'Y': 1.0, 'S': 1.0}",42.5375209790465,[],NM,False,225,0,"[0, 0]",5.028266694369891e-05,0.0021389,0,0.0021389,MP,data/source/MP/cleaned/cifs/MP-mp-1534.cif,False,,data/final/MP/graphs/S1Y1-MP-mp-1534.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
In1Pt2Y1,1,0.0,2.0,False,In2Pt4Y2,In2Pt4Y2,0.0,Other,True,In25Pt50Y25,In-Pt-Y,3,Supercon,Pt2In1Y1,MP-mp-510441,Y2In2Pt4,In-Pt-Y,In25Pt50Y25,P 63/m m c,hexagonal,4.589123999479583,4.589124030000001,9.073776,data/final/MP/cifs/In1Pt2Y1-MP-mp-510441.cif,data/source/MP/raw/cifs/mp-510441.cif,mp-510441,0.0,,2014-12-22 16:22:52,11.91813180116218,10.17188/1262928,"@misc{osti_1262928,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YInPt2 (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1262928"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699271'}},0.0,6.39979718,520.0,-50.33653259,-6.29206657375,{'tags': ['Indium platinum yttrium (1/2/1)']},-50.33653259,-6.29206657375,-0.952074007916666,"['xas', 'elasticity', 'bandstructure']",True,[59505],True,2021-05-12 10:56:20.740000,NM,8,9,mp-510441,,YInPt2,"{'functional': 'PBE', 'labels': ['Y_sv', 'In_d', 'Pt'], 'pot_type': 'paw'}","{'Y': 1.0, 'In': 1.0, 'Pt': 2.0}",GGA,mp-510441,"['mp-930641', 'mp-913904', 'mp-569162', 'mp-1414755', 'mp-1699271', 'mp-1828919', 'mp-977662', 'mp-1592112', 'mp-510441']",0.0002531,"{'Y': 2.0, 'In': 2.0, 'Pt': 4.0}",165.49248400897545,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",3.058749181458576e-06,0.0002531,0,0.0005062,MP,data/source/MP/cleaned/cifs/MP-mp-510441.cif,False,,data/final/MP/graphs/In1Pt2Y1-MP-mp-510441.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Nb3Sb0.1Sn0.9,2,0.0499999999999999,2.0,False,Nb6Sb0.2Sn1.8,Nb6Sn2,17.04,Other,True,Nb75Sb2.5Sn22.5,Nb-Sb-Sn,3,Supercon,Nb3Sb0.1Sn0.9,MP-mp-1326,Nb6Sn2,Nb-Sn,Nb75Sn25,P m -3 n,cubic,5.334611,5.334611,5.334611,data/final/MP/cifs/Nb3Sb0.1Sn0.9-MP-mp-1326-synth_doped.cif,data/source/MP/raw/cifs/mp-1326.cif,mp-1326,0.0,,2011-05-14 09:51:48,8.694218121896231,10.17188/1189484,"@misc{osti_1189484,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Sn (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189484"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668415'}},0.0,6.59372491,520.0,-69.93787048,-8.74223381,{'tags': ['Niobium tin (3/1)']},-69.93787048,-8.74223381,-0.163862066250001,"['xas', 'elasticity', 'bandstructure']",True,"[105230, 645503, 645489, 105231, 645498, 645485, 645474, 645496, 645480, 645488, 645482, 645487, 645500, 645493, 645477, 645484, 645502, 645483, 150878, 645479, 645481, 645486, 645473]",True,2021-05-12 10:56:12.755000,NM,8,9,mp-1326,,Nb3Sn,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Sn_d'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Sn': 1.0}",GGA,mp-1326,"['mp-930046', 'mp-913770', 'mp-930577', 'mp-1326', 'mp-1440651', 'mp-1668415', 'mp-1880085', 'mp-1594093', 'mp-1594507']",0.62023085,"{'Nb': 6.0, 'Sn': 2.0}",151.81275738025872,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0081709977567491,0.62023085,0,1.2404617,MP,data/source/MP/cleaned/cifs/MP-mp-1326.cif,True,,data/final/MP/graphs/Nb3Sb0.1Sn0.9-MP-mp-1326-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Mo15Se19,1,0.0,2.0,False,Mo30Se38,Mo30Se38,5.29,Chevrel,True,Mo44.118Se55.882,Mo-Se,2,Supercon,Mo15Se19,MP-mp-570170,Mo30Se38,Mo-Se,Mo44.118Se55.882,P 63/m,hexagonal,9.62931799727735,9.62931799,19.851996,data/final/MP/cifs/Mo15Se19-MP-mp-570170.cif,data/source/MP/raw/cifs/mp-570170.cif,mp-570170,0.0,,2014-02-27 06:04:44,6.123546913359304,10.17188/1275559,"@misc{osti_1275559,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Mo15Se19 (SG:176) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1275559"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-931585'}},0.0638122361764734,3.68521303,520.0,-492.23887378,-7.238806967352941,{'tags': ['Molybdenum selenide (15/19) - alpha']},-492.23887378,-7.238806967352941,-0.7641315695450364,"['xas', 'bandstructure']",True,[69004],True,2021-05-12 10:57:24.969000,NM,68,5,mp-570170,,Mo15Se19,"{'functional': 'PBE', 'labels': ['Mo_pv', 'Se'], 'pot_type': 'paw'}","{'Mo': 15.0, 'Se': 19.0}",GGA,mp-570170,"['mp-570170', 'mp-916193', 'mp-932734', 'mp-931585', 'mp-1330843']",0.09586525,"{'Mo': 30.0, 'Se': 38.0}",1594.1378319064584,[],NM,False,176,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001202722224907,0.09586525,0,0.1917305,MP,data/source/MP/cleaned/cifs/MP-mp-570170.cif,False,,data/final/MP/graphs/Mo15Se19-MP-mp-570170.json,0,True,6/m,0,3,0,0,0,0,0,1,0,0,0,1.0,False
Ba0.097Cu1La1.903O4,2,0.0277142857142857,1.0,True,Ba0.097Cu1La1.903O4,Cu1La2O4,26.0,Cuprate,True,Ba1.386Cu14.286La27.186O57.142857142857146,Ba-Cu-La-O,4,Supercon,La1.903Ba0.097Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ba0.097Cu1La1.903O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ba0.097Cu1La1.903O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ce1In5Ir0.25Rh0.75,3,0.0714285714285714,1.0,True,Ce1In5Ir0.25Rh0.75,Ce1In5Rh1,0.92,Heavy_fermion,True,Ce14.286In71.429Ir3.571Rh10.714,Ce-In-Ir-Rh,4,Supercon,Ce1Rh0.75Ir0.25In5,MP-mp-20294,Ce1In5Rh1,Ce-In-Rh,Ce14.286In71.429Rh14.286,P 4/m m m,tetragonal,4.709358,4.709358,7.592679,data/final/MP/cifs/Ce1In5Ir0.25Rh0.75-MP-mp-20294-synth_doped.cif,data/source/MP/raw/cifs/mp-20294.cif,mp-20294,0.0,,2015-11-23 15:12:00,8.05771622389016,10.17188/1195421,"@misc{osti_1195421,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeIn5Rh (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195421"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701496'}},0.0,7.74909127,520.0,-30.04466451,-4.29209493,"{'tags': ['High pressure experimental phase', 'Cerium rhodium indium (1/1/5) - HP', 'Cerium rhodium indide (1/1/5)']}",-30.04466451,-4.29209493,-0.4269784049999998,"['xas', 'bandstructure']",True,"[150226, 110780, 110777, 110779, 110778]",True,2021-05-12 10:56:57.051000,FM,7,8,mp-20294,,CeIn5Rh,"{'functional': 'PBE', 'labels': ['Ce', 'In_d', 'Rh_pv'], 'pot_type': 'paw'}","{'Ce': 1.0, 'In': 5.0, 'Rh': 1.0}",GGA,mp-20294,"['mp-986842', 'mp-988024', 'mp-1430916', 'mp-1701496', 'mp-1780117', 'mp-988278', 'mp-1588425', 'mp-20294']",0.0607598,"{'Ce': 1.0, 'In': 5.0, 'Rh': 1.0}",168.39083554410138,[],FM,True,123,1,"[0.1, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0003608260497293,0.0607598,1,0.0607598,MP,data/source/MP/cleaned/cifs/MP-mp-20294.cif,True,,data/final/MP/graphs/Ce1In5Ir0.25Rh0.75-MP-mp-20294-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Pb1Pd1Tl1,1,0.0,2.0,False,Pb2Pd2Tl2,Pb2Pd2Tl2,1.78,Other,True,Pb33.333Pd33.333Tl33.333,Pb-Pd-Tl,3,Supercon,Pd1Tl1Pb1,MP-mp-1216566,Tl2Pd2Pb2,Pb-Pd-Tl,Pb33.333Pd33.333Tl33.333,F m m m,orthorhombic,5.630336620279459,5.63033662,5.876814569999999,data/final/MP/cifs/Pb1Pd1Tl1-MP-mp-1216566.cif,data/source/MP/raw/cifs/mp-1216566.cif,mp-1216566,0.0,,2019-01-12 18:03:12.423000,11.893394867413583,,,{'GGA': {'task_id': 'mp-1759038'}},0.0064353874305553,6.58965968,520.0,-23.51668088,-3.919446813333333,{'tags': []},-23.51668088,-3.919446813333333,-0.1677228044444441,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,6,5,mp-1216566,,TlPdPb,"{'functional': 'PBE', 'labels': ['Tl_d', 'Pd', 'Pb_d'], 'pot_type': 'paw'}","{'Tl': 1.0, 'Pd': 1.0, 'Pb': 1.0}",GGA,mp-1216566,"['mp-1216566', 'mp-1387573', 'mp-1759038', 'mp-1786708', 'mp-1626226']",7.235e-05,"{'Tl': 2.0, 'Pd': 2.0, 'Pb': 2.0}",144.6457846336984,[],NM,False,69,0,"[0, 0, 0, 0, 0, 0]",1.000374814699501e-06,7.235e-05,0,0.0001447,MP,data/source/MP/cleaned/cifs/MP-mp-1216566.cif,False,,data/final/MP/graphs/Pb1Pd1Tl1-MP-mp-1216566.json,0,True,mmm,0,0,0,7,0,0,0,0,0,0,1,1.0,False
Ni0.22V0.78,3,0.06,8.0,False,Ni1.76V6.24,Ni2V6,0.35,Other,True,Ni22V78,Ni-V,2,Supercon,Ni0.22V0.78,MP-mp-7226,V6Ni2,Ni-V,Ni25V75,P m -3 n,cubic,4.669659,4.669659,4.669659,data/final/MP/cifs/Ni0.22V0.78-MP-mp-7226-synth_doped.cif,data/source/MP/raw/cifs/mp-7226.cif,mp-7226,0.0,,2011-06-01 02:03:46,6.8987549160690005,10.17188/1287488,"@misc{osti_1287488,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Ni (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1287488"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699417'}},0.0,6.68305039,520.0,-67.31355729,-8.41419466125,{'tags': ['Nickel vanadium (1/3)']},-67.31355729,-8.41419466125,-0.1562309387500011,"['bandstructure', 'elasticity']",True,[647028],True,2021-05-12 10:56:29.056000,NM,8,8,mp-7226,,V3Ni,"{'functional': 'PBE', 'labels': ['V_pv', 'Ni_pv'], 'pot_type': 'paw'}","{'V': 3.0, 'Ni': 1.0}",GGA,mp-7226,"['mp-930575', 'mp-930062', 'mp-913800', 'mp-7226', 'mp-1427876', 'mp-1699417', 'mp-1796237', 'mp-1587127']",0.00106075,"{'V': 6.0, 'Ni': 2.0}",101.82525412435716,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",2.08347135319599e-05,0.00106075,0,0.0021215,MP,data/source/MP/cleaned/cifs/MP-mp-7226.cif,True,,data/final/MP/graphs/Ni0.22V0.78-MP-mp-7226-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Cu3Nd0.7Pr0.3O7,3,0.0461538461538461,1.0,True,Ba2Cu3Nd0.7Pr0.3O7,Ba2Cu3Nd1O7,5.6,Cuprate,True,Ba15.385Cu23.077Nd5.385Pr2.308O53.84615384615385,Ba-Cu-Nd-Pr-O,5,Supercon,Nd0.7Pr0.3Ba2Cu3O7,MP-mp-22719,Ba2Nd1Cu3O7,Ba-Cu-Nd-O,Ba15.385Cu23.077Nd7.692O53.84615384615385,P m m m,orthorhombic,3.893817,3.958458,11.89947,data/final/MP/cifs/Ba2Cu3Nd0.7Pr0.3O7-MP-mp-22719-synth_doped.cif,data/source/MP/raw/cifs/mp-22719.cif,mp-22719,0.0,,2015-01-22 21:32:23,6.532421108031168,10.17188/1198922,"@misc{osti_1198922,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2NdCu3O7 (SG:47) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198922"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704234'}},0.0180149053205083,3.13221275,520.0,-78.75337907,-6.057952236153846,"{'tags': ['Neodymium barium copper oxide (1/2/3/7)', 'Neodymium dibarium tricopper heptaoxide']}",-78.75337907,-6.057952236153846,-2.155611319615384,"['bandstructure', 'elasticity']",True,"[86960, 81169]",True,2021-05-12 10:56:16.728000,NM,13,8,mp-22719,oxide,Ba2NdCu3O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Nd_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Nd': 1.0, 'Cu': 3.0, 'O': 7.0}",GGA,mp-22719,"['mp-926068', 'mp-925655', 'mp-917559', 'mp-1427130', 'mp-1704234', 'mp-1829984', 'mp-1600543', 'mp-22719']",0.0444215,"{'Ba': 2.0, 'Nd': 1.0, 'Cu': 3.0, 'O': 7.0}",183.4126123839547,[],NM,False,47,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0002421943585155,0.0444215,0,0.0444215,MP,data/source/MP/cleaned/cifs/MP-mp-22719.cif,True,,data/final/MP/graphs/Ba2Cu3Nd0.7Pr0.3O7-MP-mp-22719-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Mo0.5Rh0.5,1,0.0,4.0,False,Mo2Rh2,Mo2Rh2,1.94,Other,True,Mo50Rh50,Mo-Rh,2,Supercon,Mo0.5Rh0.5,MP-mp-12595,Mo2Rh2,Mo-Rh,Mo50Rh50,P m m a,orthorhombic,2.761992,4.447731,4.847858,data/final/MP/cifs/Mo0.5Rh0.5-MP-mp-12595.cif,data/source/MP/raw/cifs/mp-12595.cif,mp-12595,0.0,,2011-05-28 07:14:31,11.08878697670397,10.17188/1188998,"@misc{osti_1188998,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MoRh (SG:51) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188998"",
    place = ""United States"",
    year = ""2015"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677779'}},0.0,7.61141272,520.0,-37.17584203,-9.2939605075,{'tags': ['Molybdenum rhodium (1/1) - LT']},-37.17584203,-9.2939605075,-0.1889850575,"['xas', 'elasticity', 'bandstructure']",True,[108608],True,2021-05-12 10:56:12.755000,NM,4,8,mp-12595,,MoRh,"{'functional': 'PBE', 'labels': ['Mo_pv', 'Rh_pv'], 'pot_type': 'paw'}","{'Mo': 1.0, 'Rh': 1.0}",GGA,mp-12595,"['mp-934107', 'mp-944163', 'mp-944790', 'mp-12595', 'mp-1437696', 'mp-1677779', 'mp-1793327', 'mp-1593564']",0.0011197,"{'Mo': 2.0, 'Rh': 2.0}",59.55398397702039,[],NM,False,51,0,"[0, 0, 0, 0]",3.760285795261152e-05,0.0011197,0,0.0022394,MP,data/source/MP/cleaned/cifs/MP-mp-12595.cif,False,,data/final/MP/graphs/Mo0.5Rh0.5-MP-mp-12595.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Co1Sb1,1,0.0,2.0,False,Co2Sb2,Co2Sb2,0.0,Other,True,Co50Sb50,Co-Sb,2,Supercon,Co1Sb1,MP-mp-2644,Co2Sb2,Co-Sb,Co50Sb50,P 63/m m c,hexagonal,3.874211999954977,3.87421199,5.205907,data/final/MP/cifs/Co1Sb1-MP-mp-2644.cif,data/source/MP/raw/cifs/mp-2644.cif,mp-2644,0.0,,2011-05-12 20:08:20,8.868028713497768,10.17188/1201171,"@misc{osti_1201171,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CoSb (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201171"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686643'}},0.0,8.63436151,520.0,-23.12087868,-5.78021967,"{'tags': ['Cobalt antimony (1/1)', 'Cobalt antimonide (1/1)']}",-23.12087868,-5.78021967,-0.2575601525000008,"['xas', 'elasticity', 'bandstructure']",True,"[624909, 657491, 76118, 624893, 169166, 169167, 624900, 169169, 189946, 164409, 624901, 169168]",True,2021-05-12 10:56:18.721000,NM,4,13,mp-2644,,CoSb,"{'functional': 'PBE', 'labels': ['Co', 'Sb'], 'pot_type': 'paw'}","{'Co': 1.0, 'Sb': 1.0}",GGA,mp-2644,"['mp-926086', 'mp-925671', 'mp-910197', 'mp-2644', 'mp-1065952', 'mp-1065896', 'mp-1065927', 'mp-1440792', 'mp-1686643', 'mp-1784469', 'mp-1591704', 'mp-1596790', 'mp-1065948']",5.54e-05,"{'Co': 2.0, 'Sb': 2.0}",67.66962964600629,[],NM,False,194,0,"[0, 0, 0, 0]",1.6373667268406452e-06,5.54e-05,0,0.0001108,MP,data/source/MP/cleaned/cifs/MP-mp-2644.cif,False,,data/final/MP/graphs/Co1Sb1-MP-mp-2644.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Cu2Tl1Y1O7,1,0.0,1.0,True,Ba2Cu2Tl1Y1O7,Ba2Cu2Tl1Y1O7,0.0,Cuprate,True,Ba15.385Cu15.385Tl7.692Y7.692O53.84615384615385,Ba-Cu-Tl-Y-O,5,Supercon,Tl1Ba2Y1Cu2O7,MP-mp-654374,Ba2Y1Tl1Cu2O7,Ba-Cu-Tl-Y-O,Ba15.385Cu15.385Tl7.692Y7.692O53.84615384615385,P 4/m m m,tetragonal,3.878228,3.878228,12.810361,data/final/MP/cifs/Ba2Cu2Tl1Y1O7-MP-mp-654374.cif,data/source/MP/raw/cifs/mp-654374.cif,mp-654374,0.0,,2014-05-08 13:13:23,6.955225967854238,10.17188/1272635,"@misc{osti_1272635,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2YTlCu2O7 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1272635"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699646'}},0.0,3.99185235,520.0,-79.5022295,-6.115556115384615,{'tags': ['Thallium(III) yttrium dibarium dicopper oxide']},-79.5022295,-6.115556115384615,-2.216156400384615,['bandstructure'],True,[74163],True,2021-05-12 10:58:51.532000,NM,13,8,mp-654374,oxide,Ba2YTlCu2O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Tl_d', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Tl': 1.0, 'Cu': 2.0, 'O': 7.0}",GGA,mp-654374,"['mp-932671', 'mp-916258', 'mp-931592', 'mp-654374', 'mp-1436144', 'mp-1699646', 'mp-1827635', 'mp-1597270']",0.2426102,"{'Ba': 2.0, 'Y': 1.0, 'Tl': 1.0, 'Cu': 2.0, 'O': 7.0}",192.67618717551863,[],NM,False,123,0,"[0.0, 0.0, 0.0, 0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0012591602706928,0.2426102,0,0.2426102,MP,data/source/MP/cleaned/cifs/MP-mp-654374.cif,False,,data/final/MP/graphs/Ba2Cu2Tl1Y1O7-MP-mp-654374.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ga0.233V0.767,2,0.034,8.0,False,Ga1.864V6.136,Ga2V6,13.3,Other,True,Ga23.3V76.7,Ga-V,2,Supercon,Ga0.233V0.767,MP-mp-22568,V6Ga2,Ga-V,Ga25V75,P m -3 n,cubic,4.789645,4.789645,4.789645,data/final/MP/cifs/Ga0.233V0.767-MP-mp-22568-synth_doped.cif,data/source/MP/raw/cifs/mp-22568.cif,mp-22568,0.0,,2014-02-22 11:36:40,6.726541666276222,10.17188/1198793,"@misc{osti_1198793,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Ga (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198793"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686867'}},0.0,5.67452231,520.0,-61.95244347,-7.74405543375,{'tags': ['Gallium vanadium (1/3)']},-61.95244347,-7.74405543375,-0.1741018756249994,"['xas', 'elasticity', 'bandstructure']",True,"[635643, 635628, 635619, 635634, 104021, 635646, 635604, 635610, 635617, 635624, 635626, 635605, 635631, 635625, 635636, 635603, 104020, 635616, 635607]",True,2021-05-12 10:56:16.728000,FM,8,9,mp-22568,,V3Ga,"{'functional': 'PBE', 'labels': ['V_pv', 'Ga_d'], 'pot_type': 'paw'}","{'V': 3.0, 'Ga': 1.0}",GGA,mp-22568,"['mp-941343', 'mp-941663', 'mp-934924', 'mp-22568', 'mp-1440749', 'mp-1686867', 'mp-1804076', 'mp-1593784', 'mp-1595713']",0.09063635,"{'V': 6.0, 'Ga': 2.0}",109.87780534443452,[],FM,True,131,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.0, -0.0, -0.0]",0.0016497662965852,0.09063635,2,0.1812727,MP,data/source/MP/cleaned/cifs/MP-mp-22568.cif,True,,data/final/MP/graphs/Ga0.233V0.767-MP-mp-22568-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Pd0.51Sb0.49,2,0.02,4.0,False,Pd2.04Sb1.96,Pd2Sb2,1.67,Other,True,Pd51Sb49,Pd-Sb,2,Supercon,Pd0.51Sb0.49,MP-mp-1769,Sb2Pd2,Pd-Sb,Pd50Sb50,P 63/m m c,hexagonal,4.14379200150878,4.14379188,5.681682,data/final/MP/cifs/Pd0.51Sb0.49-MP-mp-1769-synth_doped.cif,data/source/MP/raw/cifs/mp-1769.cif,mp-1769,0.0,,2011-05-12 20:23:42,8.969190247481327,10.17188/1192632,"@misc{osti_1192632,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SbPd (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1192632"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672236'}},0.0,7.23050119,520.0,-20.38401466,-5.096003665,"{'tags': ['Palladium antimony (1/1)', 'Sudburyite', 'Palladium antimony', 'Palladium antimonide (1/1)']}",-20.38401466,-5.096003665,-0.5375621399999995,"['xas', 'elasticity', 'bandstructure']",True,"[648770, 42598, 648779, 42597]",True,2021-05-12 10:56:14.760000,NM,4,8,mp-1769,,SbPd,"{'functional': 'PBE', 'labels': ['Sb', 'Pd'], 'pot_type': 'paw'}","{'Sb': 1.0, 'Pd': 1.0}",GGA,mp-1769,"['mp-924880', 'mp-925511', 'mp-909858', 'mp-1769', 'mp-1439686', 'mp-1672236', 'mp-1802229', 'mp-1586197']",0.0044707,"{'Sb': 2.0, 'Pd': 2.0}",84.4896347968957,[],NM,False,194,0,"[0, 0, 0, 0]",0.0001058283660651,0.0044707,0,0.0089414,MP,data/source/MP/cleaned/cifs/MP-mp-1769.cif,True,,data/final/MP/graphs/Pd0.51Sb0.49-MP-mp-1769-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Rb0.19W1O3.001,3,0.063175669474882,2.99933344440742,False,Rb0.57W2.999O9,Rb1W3O9,5.02,Oxide,True,Rb4.534W23.861O71.60582199952279,Rb-W-O,3,Supercon,Rb0.19W1O3.001,MP-mp-565431,Rb1W3O9,Rb-W-O,Rb7.692W23.077O69.23076923076923,P 6/m m m,hexagonal,3.882989,7.530094003231798,7.530093400000001,data/final/MP/cifs/Rb0.19W1O3.001-MP-mp-565431-synth_doped.cif,data/source/MP/raw/cifs/mp-565431.cif,mp-565431,0.0,,2014-02-23 19:51:49,6.801313653620402,10.17188/1272509,"@misc{osti_1272509,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Rb(WO3)3 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1272509"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-1672885'}},0.0038003846153671,3.17423124,520.0,-93.98226341,-7.229404877692308,{'tags': ['Rubidium tungsten oxide (0.33/1/3)']},-93.98226341,-7.229404877692308,-2.2379000678846164,"['xas', 'bandstructure']",True,[96419],True,2021-05-12 10:57:23.123000,FM,13,15,mp-565431,oxide,Rb(WO3)3,"{'functional': 'PBE', 'labels': ['Rb_sv', 'W_pv', 'O'], 'pot_type': 'paw'}","{'Rb': 1.0, 'W': 3.0, 'O': 9.0}",GGA+U,mp-565431,"['mp-704837', 'mp-932684', 'mp-940813', 'mp-940952', 'mp-565431', 'mp-1179797', 'mp-1192870', 'mp-1414087', 'mp-1427299', 'mp-1672885', 'mp-1670084', 'mp-1833003', 'mp-1609186', 'mp-1605159', 'mp-1984777']",0.8587592,"{'Rb': 1.0, 'W': 3.0, 'O': 9.0}",190.6766621234564,[],FM,True,65,1,"[0.0, 0.4, 0.4, 0.3, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0045037457150575,0.8587592,3,0.8587592,MP,data/source/MP/cleaned/cifs/MP-mp-565431.cif,True,,data/final/MP/graphs/Rb0.19W1O3.001-MP-mp-565431-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
B2C1Dy0.3Ho0.7Ni2,3,0.1,1.0,True,B2C1Dy0.3Ho0.7Ni2,B2C1Ho1Ni2,5.83,Other,True,B33.333C16.667Dy5Ho11.667Ni33.333,B-C-Dy-Ho-Ni,5,Supercon,Ho0.7Dy0.3Ni2B2C1,MP-mp-6646,Ho1Ni2B2C1,B-C-Ho-Ni,B33.333C16.667Ho16.667Ni33.333,I 4/m m m,tetragonal,3.529863997734658,3.529863997734658,5.76032203,data/final/MP/cifs/B2C1Dy0.3Ho0.7Ni2-MP-mp-6646-synth_doped.cif,data/source/MP/raw/cifs/mp-6646.cif,mp-6646,0.0,,2011-05-13 04:24:09,8.11075125231065,10.17188/1281460,"@misc{osti_1281460,
    author = ""Persson, Kristin"",
    title = ""Materials Data on HoNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281460"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1670774'}},0.0,6.70981387,520.0,-41.84364575,-6.973940958333333,{'tags': ['Holmium dinickel diboride carbide']},-41.84364575,-6.973940958333333,-0.5192332130555558,"['xas', 'elasticity', 'bandstructure']",True,"[79064, 56650, 79065, 79062, 79063, 79575]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-6646,,HoNi2B2C,"{'functional': 'PBE', 'labels': ['Ho_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Ho': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6646,"['mp-1007146', 'mp-6646', 'mp-1000682', 'mp-1439301', 'mp-1670774', 'mp-1782657', 'mp-1011887', 'mp-1589032']",0.0032459,"{'Ho': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",64.68537905730652,[],NM,False,139,0,"[0.0, -0.0, -0.0, 0.0, 0.0, 0.0]",5.017980952271099e-05,0.0032459,0,0.0032459,MP,data/source/MP/cleaned/cifs/MP-mp-6646.cif,True,,data/final/MP/graphs/B2C1Dy0.3Ho0.7Ni2-MP-mp-6646-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Cu1La1.95Na0.05O4,2,0.0142857142857142,1.0,True,Cu1La1.95Na0.05O4,Cu1La2O4,0.0,Cuprate,True,Cu14.286La27.857Na0.714O57.142857142857146,Cu-La-Na-O,4,Supercon,La1.95Na0.05Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La1.95Na0.05O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La1.95Na0.05O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ir1,1,0.0,2.0,False,Ir2,Ir2,0.091333333,Other,True,Ir100,Ir,1,Supercon,Ir1,MP-mp-1060567,Ir2,Ir,Ir100,P m m a,orthorhombic,2.280203,7.194537,12.242584,data/final/MP/cifs/Ir1-MP-mp-1060567.cif,data/source/MP/raw/cifs/mp-1060567.cif,mp-1060567,0.0,,2018-03-20 09:12:58,3.1784942655438524,,,{'GGA': {'task_id': 'mp-1695811'}},3.7809085499999977,-3.49844869,520.0,-10.11504374,-5.05752187,{'tags': ['Tricarbonyliridium(I) chloride']},-10.11504374,-5.05752187,3.78090855,['bandstructure'],True,[201258],True,2021-05-12 10:58:12.772000,FM,2,8,mp-1060567,,Ir,"{'functional': 'PBE', 'labels': ['Ir'], 'pot_type': 'paw'}",{'Ir': 1.0},GGA,mp-1060567,"['mp-1060567', 'mp-1060622', 'mp-1060834', 'mp-1420236', 'mp-1695811', 'mp-1833598', 'mp-1588165', 'mp-1060824']",0.6703876,{'Ir': 2.0},200.8396499089097,[],FM,True,51,1,"[0.6, 0.6]",0.0066758491194746,0.6703876,2,1.3407752,MP,data/source/MP/cleaned/cifs/MP-mp-1060567.cif,False,,data/final/MP/graphs/Ir1-MP-mp-1060567.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ge3Ni1Y1,1,0.0,2.0,False,Ge6Ni2Y2,Ge6Ni2Y2,0.46,Other,True,Ge60Ni20Y20,Ge-Ni-Y,3,Supercon,Y1Ni1Ge3,MP-mp-8467,Y2Ni2Ge6,Ge-Ni-Y,Ge60Ni20Y20,C m m m,orthorhombic,4.095765,4.112335998446878,11.04454666,data/final/MP/cifs/Ge3Ni1Y1-MP-mp-8467.cif,data/source/MP/raw/cifs/mp-8467.cif,mp-8467,0.0,,2011-06-05 00:50:41,6.641673942179135,10.17188/1308120,"@misc{osti_1308120,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YNiGe3 (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1308120"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678586'}},0.0,6.39977457,520.0,-58.02276762,-5.802276762,{'tags': ['Yttrium nickel germanide (1/1/3)']},-58.02276762,-5.802276762,-0.5791384903333338,['bandstructure'],True,[60646],True,2021-05-12 10:59:07.834000,NM,10,8,mp-8467,,YNiGe3,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ni_pv', 'Ge_d'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ni': 1.0, 'Ge': 3.0}",GGA,mp-8467,"['mp-922131', 'mp-907715', 'mp-8467', 'mp-922302', 'mp-1300588', 'mp-1678586', 'mp-1830903', 'mp-1598214']",0.0002336,"{'Y': 2.0, 'Ni': 2.0, 'Ge': 6.0}",182.77289716519527,[],NM,False,65,0,"[0.0, 0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",2.556177678672629e-06,0.0002336,0,0.0004672,MP,data/source/MP/cleaned/cifs/MP-mp-8467.cif,False,,data/final/MP/graphs/Ge3Ni1Y1-MP-mp-8467.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Bi2Ca1Cu1.96Fe0.04Sr2O8,2,0.0053333333333333,2.0,False,Bi4Ca2Cu3.92Fe0.08Sr4O16,Bi4Ca2Cu4Sr4O16,65.7,Cuprate,True,Bi13.333Ca6.667Cu13.067Fe0.267Sr13.333O53.333333333333336,Bi-Ca-Cu-Fe-Sr-O,6,Supercon,Bi2Sr2Ca1Cu1.96Fe0.04O8,MP-mp-1218930,Sr4Ca2Cu4Bi4O16,Bi-Ca-Cu-Sr-O,Bi13.333Ca6.667Cu13.333Sr13.333O53.333333333333336,C c c 2,orthorhombic,5.417115,5.472898000129128,16.11398919,data/final/MP/cifs/Bi2Ca1Cu1.96Fe0.04Sr2O8-MP-mp-1218930-synth_doped.cif,data/source/MP/raw/cifs/mp-1218930.cif,mp-1218930,0.0,,2019-01-12 20:01:06.544000,6.266668983881059,,,,0.039252223722225,4.51768334,520.0,-173.15021002,-5.771673667333333,{'tags': []},-173.15021002,-5.771673667333333,-2.074956548222222,[],False,[],True,2021-05-12 11:00:42.526000,NM,30,3,mp-1218930,oxide,Sr2CaCu2(BiO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",GGA,mp-1218930,"['mp-1218930', 'mp-1359698', 'mp-1817714']",0.00011165,"{'Sr': 4.0, 'Ca': 2.0, 'Cu': 4.0, 'Bi': 4.0, 'O': 16.0}",470.7976286073367,[],NM,False,37,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.743014544498498e-07,0.00011165,0,0.0002233,MP,data/source/MP/cleaned/cifs/MP-mp-1218930.cif,True,,data/final/MP/graphs/Bi2Ca1Cu1.96Fe0.04Sr2O8-MP-mp-1218930-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
La0.84Mo6Se8,2,0.020125786163522,1.0,True,La0.84Mo6Se8,La1Mo6Se8,9.4,Chevrel,True,La5.66Mo40.431Se53.908,La-Mo-Se,3,Supercon,La0.84Mo6Se8,MP-mp-37784,La1Mo6Se8,La-Mo-Se,La6.667Mo40Se53.333,R -3,trigonal,6.84882661,6.84882661,6.84882641,data/final/MP/cifs/La0.84Mo6Se8-MP-mp-37784-synth_doped.cif,data/source/MP/raw/cifs/mp-37784.cif,mp-37784,0.0,,2013-11-13 11:12:22,6.964358050864285,,,{'GGA': {'task_id': 'mp-1669492'}},0.0265230636249986,5.68236385,520.0,-109.21685909,-7.281123939333333,"{'tags': ['Lanthanum molybdenum(II/III) selenide (1/6/8)', 'Lanthanum molybdenum selenide (1/6/8)', 'Lanthanum molybdenum(II/III) selenide  (1/6/8)']}",-109.21685909,-7.281123939333333,-1.001046798916666,"['xas', 'bandstructure']",True,"[641459, 641461, 600706, 600656]",True,2021-05-12 10:57:34.594000,FM,15,11,mp-37784,,La(Mo3Se4)2,"{'functional': 'PBE', 'labels': ['La', 'Mo_pv', 'Se'], 'pot_type': 'paw'}","{'La': 1.0, 'Mo': 6.0, 'Se': 8.0}",GGA,mp-37784,"['mp-948248', 'mp-676259', 'mp-949023', 'mp-937946', 'mp-1104045', 'mp-1104421', 'mp-37784', 'mp-1413507', 'mp-1669492', 'mp-1810114', 'mp-1598006']",0.6990221,"{'La': 1.0, 'Mo': 6.0, 'Se': 8.0}",320.98579209458114,[],FM,True,148,1,"[0.0, 0.1, 0.1, 0.1, 0.1, 0.1, 0.1, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0021777353303975,0.6990221,6,0.6990221,MP,data/source/MP/cleaned/cifs/MP-mp-37784.cif,True,,data/final/MP/graphs/La0.84Mo6Se8-MP-mp-37784-synth_doped.json,0,True,-3,0,0,0,0,0,0,2,1,0,0,0,1.0,False
Bi1.3K0.7O3,3,0.12,1.0,True,Bi1.3K0.7O3,Bi1K1O3,0.0,Oxide,True,Bi26K14O60,Bi-K-O,3,Supercon,K0.7Bi1.3O3,MP-mp-982040,K1Bi1O3,Bi-K-O,Bi20K20O60,P m -3 m,cubic,4.284204,4.284204,4.284204,data/final/MP/cifs/Bi1.3K0.7O3-MP-mp-982040-synth_doped.cif,data/source/MP/raw/cifs/mp-982040.cif,mp-982040,0.0,,2015-10-12 11:25:13,6.252348761231978,10.17188/1316390,"@misc{osti_1316390,
    author = ""Persson, Kristin"",
    title = ""Materials Data on KBiO3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1316390"",
    place = ""United States"",
    year = ""2016"",
    month = ""9"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1717462'}},0.0928686834999998,1.80216133,520.0,-25.20286901,-5.040573802,{'tags': []},-25.20286901,-5.040573802,-1.4839105476,"['xas', 'elasticity']",False,[],True,2021-05-12 10:56:37.246000,NM,5,9,mp-982040,oxide,KBiO3,"{'functional': 'PBE', 'labels': ['K_sv', 'Bi', 'O'], 'pot_type': 'paw'}","{'K': 1.0, 'Bi': 1.0, 'O': 3.0}",GGA,mp-982040,"['mp-982222', 'mp-1006156', 'mp-982040', 'mp-1006117', 'mp-1431172', 'mp-1717462', 'mp-1798749', 'mp-1011221', 'mp-1585048']",0.0005425,"{'K': 1.0, 'Bi': 1.0, 'O': 3.0}",78.63401066432932,[],NM,False,221,0,"[0, 0, 0, 0, 0]",6.899050365315956e-06,0.0005425,0,0.0005425,MP,data/source/MP/cleaned/cifs/MP-mp-982040.cif,True,,data/final/MP/graphs/Bi1.3K0.7O3-MP-mp-982040-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Cu1.2La1Sr1Tl0.8O5,3,0.0444444444444444,1.0,True,Cu1.2La1Sr1Tl0.8O5,Cu1La1Sr1Tl1O5,37.0,Cuprate,True,Cu13.333La11.111Sr11.111Tl8.889O55.55555555555556,Cu-La-Sr-Tl-O,5,Supercon,Tl0.8La1Sr1Cu1.2O5,MP-mp-1218170,Sr1La1Tl1Cu1O5,Cu-La-Sr-Tl-O,Cu11.111La11.111Sr11.111Tl11.111O55.55555555555556,P 4 m m,tetragonal,3.808314,3.808314,8.940218,data/final/MP/cifs/Cu1.2La1Sr1Tl0.8O5-MP-mp-1218170-synth_doped.cif,data/source/MP/raw/cifs/mp-1218170.cif,mp-1218170,0.0,,2019-01-12 19:23:00.047000,7.356801903811997,,,{'GGA': {'task_id': 'mp-1751231'}},0.0235770105555133,5.93274247,520.0,-55.01092809,-6.1123253433333335,{'tags': []},-55.01092809,-6.1123253433333335,-2.2909747433333343,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,9,5,mp-1218170,oxide,SrLaTlCuO5,"{'functional': 'PBE', 'labels': ['Sr_sv', 'La', 'Tl_d', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 1.0, 'La': 1.0, 'Tl': 1.0, 'Cu': 1.0, 'O': 5.0}",GGA,mp-1218170,"['mp-1218170', 'mp-1444406', 'mp-1751231', 'mp-1787322', 'mp-1618863']",0.0033628,"{'Sr': 1.0, 'La': 1.0, 'Tl': 1.0, 'Cu': 1.0, 'O': 5.0}",129.66226608171218,[],NM,False,99,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",2.593507040730561e-05,0.0033628,0,0.0033628,MP,data/source/MP/cleaned/cifs/MP-mp-1218170.cif,True,,data/final/MP/graphs/Cu1.2La1Sr1Tl0.8O5-MP-mp-1218170-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
Ir2La1Si2,1,0.0,1.0,True,Ir2La1Si2,Ir2La1Si2,1.198333333,Other,True,Ir40La20Si40,Ir-La-Si,3,Supercon,La1Ir2Si2,MP-mp-3585,La1Si2Ir2,Ir-La-Si,Ir40La20Si40,I 4/m m m,tetragonal,4.146200002948095,4.146200002948095,5.95163608,data/final/MP/cifs/Ir2La1Si2-MP-mp-3585.cif,data/source/MP/raw/cifs/mp-3585.cif,mp-3585,0.0,,2011-05-12 22:28:24,10.807568715981123,10.17188/1207087,"@misc{osti_1207087,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La(SiIr)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207087"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1674298'}},0.0,9.62972706,520.0,-38.74108021,-7.748216042,"{'tags': ['Lanthanum iridium silicide (1/2/2)', 'Iridium lanthanum silicide (2/1/2)']}",-38.74108021,-7.748216042,-1.027116844999999,"['xas', 'bandstructure']",True,"[604622, 188328, 640763, 44657]",True,2021-05-12 10:57:06.958000,NM,5,14,mp-3585,,La(SiIr)2,"{'functional': 'PBE', 'labels': ['La', 'Si', 'Ir'], 'pot_type': 'paw'}","{'La': 1.0, 'Si': 2.0, 'Ir': 2.0}",GGA,mp-3585,"['mp-1000819', 'mp-1007273', 'mp-3585', 'mp-1069325', 'mp-1069301', 'mp-1069373', 'mp-1125125', 'mp-1136273', 'mp-1437966', 'mp-1674298', 'mp-1866125', 'mp-1012011', 'mp-1591170', 'mp-1069362']",0.0046791,"{'La': 1.0, 'Si': 2.0, 'Ir': 2.0}",89.03943155279477,[],NM,False,139,0,"[0, 0, 0, 0, 0]",5.255087457769302e-05,0.0046791,0,0.0046791,MP,data/source/MP/cleaned/cifs/MP-mp-3585.cif,False,,data/final/MP/graphs/Ir2La1Si2-MP-mp-3585.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Fe0.06Si1V2.94,2,0.03,2.0,False,Fe0.12Si2V5.88,Si2V6,13.4,Other,True,Fe1.5Si25V73.5,Fe-Si-V,3,Supercon,V2.94Fe0.06Si1,MP-mp-2567,V6Si2,Si-V,Si25V75,P m -3 n,cubic,4.702381,4.702381,4.702381,data/final/MP/cifs/Fe0.06Si1V2.94-MP-mp-2567-synth_doped.cif,data/source/MP/raw/cifs/mp-2567.cif,mp-2567,0.0,,2011-05-13 19:15:43,5.778142190030859,10.17188/1200874,"@misc{osti_1200874,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Si (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1200874"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668672'}},0.0,7.30599425,520.0,-69.05773321,-8.63221665125,{'tags': ['Vanadium silicide (3/1)']},-69.05773321,-8.63221665125,-0.4452085937499994,"['xas', 'elasticity', 'bandstructure']",True,"[652491, 87328, 652522, 652502, 652510, 652520, 600518, 186003, 652507, 652513, 652497, 601150, 652514, 652487, 22412, 652509, 652529, 652532, 652499, 652539, 652537, 652533, 652512, 652538, 652490, 652493, 652494, 652511, 652519, 87329, 652526, 652500]",True,2021-05-12 10:56:18.721000,FM,8,13,mp-2567,,V3Si,"{'functional': 'PBE', 'labels': ['V_pv', 'Si'], 'pot_type': 'paw'}","{'V': 3.0, 'Si': 1.0}",GGA,mp-2567,"['mp-920081', 'mp-906309', 'mp-919083', 'mp-2567', 'mp-1078474', 'mp-1078852', 'mp-1138781', 'mp-1145907', 'mp-1440678', 'mp-1668672', 'mp-1795955', 'mp-1593554', 'mp-1596575']",0.8382519,"{'V': 6.0, 'Si': 2.0}",103.98086881866836,[],FM,True,131,1,"[0.2, 0.3, 0.3, 0.2, 0.3, 0.3, 0.0, 0.0]",0.0161231947669493,0.8382519,6,1.6765038,MP,data/source/MP/cleaned/cifs/MP-mp-2567.cif,True,,data/final/MP/graphs/Fe0.06Si1V2.94-MP-mp-2567-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Rh24Zr76,2,0.02,0.1578848684210526,False,Rh3.789Zr12,Rh4Zr12,3.67,Other,True,Rh24Zr76,Rh-Zr,2,Supercon,Rh24Zr76,MP-mp-1188413,Zr12Rh4,Rh-Zr,Rh25Zr75,I -4 2 m,tetragonal,5.750105997369286,8.133162878649543,8.13316288,data/final/MP/cifs/Rh24Zr76-MP-mp-1188413-synth_doped.cif,data/source/MP/raw/cifs/mp-1188413.cif,mp-1188413,0.0,,2019-01-11 19:25:26.786000,7.515208089275875,,,{'GGA': {'task_id': 'mp-1708881'}},0.0,4.73652502,520.0,-138.70039462,-8.66877466375,{'tags': []},-138.70039462,-8.66877466375,-0.4169222237500012,['bandstructure'],True,[],True,2021-05-12 10:58:31.620000,NM,16,5,mp-1188413,,Zr3Rh,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Rh_pv'], 'pot_type': 'paw'}","{'Zr': 3.0, 'Rh': 1.0}",GGA,mp-1188413,"['mp-1188413', 'mp-1426452', 'mp-1708881', 'mp-1811428', 'mp-1604423']",0.05184475,"{'Zr': 12.0, 'Rh': 4.0}",332.82998576972955,[],NM,False,121,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0006230778741897,0.05184475,0,0.207379,MP,data/source/MP/cleaned/cifs/MP-mp-1188413.cif,True,,data/final/MP/graphs/Rh24Zr76-MP-mp-1188413-synth_doped.json,0,True,-42m,0,0,0,0,6,0,0,0,0,1,0,1.0,False
B4Ir4Lu0.4Y0.6,2,0.0222222222222222,2.0,False,B8Ir8Lu0.8Y1.2,B8Ir8Lu1Y1,3.06,Other,True,B44.444Ir44.444Lu4.444Y6.667,B-Ir-Lu-Y,4,Supercon,Y0.6Lu0.4Ir4B4,MP-mp-1215947,Y1Lu1B8Ir8,B-Ir-Lu-Y,B44.444Ir44.444Lu5.556Y5.556,P -4 m 2,tetragonal,5.397527,5.397527,7.454301,data/final/MP/cifs/B4Ir4Lu0.4Y0.6-MP-mp-1215947-synth_doped.cif,data/source/MP/raw/cifs/mp-1215947.cif,mp-1215947,0.0,,2019-01-12 17:32:34.719000,14.436994561781765,,,,0.0267232327777815,8.34985726,520.0,-144.25774255,-8.014319030555555,{'tags': []},-144.25774255,-8.014319030555555,-0.5070968549999988,[],False,[],True,2021-05-12 11:00:37.845000,NM,18,3,mp-1215947,,YLu(BIr)8,"{'functional': 'PBE', 'labels': ['Y_sv', 'Lu_3', 'B', 'Ir'], 'pot_type': 'paw'}","{'Y': 1.0, 'Lu': 1.0, 'B': 8.0, 'Ir': 8.0}",GGA,mp-1215947,"['mp-1215947', 'mp-1367845', 'mp-1830201']",5.13e-05,"{'Y': 1.0, 'Lu': 1.0, 'B': 8.0, 'Ir': 8.0}",217.1683702956564,[],NM,False,115,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.3622224511865785e-07,5.13e-05,0,5.13e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1215947.cif,True,,data/final/MP/graphs/B4Ir4Lu0.4Y0.6-MP-mp-1215947-synth_doped.json,0,True,-42m,0,0,0,0,6,0,0,1,0,0,0,1.0,False
Au2Pb1,1,0.0,2.0,False,Au4Pb2,Au4Pb2,2.6575,Other,True,Au66.667Pb33.333,Au-Pb,2,Supercon,Au2Pb1,MP-mp-19871,Pb2Au4,Au-Pb,Au66.667Pb33.333,F d -3 m,cubic,5.7539089,5.753908899999999,5.753908899999999,data/final/MP/cifs/Au2Pb1-MP-mp-19871.cif,data/source/MP/raw/cifs/mp-19871.cif,mp-19871,0.0,,2014-02-21 13:01:06,14.8209422929245,10.17188/1195061,"@misc{osti_1195061,
    author = ""Persson, Kristin"",
    title = ""Materials Data on PbAu2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195061"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696374'}},0.0,5.7258389,520.0,-20.94947419,-3.491579031666667,"{'tags': ['Hunchunite', 'Lead auride (1/2)']}",-20.94947419,-3.491579031666667,-0.0714423149999999,"['xas', 'elasticity', 'bandstructure']",True,[56261],True,2021-05-12 10:56:14.760000,NM,6,8,mp-19871,,PbAu2,"{'functional': 'PBE', 'labels': ['Pb_d', 'Au'], 'pot_type': 'paw'}","{'Pb': 1.0, 'Au': 2.0}",GGA,mp-19871,"['mp-912280', 'mp-928835', 'mp-928320', 'mp-19871', 'mp-1434278', 'mp-1696374', 'mp-1779395', 'mp-1595271']",2.805e-05,"{'Pb': 2.0, 'Au': 4.0}",134.70196970585204,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",4.16474978966568e-07,2.805e-05,0,5.61e-05,MP,data/source/MP/cleaned/cifs/MP-mp-19871.cif,False,,data/final/MP/graphs/Au2Pb1-MP-mp-19871.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
C3Sc4,1,0.0,2.0,False,C6Sc8,C6Sc8,0.0,Other,True,C42.857Sc57.143,C-Sc,2,Supercon,C3Sc4,MP-mp-15661,Sc8C6,C-Sc,C42.857Sc57.143,I -4 3 d,cubic,6.258228661387351,6.25822866,6.25822866,data/final/MP/cifs/C3Sc4-MP-mp-15661.cif,data/source/MP/raw/cifs/mp-15661.cif,mp-15661,0.4656000000000002,,2011-06-03 01:44:36,3.799358904962551,10.17188/1191308,"@misc{osti_1191308,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sc4C3 (SG:220) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191308"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695041'}},0.0,5.49276066,520.0,-112.8174614,-8.0583901,{'tags': ['Scandium carbide (4/3)']},-112.8174614,-8.0583901,-0.4855017399999986,"['piezo', 'xas', 'bandstructure', 'diel', 'elasticity']",True,[42760],True,2021-05-12 10:56:12.755000,NM,14,10,mp-15661,,Sc4C3,"{'functional': 'PBE', 'labels': ['Sc_sv', 'C'], 'pot_type': 'paw'}","{'Sc': 4.0, 'C': 3.0}",GGA,mp-15661,"['mp-690177', 'mp-680037', 'mp-15661', 'mp-1116861', 'mp-1141252', 'mp-1421980', 'mp-1695041', 'mp-1851635', 'mp-1607547', 'mp-690323']",0.0,"{'Sc': 8.0, 'C': 6.0}",188.68283374649903,[],NM,False,220,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0,0.0,0,0.0,MP,data/source/MP/cleaned/cifs/MP-mp-15661.cif,False,,data/final/MP/graphs/C3Sc4-MP-mp-15661.json,0,True,-43m,5,0,0,0,0,0,0,0,0,1,0,1.0,False
Co1Ge2,1,0.0,4.0,False,Co4Ge8,Co4Ge8,0.0,Other,True,Co33.333Ge66.667,Co-Ge,2,Supercon,Co1Ge2,MP-mp-30045,Co4Ge8,Co-Ge,Co33.333Ge66.667,C m c a,orthorhombic,5.674990002713252,6.15815487,5.676778,data/final/MP/cifs/Co1Ge2-MP-mp-30045.cif,data/source/MP/raw/cifs/mp-30045.cif,mp-30045,0.0,,2014-02-25 23:15:23,7.703665360774801,10.17188/1204475,"@misc{osti_1204475,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CoGe2 (SG:64) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1204475"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697858'}},0.0,5.0456163,520.0,-67.25531267,-5.604609389166666,{'tags': ['Cobalt germanide (1/2)']},-67.25531267,-5.604609389166666,-0.1531515541666669,"['xas', 'elasticity', 'bandstructure']",True,[52964],True,2021-05-12 10:56:18.721000,NM,12,9,mp-30045,,CoGe2,"{'functional': 'PBE', 'labels': ['Co', 'Ge_d'], 'pot_type': 'paw'}","{'Co': 1.0, 'Ge': 2.0}",GGA,mp-30045,"['mp-911159', 'mp-927682', 'mp-927273', 'mp-30045', 'mp-505763', 'mp-1435873', 'mp-1697858', 'mp-1789889', 'mp-1600282']",0.0003406,"{'Co': 4.0, 'Ge': 8.0}",176.07410100617253,[],NM,False,64,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",7.737651319612526e-06,0.0003406,0,0.0013624,MP,data/source/MP/cleaned/cifs/MP-mp-30045.cif,False,,data/final/MP/graphs/Co1Ge2-MP-mp-30045.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
I2,1,0.0,2.0,False,I4,I4,1.2,Other,True,I100,I,1,Supercon,I2,MP-mp-23153,I4,I,I100,C m c a,orthorhombic,4.603332003186656,5.11727078,9.832479,data/final/MP/cifs/I2-MP-mp-23153.cif,data/source/MP/raw/cifs/mp-23153.cif,mp-23153,1.0496,,2013-09-21 18:24:07,4.074684630977836,10.17188/1199273,"@misc{osti_1199273,
    author = ""Persson, Kristin"",
    title = ""Materials Data on I (SG:64) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199273"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686881'}},0.0,1.00649063,520.0,-6.09605046,-1.524012615,"{'tags': ['High pressure experimental phase', 'Iodine', 'Diiodine']}",-6.09605046,-1.524012615,0.0,"['eos', 'bandstructure', 'xas', 'diel', 'elasticity']",True,"[194468, 20329, 657497, 15318, 67616, 67618, 67706, 24009, 10084, 67614, 67705, 67615, 426946, 67613, 67704, 67617, 67612]",True,2021-05-12 10:56:16.728000,NM,4,79,mp-23153,,I,"{'functional': 'PBE', 'labels': ['I'], 'pot_type': 'paw'}",{'I': 1.0},GGA,mp-23153,"['mp-656758', 'mp-655266', 'mp-1018058', 'mp-658015', 'mp-23153', 'mp-1063623', 'mp-1063598', 'mp-1063582', 'mp-1064051', 'mp-1064036', 'mp-1064066', 'mp-1064167', 'mp-1064177', 'mp-1064195', 'mp-1064302', 'mp-1064313', 'mp-1064346', 'mp-1064754', 'mp-1064774', 'mp-1064797', 'mp-1065304', 'mp-1065297', 'mp-1065314', 'mp-1066027', 'mp-1066003', 'mp-1066015', 'mp-1066031', 'mp-1066064', 'mp-1066044', 'mp-1066498', 'mp-1066509', 'mp-1066520', 'mp-1066958', 'mp-1066941', 'mp-1066930', 'mp-1067333', 'mp-1067439', 'mp-1067427', 'mp-1067457', 'mp-1067233', 'mp-1067524', 'mp-1067510', 'mp-1067529', 'mp-1067557', 'mp-1067553', 'mp-1067571', 'mp-1067267', 'mp-1067606', 'mp-1067617', 'mp-1067641', 'mp-1067289', 'mp-1067298', 'mp-1067309', 'mp-1067751', 'mp-1067762', 'mp-1067784', 'mp-1140061', 'mp-1440922', 'mp-1686881', 'mp-1784614', 'mp-1588675', 'mp-1591191', 'mp-1066956', 'mp-1067567', 'mp-1066519', 'mp-1066025', 'mp-1065319', 'mp-1066069', 'mp-1067452', 'mp-1064795', 'mp-1067286', 'mp-1067548', 'mp-1067329', 'mp-1064063', 'mp-1067638', 'mp-1067778', 'mp-1064192', 'mp-1064340', 'mp-1063622']",0.00039505,{'I': 4.0},206.8673767379117,[],NM,False,64,0,"[0, 0, 0, 0]",7.638710486487276e-06,0.00039505,0,0.0015802,MP,data/source/MP/cleaned/cifs/MP-mp-23153.cif,False,,data/final/MP/graphs/I2-MP-mp-23153.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Cu0.8Ir2S4Zn0.2,3,0.0571428571428571,2.0,False,Cu1.6Ir4S8Zn0.4,Cu2Ir4S8,3.32,Other,True,Cu11.429Ir28.571S57.143Zn2.857,Cu-Ir-S-Zn,4,Supercon,Cu0.8Zn0.2Ir2S4,MP-mp-15065,Cu2Ir4S8,Cu-Ir-S,Cu14.286Ir28.571S57.143,F d -3 m,cubic,7.0146421,7.014642099999999,7.0146421,data/final/MP/cifs/Cu0.8Ir2S4Zn0.2-MP-mp-15065-synth_doped.cif,data/source/MP/raw/cifs/mp-15065.cif,mp-15065,0.0,,2011-06-03 14:22:46,7.841171261871164,10.17188/1191009,"@misc{osti_1191009,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Cu(IrS2)2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191009"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703593'}},0.0,5.93564872,520.0,-81.88317445,-5.848798175,"{'tags': ['Cuproiridsite', 'Copper tetrathiodiiridate(III)']}",-81.88317445,-5.848798175,-0.6616743210714284,"['xas', 'bandstructure']",True,[75531],True,2021-05-12 10:56:53.126000,NM,14,11,mp-15065,,Cu(IrS2)2,"{'functional': 'PBE', 'labels': ['Cu_pv', 'Ir', 'S'], 'pot_type': 'paw'}","{'Cu': 1.0, 'Ir': 2.0, 'S': 4.0}",GGA,mp-15065,"['mp-923885', 'mp-924531', 'mp-908944', 'mp-22362', 'mp-15065', 'mp-1104143', 'mp-1104190', 'mp-1419385', 'mp-1703593', 'mp-1882020', 'mp-1598621']",0.00084405,"{'Cu': 2.0, 'Ir': 4.0, 'S': 8.0}",244.06278087318373,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.916662974831648e-06,0.00084405,0,0.0016881,MP,data/source/MP/cleaned/cifs/MP-mp-15065.cif,True,,data/final/MP/graphs/Cu0.8Ir2S4Zn0.2-MP-mp-15065-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ba1.7Cu3Nd1.3O7,3,0.0461538461538461,1.0,True,Ba1.7Cu3Nd1.3O7,Ba2Cu3Nd1O7,69.0,Cuprate,True,Ba13.077Cu23.077Nd10O53.84615384615385,Ba-Cu-Nd-O,4,Supercon,Nd1.3Ba1.7Cu3O7,MP-mp-22719,Ba2Nd1Cu3O7,Ba-Cu-Nd-O,Ba15.385Cu23.077Nd7.692O53.84615384615385,P m m m,orthorhombic,3.893817,3.958458,11.89947,data/final/MP/cifs/Ba1.7Cu3Nd1.3O7-MP-mp-22719-synth_doped.cif,data/source/MP/raw/cifs/mp-22719.cif,mp-22719,0.0,,2015-01-22 21:32:23,6.532421108031168,10.17188/1198922,"@misc{osti_1198922,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2NdCu3O7 (SG:47) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198922"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704234'}},0.0180149053205083,3.13221275,520.0,-78.75337907,-6.057952236153846,"{'tags': ['Neodymium barium copper oxide (1/2/3/7)', 'Neodymium dibarium tricopper heptaoxide']}",-78.75337907,-6.057952236153846,-2.155611319615384,"['bandstructure', 'elasticity']",True,"[86960, 81169]",True,2021-05-12 10:56:16.728000,NM,13,8,mp-22719,oxide,Ba2NdCu3O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Nd_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Nd': 1.0, 'Cu': 3.0, 'O': 7.0}",GGA,mp-22719,"['mp-926068', 'mp-925655', 'mp-917559', 'mp-1427130', 'mp-1704234', 'mp-1829984', 'mp-1600543', 'mp-22719']",0.0444215,"{'Ba': 2.0, 'Nd': 1.0, 'Cu': 3.0, 'O': 7.0}",183.4126123839547,[],NM,False,47,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0002421943585155,0.0444215,0,0.0444215,MP,data/source/MP/cleaned/cifs/MP-mp-22719.cif,True,,data/final/MP/graphs/Ba1.7Cu3Nd1.3O7-MP-mp-22719-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
C0.98Mg0.9Ni3Zn0.1,2,0.0449799196787149,1.0,True,C0.98Mg0.9Ni3Zn0.1,C1Mg1Ni3,4.5,Other,True,C19.679Mg18.072Ni60.241Zn2.008,C-Mg-Ni-Zn,4,Supercon,Mg0.9Zn0.1C0.98Ni3,MP-mp-10700,Mg1Ni3C1,C-Mg-Ni,C20Mg20Ni60,P m -3 m,cubic,3.810209,3.810209,3.810209,data/final/MP/cifs/C0.98Mg0.9Ni3Zn0.1-MP-mp-10700-synth_doped.cif,data/source/MP/raw/cifs/mp-10700.cif,mp-10700,0.0,,2011-05-28 10:04:44,6.376007671789427,10.17188/1187303,"@misc{osti_1187303,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MgNi3C (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187303"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678621'}},0.0,6.64260176,520.0,-28.85099542,-5.770199084,{'tags': ['Magnesium nickel carbide (1/3/1)']},-28.85099542,-5.770199084,-0.1367049259999994,"['xas', 'elasticity', 'bandstructure']",True,[77152],True,2021-05-12 10:56:10.715000,NM,5,8,mp-10700,,MgNi3C,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Ni_pv', 'C'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",GGA,mp-10700,"['mp-927245', 'mp-927653', 'mp-911184', 'mp-10700', 'mp-1438083', 'mp-1678621', 'mp-1791467', 'mp-1591421']",0.0387875,"{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",55.31544309398296,[],NM,False,221,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",0.0007012056277683,0.0387875,0,0.0387875,MP,data/source/MP/cleaned/cifs/MP-mp-10700.cif,True,,data/final/MP/graphs/C0.98Mg0.9Ni3Zn0.1-MP-mp-10700-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ce1Cu2Eu1Ru1Sr2O10,1,0.0,1.0,True,Ce1Cu2Eu1Ru1Sr2O10,Ce1Cu2Eu1Ru1Sr2O10,0.0,Cuprate,True,Ce5.882Cu11.765Eu5.882Ru5.882Sr11.765O58.82352941176471,Ce-Cu-Eu-Ru-Sr-O,6,Supercon,Eu1Ce1Sr2Ru1Cu2O10,MP-mp-1218883,Sr2Ce1Eu1Cu2Ru1O10,Ce-Cu-Eu-Ru-Sr-O,Ce5.882Cu11.765Eu5.882Ru5.882Sr11.765O58.82352941176471,C 1 m 1,monoclinic,3.89765054,3.89765054,14.72856415,data/final/MP/cifs/Ce1Cu2Eu1Ru1Sr2O10-MP-mp-1218883.cif,data/source/MP/raw/cifs/mp-1218883.cif,mp-1218883,0.0,,2019-01-12 19:58:44.354000,6.461952007932866,,,,0.0307225061764704,4.2426979,520.0,-121.19651369,-7.129206687647059,{'tags': []},-121.19651369,-7.129206687647059,-2.441763594607844,[],False,[],True,2021-05-12 11:00:42.526000,FiM,17,2,mp-1218883,oxide,Sr2CeEuCu2RuO10,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ce', 'Eu', 'Cu_pv', 'Ru_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ce': 1.0, 'Eu': 1.0, 'Cu': 2.0, 'Ru': 1.0, 'O': 10.0}",GGA,mp-1218883,"['mp-1218883', 'mp-1331028']",3.9050614,"{'Sr': 2.0, 'Ce': 1.0, 'Eu': 1.0, 'Cu': 2.0, 'Ru': 1.0, 'O': 10.0}",219.83315827706463,[],FiM,True,8,5,"[-0.0, -0.0, 0.1, 6.3, -0.1, -0.1, -1.2, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0177637506125363,3.9050614,5,3.9050614,MP,data/source/MP/cleaned/cifs/MP-mp-1218883.cif,False,,data/final/MP/graphs/Ce1Cu2Eu1Ru1Sr2O10-MP-mp-1218883.json,0,True,m,0,0,5,0,0,0,0,0,1,0,0,1.0,False
Al0.6Ge0.4Nb3,2,0.0499999999999999,2.0,False,Al1.2Ge0.8Nb6,Al1Ge1Nb6,19.7,Other,True,Al15Ge10Nb75,Al-Ge-Nb,3,Supercon,Nb3Al0.6Ge0.4,MP-mp-1220344,Nb6Al1Ge1,Al-Ge-Nb,Al12.5Ge12.5Nb75,P m -3,cubic,5.193789,5.193789,5.193789,data/final/MP/cifs/Al0.6Ge0.4Nb3-MP-mp-1220344-synth_doped.cif,data/source/MP/raw/cifs/mp-1220344.cif,mp-1220344,0.0,,2019-01-12 21:12:22.670000,7.787554520755366,,,{'GGA': {'task_id': 'mp-1754189'}},0.0456705447083347,5.7081774,520.0,-70.77042247,-8.84630280875,{'tags': []},-70.77042247,-8.84630280875,-0.2242485681249988,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,8,5,mp-1220344,,Nb6AlGe,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al', 'Ge_d'], 'pot_type': 'paw'}","{'Nb': 6.0, 'Al': 1.0, 'Ge': 1.0}",GGA,mp-1220344,"['mp-1220344', 'mp-1388432', 'mp-1754189', 'mp-1925908', 'mp-1619029']",0.0004952,"{'Nb': 6.0, 'Al': 1.0, 'Ge': 1.0}",140.10476523412882,[],NM,False,200,0,"[0, 0, 0, 0, 0, 0, 0, 0]",3.534497910706122e-06,0.0004952,0,0.0004952,MP,data/source/MP/cleaned/cifs/MP-mp-1220344.cif,True,,data/final/MP/graphs/Al0.6Ge0.4Nb3-MP-mp-1220344-synth_doped.json,0,True,m-3,2,0,0,0,0,0,0,1,0,0,0,1.0,False
Au2Ce1Si2,1,0.0,1.0,True,Au2Ce1Si2,Au2Ce1Si2,2.051666667,Heavy_fermion,True,Au40Ce20Si40,Au-Ce-Si,3,Supercon,Ce1Au2Si2,MP-mp-5173,Ce1Si2Au2,Au-Ce-Si,Au40Ce20Si40,I 4/m m m,tetragonal,4.336499999992132,4.336499999992132,5.96414949,data/final/MP/cifs/Au2Ce1Si2-MP-mp-5173.cif,data/source/MP/raw/cifs/mp-5173.cif,mp-5173,0.0,,2011-05-13 00:32:28,10.188149556697963,10.17188/1263126,"@misc{osti_1263126,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ce(SiAu)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1263126"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-920276'}},0.0,7.82962311,520.0,-26.23661146,-5.247322292,"{'tags': ['Cerium gold silicide (1/2/2)', 'Gold cerium silicide (2/1/2)']}",-26.23661146,-5.247322292,-0.5526262369999998,"['xas', 'bandstructure']",True,"[106687, 611729, 611726, 418530, 58424]",True,2021-05-12 10:57:10.838000,FM,5,10,mp-5173,,Ce(SiAu)2,"{'functional': 'PBE', 'labels': ['Ce', 'Si', 'Au'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Si': 2.0, 'Au': 2.0}",GGA,mp-5173,"['mp-906580', 'mp-921304', 'mp-920276', 'mp-5173', 'mp-1156252', 'mp-1260044', 'mp-1439861', 'mp-1687982', 'mp-1797736', 'mp-1592891']",0.4671769,"{'Ce': 1.0, 'Si': 2.0, 'Au': 2.0}",96.198391237662,[],FM,True,139,1,"[0.5, 0.0, 0.0, 0.0, 0.0]",0.0048563899457093,0.4671769,1,0.4671769,MP,data/source/MP/cleaned/cifs/MP-mp-5173.cif,False,,data/final/MP/graphs/Au2Ce1Si2-MP-mp-5173.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B2Zr1,1,0.0,1.0,True,B2Zr1,B2Zr1,2.75,Other,True,B66.667Zr33.333,B-Zr,2,Supercon,B2Zr1,MP-mp-1472,Zr1B2,B-Zr,B66.667Zr33.333,P 6/m m m,hexagonal,3.180490001982521,3.18049075,3.545484,data/final/MP/cifs/B2Zr1-MP-mp-1472.cif,data/source/MP/raw/cifs/mp-1472.cif,mp-1472,0.0,,2011-05-12 18:15:42,6.03310523000882,10.17188/1190849,"@misc{osti_1190849,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrB2 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1190849"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668779'}},0.0,7.16960984,520.0,-24.86855078,-8.289516926666666,{'tags': ['Zirconium boride (1/2)']},-24.86855078,-8.289516926666666,-0.9873555361111102,"['xas', 'elasticity', 'bandstructure']",True,"[615772, 30327, 44492, 615765, 615751, 615754, 169458, 44603, 615771, 615766, 615755, 186559]",True,2021-05-12 10:56:12.755000,NM,3,13,mp-1472,,ZrB2,"{'functional': 'PBE', 'labels': ['Zr_sv', 'B'], 'pot_type': 'paw'}","{'Zr': 1.0, 'B': 2.0}",GGA,mp-1472,"['mp-921664', 'mp-907184', 'mp-920651', 'mp-1472', 'mp-1063554', 'mp-1063589', 'mp-1063503', 'mp-1440931', 'mp-1668779', 'mp-1790527', 'mp-1588229', 'mp-1587116', 'mp-1063573']",0.0002305,"{'Zr': 1.0, 'B': 2.0}",31.0594933066118,[],NM,False,191,0,"[0, 0, 0]",7.421241477591401e-06,0.0002305,0,0.0002305,MP,data/source/MP/cleaned/cifs/MP-mp-1472.cif,False,,data/final/MP/graphs/B2Zr1-MP-mp-1472.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Tc0.5W0.5,1,0.0,2.0,False,Tc1W1,Tc1W1,7.52,Other,True,Tc50W50,Tc-W,2,Supercon,Tc0.5W0.5,MP-mp-1217337,Tc1W1,Tc-W,Tc50W50,C m m m,orthorhombic,2.74342342,2.74342342,4.415078,data/final/MP/cifs/Tc0.5W0.5-MP-mp-1217337.cif,data/source/MP/raw/cifs/mp-1217337.cif,mp-1217337,0.0,,2019-01-12 18:41:26.565000,15.07500046961932,,,{'GGA': {'task_id': 'mp-1675757'}},0.1056380400000005,7.99534205,520.0,-23.1074703,-11.55373515,{'tags': []},-23.1074703,-11.55373515,0.1056380400000005,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,2,5,mp-1217337,,TcW,"{'functional': 'PBE', 'labels': ['Tc_pv', 'W_pv'], 'pot_type': 'paw'}","{'Tc': 1.0, 'W': 1.0}",GGA,mp-1217337,"['mp-1217337', 'mp-1421216', 'mp-1675757', 'mp-1794582', 'mp-1607750']",8.03e-05,"{'Tc': 1.0, 'W': 1.0}",31.045195087968203,[],NM,False,65,0,"[0, 0]",2.5865516313383023e-06,8.03e-05,0,8.03e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1217337.cif,False,,data/final/MP/graphs/Tc0.5W0.5-MP-mp-1217337.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ba0.241Bi1K0.759O3,2,0.0369333333333333,3.0,False,Ba0.723Bi3K2.277O9,Ba1Bi3K2O9,0.0,Oxide,True,Ba4.82Bi20K15.18O60,Ba-Bi-K-O,4,Supercon,Ba0.241K0.759Bi1O3,MP-mp-1223672,K2Ba1Bi3O9,Ba-Bi-K-O,Ba6.667Bi20K13.333O60,P -3 m 1,trigonal,6.104433996276926,6.1044332,7.481113,data/final/MP/cifs/Ba0.241Bi1K0.759O3-MP-mp-1223672-synth_doped.cif,data/source/MP/raw/cifs/mp-1223672.cif,mp-1223672,0.0,,2019-01-13 00:02:05.715000,6.784857598202287,,,{'GGA': {'task_id': 'mp-1736675'}},0.0209399281666646,2.58339382,520.0,-80.80971432,-5.387314288,{'tags': []},-80.80971432,-5.387314288,-1.7767462414000008,[],False,[],True,2021-05-12 11:00:52.054000,NM,15,4,mp-1223672,oxide,K2Ba(BiO3)3,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Bi', 'O'], 'pot_type': 'paw'}","{'K': 2.0, 'Ba': 1.0, 'Bi': 3.0, 'O': 9.0}",GGA,mp-1223672,"['mp-1223672', 'mp-1408017', 'mp-1736675', 'mp-1774751']",0.001083,"{'K': 2.0, 'Ba': 1.0, 'Bi': 3.0, 'O': 9.0}",241.4279662625217,[],NM,False,164,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.485810060721703e-06,0.001083,0,0.001083,MP,data/source/MP/cleaned/cifs/MP-mp-1223672.cif,True,,data/final/MP/graphs/Ba0.241Bi1K0.759O3-MP-mp-1223672-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Al2Np1Pd5,1,0.0,1.0,True,Al2Np1Pd5,Al2Np1Pd5,4.95,Heavy_fermion,True,Al25Np12.5Pd62.5,Al-Np-Pd,3,Supercon,Np1Pd5Al2,MP-mp-569227,Np1Al2Pd5,Al-Np-Pd,Al25Np12.5Pd62.5,I 4/m m m,tetragonal,4.177842001821238,4.177842001821238,8.07613441,data/final/MP/cifs/Al2Np1Pd5-MP-mp-569227.cif,data/source/MP/raw/cifs/mp-569227.cif,mp-569227,0.0,,2014-02-16 14:34:27,10.417569423703483,10.17188/1274993,"@misc{osti_1274993,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NpAl2Pd5 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1274993"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703712'}},0.0,8.02404806,520.0,-51.9634279,-6.4954284875,{'tags': ['Neptunium palladium aluminium (1/5/2)']},-51.9634279,-6.4954284875,-0.7031359385937499,"['xas', 'bandstructure']",True,"[161314, 168817]",True,2021-05-12 10:57:24.969000,FM,8,8,mp-569227,,NpAl2Pd5,"{'functional': 'PBE', 'labels': ['Np', 'Al', 'Pd'], 'pot_type': 'paw'}","{'Np': 1.0, 'Al': 2.0, 'Pd': 5.0}",GGA,mp-569227,"['mp-1001265', 'mp-569227', 'mp-1007604', 'mp-1261130', 'mp-1424719', 'mp-1703712', 'mp-1779203', 'mp-1590707']",3.6483795,"{'Np': 1.0, 'Al': 2.0, 'Pd': 5.0}",131.19455588717688,[],FM,True,139,1,"[3.6, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0278089245039823,3.6483795,1,3.6483795,MP,data/source/MP/cleaned/cifs/MP-mp-569227.cif,False,,data/final/MP/graphs/Al2Np1Pd5-MP-mp-569227.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ba2Cu3Pr0.5Y0.5O7,1,0.0,2.0,False,Ba4Cu6Pr1Y1O14,Ba4Cu6Pr1Y1O14,25.93,Cuprate,True,Ba15.385Cu23.077Pr3.846Y3.846O53.84615384615385,Ba-Cu-Pr-Y-O,5,Supercon,Y0.5Pr0.5Ba2Cu3O7,MP-mp-1228182,Ba4Pr1Y1Cu6O14,Ba-Cu-Pr-Y-O,Ba15.385Cu23.077Pr3.846Y3.846O53.84615384615385,C m m m,orthorhombic,3.949929,7.74232199751255,12.49432076,data/final/MP/cifs/Ba2Cu3Pr0.5Y0.5O7-MP-mp-1228182.cif,data/source/MP/raw/cifs/mp-1228182.cif,mp-1228182,0.0,,2019-01-13 03:55:31.194000,6.327747434820984,,,,0.0237480683814448,3.26863064,520.0,-159.60355051,-6.138598096538461,{'tags': []},-159.60355051,-6.138598096538461,-2.1704462631410246,[],False,[],True,2021-05-12 11:00:59.151000,NM,26,3,mp-1228182,oxide,Ba4PrY(Cu3O7)2,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Pr_3', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 4.0, 'Pr': 1.0, 'Y': 1.0, 'Cu': 6.0, 'O': 14.0}",GGA,mp-1228182,"['mp-1228182', 'mp-1368338', 'mp-1838576']",0.0118757,"{'Ba': 4.0, 'Pr': 1.0, 'Y': 1.0, 'Cu': 6.0, 'O': 14.0}",363.293922142809,[],NM,False,65,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",3.268895865351615e-05,0.0118757,0,0.0118757,MP,data/source/MP/cleaned/cifs/MP-mp-1228182.cif,False,,data/final/MP/graphs/Ba2Cu3Pr0.5Y0.5O7-MP-mp-1228182.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ce0.985La0.015Pt3Si1,2,0.006,1.0,True,Ce0.985La0.015Pt3Si1,Ce1Pt3Si1,0.15,Heavy_fermion,True,Ce19.7La0.3Pt60Si20,Ce-La-Pt-Si,4,Supercon,Ce0.985La0.015Pt3Si1,MP-mp-1207119,Ce1Si1Pt3,Ce-Pt-Si,Ce20Pt60Si20,P 4 m m,tetragonal,4.067884,4.067884,5.552623,data/final/MP/cifs/Ce0.985La0.015Pt3Si1-MP-mp-1207119-synth_doped.cif,data/source/MP/raw/cifs/mp-1207119.cif,mp-1207119,0.0,,2019-01-12 10:17:34.047000,13.616649050512317,,,,0.0,7.99187805,520.0,-34.84666915,-6.969333829999999,"{'tags': ['CePt3Si', 'CePt3B']}",-34.84666915,-6.969333829999999,-1.0409085689999995,[],False,[],True,2021-05-12 11:00:19.396000,NM,5,2,mp-1207119,,CeSiPt3,"{'functional': 'PBE', 'labels': ['Ce', 'Si', 'Pt'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Si': 1.0, 'Pt': 3.0}",GGA,mp-1207119,"['mp-1207119', 'mp-1923489']",0.0099182,"{'Ce': 1.0, 'Si': 1.0, 'Pt': 3.0}",91.88302988314366,[],NM,False,99,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",0.0001079437629844,0.0099182,0,0.0099182,MP,data/source/MP/cleaned/cifs/MP-mp-1207119.cif,True,,data/final/MP/graphs/Ce0.985La0.015Pt3Si1-MP-mp-1207119-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
B1Ba1Cu1Gd1O5,1,0.0,2.0,False,B2Ba2Cu2Gd2O10,B2Ba2Cu2Gd2O10,0.0,Cuprate,True,B11.111Ba11.111Cu11.111Gd11.111O55.55555555555556,B-Ba-Cu-Gd-O,5,Supercon,Gd1Ba1Cu1B1O5,MP-mp-1214529,Ba2Gd2Cu2B2O10,B-Ba-Cu-Gd-O,B11.111Ba11.111Cu11.111Gd11.111O55.55555555555556,P 4 b m,tetragonal,5.512761,5.512761,7.541521,data/final/MP/cifs/B1Ba1Cu1Gd1O5-MP-mp-1214529.cif,data/source/MP/raw/cifs/mp-1214529.cif,mp-1214529,0.0,,2019-01-12 16:21:28.650000,6.505211411169715,,,{'GGA': {'task_id': 'mp-1682577'}},0.0184338249814892,3.56913362,520.0,-147.42335949,-8.190186638333333,{'tags': []},-147.42335949,-8.190186638333333,-2.848131467685185,[],False,[],True,2021-05-12 11:00:35.508000,FM,18,5,mp-1214529,oxide,BaGdCuBO5,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Gd', 'Cu_pv', 'B', 'O'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Gd': 1.0, 'Cu': 1.0, 'B': 1.0, 'O': 5.0}",GGA,mp-1214529,"['mp-1214529', 'mp-1370516', 'mp-1682577', 'mp-1773989', 'mp-1872369']",6.9755516,"{'Ba': 2.0, 'Gd': 2.0, 'Cu': 2.0, 'B': 2.0, 'O': 10.0}",229.1908491791077,[],FM,True,100,1,"[0.0, 0.0, 6.9, 6.9, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0608711178913496,6.9755516,2,13.9511032,MP,data/source/MP/cleaned/cifs/MP-mp-1214529.cif,False,,data/final/MP/graphs/B1Ba1Cu1Gd1O5-MP-mp-1214529.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
Co35.38Zr64.62,2,0.0409333333333333,0.0600012789471133,False,Co2.123Zr3.877,Co2Zr4,2.67,Other,True,Co35.38Zr64.62,Co-Zr,2,Supercon,Co35.38Zr64.62,MP-mp-628,Zr4Co2,Co-Zr,Co33.333Zr66.667,I 4/m c m,tetragonal,5.27792884001752,5.27792884,5.277928840000001,data/final/MP/cifs/Co35.38Zr64.62-MP-mp-628-synth_doped.cif,data/source/MP/raw/cifs/mp-628.cif,mp-628,0.0,,2011-05-13 12:16:44,7.17077101131263,10.17188/1278899,"@misc{osti_1278899,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Zr2Co (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278899"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677545'}},0.0,4.51380976,520.0,-49.95120762,-8.325201269999999,"{'tags': ['Cobalt zirconium (1/2)', 'Zirconium cobalt (2/1)']}",-49.95120762,-8.325201269999999,-0.2572949183333328,"['xas', 'elasticity', 'bandstructure']",True,"[625671, 191386, 625688, 102740, 625665]",True,2021-05-12 10:56:27.046000,NM,6,20,mp-628,,Zr2Co,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Co'], 'pot_type': 'paw'}","{'Zr': 2.0, 'Co': 1.0}",GGA,mp-628,"['mp-928347', 'mp-912327', 'mp-928866', 'mp-628', 'mp-1071352', 'mp-1071381', 'mp-1071431', 'mp-1071762', 'mp-1071803', 'mp-1071859', 'mp-1071883', 'mp-1071742', 'mp-1071925', 'mp-1441633', 'mp-1677545', 'mp-1802810', 'mp-1591799', 'mp-1071792', 'mp-1071416', 'mp-1071915']",0.0001226,"{'Zr': 4.0, 'Co': 2.0}",111.79353060019714,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0]",2.1933290654975308e-06,0.0001226,0,0.0002452,MP,data/source/MP/cleaned/cifs/MP-mp-628.cif,True,,data/final/MP/graphs/Co35.38Zr64.62-MP-mp-628-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ag0.7Hg0.3,3,0.1,4.0,False,Ag2.8Hg1.2,Ag3Hg1,0.0,Other,True,Ag70Hg30,Ag-Hg,2,Supercon,Ag0.7Hg0.3,MP-mp-985443,Ag3Hg1,Ag-Hg,Ag75Hg25,P m -3 m,cubic,4.245293,4.245293,4.245293,data/final/MP/cifs/Ag0.7Hg0.3-MP-mp-985443-synth_doped.cif,data/source/MP/raw/cifs/mp-985443.cif,mp-985443,0.0,,2015-10-18 20:18:31,11.376760916596703,10.17188/1316677,"@misc{osti_1316677,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ag3Hg (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1316677"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1767051'}},0.0211861612500001,3.28326039,520.0,-8.71660373,-2.1791509325,{'tags': []},-8.71660373,-2.1791509325,0.0211861612500001,"['xas', 'elasticity', 'bandstructure']",True,[],True,2021-05-12 10:56:37.246000,NM,4,8,mp-985443,,Ag3Hg,"{'functional': 'PBE', 'labels': ['Ag', 'Hg'], 'pot_type': 'paw'}","{'Ag': 3.0, 'Hg': 1.0}",GGA,mp-985443,"['mp-985443', 'mp-985761', 'mp-985712', 'mp-1437194', 'mp-1767051', 'mp-1798617', 'mp-985765', 'mp-1612891']",0.0007134,"{'Ag': 3.0, 'Hg': 1.0}",76.51084682028718,[],NM,False,221,0,"[0, 0, 0, 0]",9.32416813626011e-06,0.0007134,0,0.0007134,MP,data/source/MP/cleaned/cifs/MP-mp-985443.cif,True,,data/final/MP/graphs/Ag0.7Hg0.3-MP-mp-985443-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
As1Fe0.8Gd1Ir0.2O1,3,0.0999999999999999,2.0,False,As2Fe1.6Gd2Ir0.4O2,As2Fe2Gd2O2,17.6,Ferrite,True,As25Fe20Gd25Ir5O25,As-Fe-Gd-Ir-O,5,Supercon,Gd1Fe0.8Ir0.2As1O1,MP-mp-1078679,Gd2Fe2As2O2,As-Fe-Gd-O,As25Fe25Gd25O25,P 4/n m m,tetragonal,3.996524,3.996524,9.110606,data/final/MP/cifs/As1Fe0.8Gd1Ir0.2O1-MP-mp-1078679-synth_doped.cif,data/source/MP/raw/cifs/mp-1078679.cif,mp-1078679,0.0,,2018-04-12 14:54:44,6.938465251324023,,,{'GGA+U': {'task_id': 'mp-1704492'}},0.2756975050000001,4.06882668,520.0,-71.78498399,-8.97312299875,{'tags': ['Gadolinium iron arsenic oxide (1/1/1/1)']},-71.78498399,-8.97312299875,-1.670570473750001,['bandstructure'],True,"[425013, 422003, 425006, 425015, 425010, 236655, 425016]",True,2021-05-12 10:58:16.596000,FM,8,10,mp-1078679,oxide,GdFeAsO,"{'functional': 'PBE', 'labels': ['Gd', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Gd': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-1078679,"['mp-1078679', 'mp-1079389', 'mp-1079927', 'mp-1080502', 'mp-1080613', 'mp-1095209', 'mp-1438268', 'mp-1704492', 'mp-1864230', 'mp-1589235']",10.7990939,"{'Gd': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",145.5164583479414,[],FM,True,129,2,"[6.9, 6.9, 3.6, 3.6, 0.0, 0.0, 0.0, 0.0]",0.1484243641248952,10.7990939,4,21.5981878,MP,data/source/MP/cleaned/cifs/MP-mp-1078679.cif,True,,data/final/MP/graphs/As1Fe0.8Gd1Ir0.2O1-MP-mp-1078679-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Si2V1,1,0.0,3.0,False,Si6V3,Si6V3,0.0,Other,True,Si66.667V33.333,Si-V,2,Supercon,Si2V1,MP-mp-11190,V3Si6,Si-V,Si66.667V33.333,P 64 2 2,hexagonal,4.564947999360036,4.56494719,6.372156,data/final/MP/cifs/Si2V1-MP-mp-11190.cif,data/source/MP/raw/cifs/mp-11190.cif,mp-11190,0.0,,2011-05-28 08:26:34,4.640041982589596,10.17188/1187622,"@misc{osti_1187622,
    author = ""Persson, Kristin"",
    title = ""Materials Data on VSi2 (SG:181) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187622"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698895'}},0.0,9.86412086,520.0,-64.16008407,-7.12889823,{'tags': ['Vanadium silicide (1/2)']},-64.16008407,-7.12889823,-0.436720193333333,"['xas', 'elasticity', 'bandstructure']",True,[96025],True,2021-05-12 10:56:10.715000,FM,9,11,mp-11190,,VSi2,"{'functional': 'PBE', 'labels': ['V_pv', 'Si'], 'pot_type': 'paw'}","{'V': 1.0, 'Si': 2.0}",GGA,mp-11190,"['mp-1007430', 'mp-1000988', 'mp-11190', 'mp-1138701', 'mp-1146119', 'mp-1115671', 'mp-1428830', 'mp-1698895', 'mp-1804691', 'mp-1012196', 'mp-1596748']",0.1130430666666666,"{'V': 3.0, 'Si': 6.0}",114.99755267640492,[],FM,True,181,1,"[0.1, 0.1, 0.1, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.002949012323369,0.1130430666666666,3,0.3391292,MP,data/source/MP/cleaned/cifs/MP-mp-11190.cif,False,,data/final/MP/graphs/Si2V1-MP-mp-11190.json,0,True,622,0,4,0,0,0,0,0,1,0,0,0,0.5,False
C2Pt0.2Rh0.8U2,3,0.0799999999999999,1.0,True,C2Pt0.2Rh0.8U2,C2Rh1U2,0.0,Heavy_fermion,True,C40Pt4Rh16U40,C-Pt-Rh-U,4,Supercon,U2Pt0.2Rh0.8C2,MP-mp-1069790,U2Rh1C2,C-Rh-U,C40Rh20U40,I 4/m m m,tetragonal,3.45519800165464,3.45519800165464,6.75012866,data/final/MP/cifs/C2Pt0.2Rh0.8U2-MP-mp-1069790-synth_doped.cif,data/source/MP/raw/cifs/mp-1069790.cif,mp-1069790,0.0,,2018-03-22 01:49:35,13.328741052294186,,,{'GGA': {'task_id': 'mp-1678120'}},0.0,10.53389718,520.0,-49.92071488,-9.984142976,"{'tags': ['Uranium rhodium carbide (2/1/2)', 'Rhodium uranium carbide (1/2/2)', 'Na2HgO2', 'U2RhC2']}",-49.92071488,-9.984142976,-0.3040051179999992,['bandstructure'],True,"[604010, 618732, 618730]",True,2021-05-12 10:58:14.654000,FM,5,16,mp-1069790,,U2RhC2,"{'functional': 'PBE', 'labels': ['U', 'Rh_pv', 'C'], 'pot_type': 'paw'}","{'U': 2.0, 'Rh': 1.0, 'C': 2.0}",GGA,mp-1069790,"['mp-1069790', 'mp-1069821', 'mp-1069857', 'mp-1069831', 'mp-1069934', 'mp-1069969', 'mp-1070617', 'mp-1070658', 'mp-1070795', 'mp-1438538', 'mp-1678120', 'mp-1799718', 'mp-1590168', 'mp-1070757', 'mp-1069902', 'mp-1069923']",2.1803942,"{'U': 2.0, 'Rh': 1.0, 'C': 2.0}",75.1218498577192,[],FM,True,139,1,"[1.1, 1.1, 0.0, 0.0, 0.0]",0.0290247671500324,2.1803942,2,2.1803942,MP,data/source/MP/cleaned/cifs/MP-mp-1069790.cif,True,,data/final/MP/graphs/C2Pt0.2Rh0.8U2-MP-mp-1069790-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Bi2Ca1Cu1.99Fe0.01Sr2O8,2,0.0013333333333333,2.0,False,Bi4Ca2Cu3.98Fe0.02Sr4O16,Bi4Ca2Cu4Sr4O16,74.1,Cuprate,True,Bi13.333Ca6.667Cu13.267Fe0.067Sr13.333O53.333333333333336,Bi-Ca-Cu-Fe-Sr-O,6,Supercon,Bi2Sr2Ca1Cu1.99Fe0.01O8,MP-mp-1218930,Sr4Ca2Cu4Bi4O16,Bi-Ca-Cu-Sr-O,Bi13.333Ca6.667Cu13.333Sr13.333O53.333333333333336,C c c 2,orthorhombic,5.417115,5.472898000129128,16.11398919,data/final/MP/cifs/Bi2Ca1Cu1.99Fe0.01Sr2O8-MP-mp-1218930-synth_doped.cif,data/source/MP/raw/cifs/mp-1218930.cif,mp-1218930,0.0,,2019-01-12 20:01:06.544000,6.266668983881059,,,,0.039252223722225,4.51768334,520.0,-173.15021002,-5.771673667333333,{'tags': []},-173.15021002,-5.771673667333333,-2.074956548222222,[],False,[],True,2021-05-12 11:00:42.526000,NM,30,3,mp-1218930,oxide,Sr2CaCu2(BiO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",GGA,mp-1218930,"['mp-1218930', 'mp-1359698', 'mp-1817714']",0.00011165,"{'Sr': 4.0, 'Ca': 2.0, 'Cu': 4.0, 'Bi': 4.0, 'O': 16.0}",470.7976286073367,[],NM,False,37,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.743014544498498e-07,0.00011165,0,0.0002233,MP,data/source/MP/cleaned/cifs/MP-mp-1218930.cif,True,,data/final/MP/graphs/Bi2Ca1Cu1.99Fe0.01Sr2O8-MP-mp-1218930-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Ce0.2Cu1Pr1.8O4,3,0.0571428571428571,1.0,True,Ce0.2Cu1Pr1.8O4,Cu1Pr2O4,3.0,Cuprate,True,Ce2.857Cu14.286Pr25.714O57.142857142857146,Ce-Cu-Pr-O,4,Supercon,Pr1.8Ce0.2Cu1O4,MP-mp-4181,Pr2Cu1O4,Cu-Pr-O,Cu14.286Pr28.571O57.142857142857146,I 4/m m m,tetragonal,3.995734002478021,3.995734002478021,6.85109716,data/final/MP/cifs/Ce0.2Cu1Pr1.8O4-MP-mp-4181-synth_doped.cif,data/source/MP/raw/cifs/mp-4181.cif,mp-4181,0.0,,2011-05-13 10:21:01,6.821515862307185,10.17188/1207928,"@misc{osti_1207928,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Pr2CuO4 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207928"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-669887'}},0.0,3.15418113,520.0,-51.2919541,-7.327422014285714,"{'tags': ['Dipraseodymium cuprate', 'Dipraseodymium copper oxide', 'Praseodymium cuprate', 'Dipraseodymium copper tetraoxide']}",-51.2919541,-7.327422014285714,-2.9410150171428566,"['xas', 'elasticity', 'bandstructure']",True,"[91071, 261374, 71180, 186589, 185267, 185268, 65925, 65924, 191813, 261373, 202884, 72241]",True,2021-05-12 10:56:20.740000,NM,7,12,mp-4181,oxide,Pr2CuO4,"{'functional': 'PBE', 'labels': ['Pr_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Pr': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-4181,"['mp-669887', 'mp-660138', 'mp-4181', 'mp-1077961', 'mp-1077976', 'mp-1077987', 'mp-1078042', 'mp-1442060', 'mp-1687781', 'mp-1797293', 'mp-1589370', 'mp-688743']",0.0084498,"{'Pr': 2.0, 'Cu': 1.0, 'O': 4.0}",99.64888441679796,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",8.479573102552068e-05,0.0084498,0,0.0084498,MP,data/source/MP/cleaned/cifs/MP-mp-4181.cif,True,,data/final/MP/graphs/Ce0.2Cu1Pr1.8O4-MP-mp-4181-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
La3Ni4P4O2,1,0.0,1.0,True,La3Ni4P4O2,La3Ni4P4O2,2.2,Ferrite,True,La23.077Ni30.769P30.769O15.384615384615385,La-Ni-P-O,4,Supercon,La3Ni4P4O2,MP-mp-1210896,La3Ni4P4O2,La-Ni-P-O,La23.077Ni30.769P30.769O15.384615384615385,I 4/m m m,tetragonal,4.009213999400273,4.009213999400273,13.296959700000002,data/final/MP/cifs/La3Ni4P4O2-MP-mp-1210896.cif,data/source/MP/raw/cifs/mp-1210896.cif,mp-1210896,0.0,,2019-01-12 13:21:35.493000,6.420371786595251,,,{'GGA+U': {'task_id': 'mp-1733147'}},0.6065703066998269,8.330403,520.0,-71.93163903,-5.533203002307692,{'tags': []},-71.93163903,-5.533203002307692,-1.076302996794871,[],False,[],True,2021-05-12 11:00:26.500000,NM,13,4,mp-1210896,oxide,La3Ni4(P2O)2,"{'functional': 'PBE', 'labels': ['La', 'Ni_pv', 'P', 'O'], 'pot_type': 'paw'}","{'La': 3.0, 'Ni': 4.0, 'P': 4.0, 'O': 2.0}",GGA+U,mp-1210896,"['mp-1210896', 'mp-1389121', 'mp-1733147', 'mp-1829866']",0.0018583,"{'La': 3.0, 'Ni': 4.0, 'P': 4.0, 'O': 2.0}",208.8185049891326,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",8.89911552664698e-06,0.0018583,0,0.0018583,MP,data/source/MP/cleaned/cifs/MP-mp-1210896.cif,False,,data/final/MP/graphs/La3Ni4P4O2-MP-mp-1210896.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As2Ba0.3Fe2K0.7,3,0.12,1.0,True,As2Ba0.3Fe2K0.7,As2Fe2K1,19.7,Ferrite,True,As40Ba6Fe40K14,As-Ba-Fe-K,4,Supercon,Ba0.3K0.7Fe2As2,MP-mp-35276,K1Fe2As2,As-Fe-K,As40Fe40K20,I 4/m m m,tetragonal,3.773663997645024,3.773663997645024,7.55368275,data/final/MP/cifs/As2Ba0.3Fe2K0.7-MP-mp-35276-synth_doped.cif,data/source/MP/raw/cifs/mp-35276.cif,mp-35276,0.0,,2013-11-11 09:13:53,4.960691158678031,,,{'GGA': {'task_id': 'mp-1695961'}},0.0,3.49619278,520.0,-28.80228941,-5.760457882,"{'tags': ['Potassium iron arsenide (1/2/2)', 'Potassium iron iron(III) arsenide']}",-28.80228941,-5.760457882,-0.2867273506000004,"['xas', 'elasticity', 'bandstructure']",True,"[189036, 31473]",True,2021-05-12 10:56:27.046000,FM,5,13,mp-35276,,K(FeAs)2,"{'functional': 'PBE', 'labels': ['K_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'K': 1.0, 'Fe': 2.0, 'As': 2.0}",GGA,mp-35276,"['mp-675576', 'mp-936897', 'mp-947308', 'mp-947894', 'mp-1068571', 'mp-1068449', 'mp-1068488', 'mp-35276', 'mp-1441920', 'mp-1695961', 'mp-1796098', 'mp-1593314', 'mp-1068554']",1.3381583,"{'K': 1.0, 'Fe': 2.0, 'As': 2.0}",100.63322517614498,[],FM,True,139,1,"[0.0, 0.8, 0.8, 0.0, 0.0]",0.0132973806380321,1.3381583,2,1.3381583,MP,data/source/MP/cleaned/cifs/MP-mp-35276.cif,True,,data/final/MP/graphs/As2Ba0.3Fe2K0.7-MP-mp-35276-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
N1Ta2,1,0.0,3.0,False,N3Ta6,N3Ta6,0.0,Other,True,N33.333Ta66.667,N-Ta,2,Supercon,N1Ta2,MP-mp-1079438,Ta6N3,N-Ta,N33.333Ta66.667,P -3 1 m,trigonal,4.966065,5.318498001393175,5.31849854,data/final/MP/cifs/N1Ta2-MP-mp-1079438.cif,data/source/MP/raw/cifs/mp-1079438.cif,mp-1079438,0.0,,2018-04-15 02:45:50,15.393041119312274,,,{'GGA': {'task_id': 'mp-1695212'}},0.0,7.37186767,520.0,-104.40369681,-11.600410756666667,"{'tags': ['Tantalum nitride (2/1)', 'Tantalum nitride (2/1) - beta']}",-104.40369681,-11.600410756666667,-1.0367273616666668,['bandstructure'],True,"[644715, 167808]",True,2021-05-12 10:58:16.596000,NM,9,6,mp-1079438,,Ta2N,"{'functional': 'PBE', 'labels': ['Ta_pv', 'N'], 'pot_type': 'paw'}","{'Ta': 2.0, 'N': 1.0}",GGA,mp-1079438,"['mp-1079438', 'mp-1079924', 'mp-1434895', 'mp-1695212', 'mp-1933303', 'mp-1590321']",0.0012778,"{'Ta': 6.0, 'N': 3.0}",121.65251464401956,[],NM,False,162,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0]",3.151106256387155e-05,0.0012778,0,0.0038334,MP,data/source/MP/cleaned/cifs/MP-mp-1079438.cif,False,,data/final/MP/graphs/N1Ta2-MP-mp-1079438.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Bi2Ca0.8Cu2Sr2.2O8,3,0.0266666666666666,2.0,False,Bi4Ca1.6Cu4Sr4.4O16,Bi4Ca2Cu4Sr4O16,89.9,Cuprate,True,Bi13.333Ca5.333Cu13.333Sr14.667O53.333333333333336,Bi-Ca-Cu-Sr-O,5,Supercon,Bi2Sr2.2Ca0.8Cu2O8,MP-mp-1218930,Sr4Ca2Cu4Bi4O16,Bi-Ca-Cu-Sr-O,Bi13.333Ca6.667Cu13.333Sr13.333O53.333333333333336,C c c 2,orthorhombic,5.417115,5.472898000129128,16.11398919,data/final/MP/cifs/Bi2Ca0.8Cu2Sr2.2O8-MP-mp-1218930-synth_doped.cif,data/source/MP/raw/cifs/mp-1218930.cif,mp-1218930,0.0,,2019-01-12 20:01:06.544000,6.266668983881059,,,,0.039252223722225,4.51768334,520.0,-173.15021002,-5.771673667333333,{'tags': []},-173.15021002,-5.771673667333333,-2.074956548222222,[],False,[],True,2021-05-12 11:00:42.526000,NM,30,3,mp-1218930,oxide,Sr2CaCu2(BiO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",GGA,mp-1218930,"['mp-1218930', 'mp-1359698', 'mp-1817714']",0.00011165,"{'Sr': 4.0, 'Ca': 2.0, 'Cu': 4.0, 'Bi': 4.0, 'O': 16.0}",470.7976286073367,[],NM,False,37,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.743014544498498e-07,0.00011165,0,0.0002233,MP,data/source/MP/cleaned/cifs/MP-mp-1218930.cif,True,,data/final/MP/graphs/Bi2Ca0.8Cu2Sr2.2O8-MP-mp-1218930-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
B2Co3Sm1,1,0.0,1.0,True,B2Co3Sm1,B2Co3Sm1,0.0,Other,True,B33.333Co50Sm16.667,B-Co-Sm,3,Supercon,Sm1Co3B2,MP-mp-5410,Sm1Co3B2,B-Co-Sm,B33.333Co50Sm16.667,P 6/m m m,hexagonal,3.025328,5.058903998800797,5.05890367,data/final/MP/cifs/B2Co3Sm1-MP-mp-5410.cif,data/source/MP/raw/cifs/mp-5410.cif,mp-5410,0.0,,2011-05-13 00:59:41,8.637473087045112,10.17188/1264905,"@misc{osti_1264905,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SmCo3B2 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1264905"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695414'}},0.0086167536428503,5.42525987,520.0,-41.95245034,-6.992075056666667,"{'tags': ['Samarium cobalt boride (1/3/2)', 'Cobalt samarium boride (3/1/2)']}",-41.95245034,-6.992075056666667,-0.4250212130555558,"['xas', 'elasticity', 'bandstructure']",True,"[44181, 659054, 87161]",True,2021-05-12 10:56:22.739000,NM,6,8,mp-5410,,SmCo3B2,"{'functional': 'PBE', 'labels': ['Sm_3', 'Co', 'B'], 'pot_type': 'paw'}","{'Sm': 1.0, 'Co': 3.0, 'B': 2.0}",GGA,mp-5410,"['mp-926024', 'mp-5410', 'mp-910089', 'mp-925596', 'mp-1441509', 'mp-1695414', 'mp-1783154', 'mp-1596352']",0.0456357,"{'Sm': 1.0, 'Co': 3.0, 'B': 2.0}",67.05264858906803,[],NM,False,191,0,"[-0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0006805950392754,0.0456357,0,0.0456357,MP,data/source/MP/cleaned/cifs/MP-mp-5410.cif,False,,data/final/MP/graphs/B2Co3Sm1-MP-mp-5410.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Pd2Sn1Tm0.1Y0.9,2,0.0499999999999999,1.0,True,Pd2Sn1Tm0.1Y0.9,Pd2Sn1Y1,4.12,Other,True,Pd50Sn25Tm2.5Y22.5,Pd-Sn-Tm-Y,4,Supercon,Pd2Y0.9Tm0.1Sn1,MP-mp-5538,Y1Sn1Pd2,Pd-Sn-Y,Pd50Sn25Y25,F m -3 m,cubic,4.81595014,4.81595014,4.81595014,data/final/MP/cifs/Pd2Sn1Tm0.1Y0.9-MP-mp-5538-synth_doped.cif,data/source/MP/raw/cifs/mp-5538.cif,mp-5538,0.0,,2011-05-13 01:04:13,8.839720826473608,10.17188/1267618,"@misc{osti_1267618,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YSnPd2 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1267618"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687523'}},0.0,6.33853657,520.0,-24.32859047,-6.0821476175,"{'tags': ['Palladium yttrium stannide (2/1/1)', 'Palladium tin yttrium (2/1/1)']}",-24.32859047,-6.0821476175,-0.873195970416667,"['xas', 'elasticity', 'bandstructure']",True,"[105699, 648949, 105700, 424011, 648950]",True,2021-05-12 10:56:22.739000,NM,4,12,mp-5538,,YSnPd2,"{'functional': 'PBE', 'labels': ['Y_sv', 'Sn_d', 'Pd'], 'pot_type': 'paw'}","{'Y': 1.0, 'Sn': 1.0, 'Pd': 2.0}",GGA,mp-5538,"['mp-1008093', 'mp-1001657', 'mp-5538', 'mp-1065654', 'mp-1065644', 'mp-1065683', 'mp-1439031', 'mp-1687523', 'mp-1801498', 'mp-1012418', 'mp-1593849', 'mp-1065696']",0.0001592,"{'Y': 1.0, 'Sn': 1.0, 'Pd': 2.0}",78.98251295612837,[],NM,False,225,0,"[0, 0, 0, 0]",2.015636044505563e-06,0.0001592,0,0.0001592,MP,data/source/MP/cleaned/cifs/MP-mp-5538.cif,True,,data/final/MP/graphs/Pd2Sn1Tm0.1Y0.9-MP-mp-5538-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
C1Fe0.05Mg1Ni2.95,2,0.0199999999999999,1.0,True,C1Fe0.05Mg1Ni2.95,C1Mg1Ni3,3.72,Other,True,C20Fe1Mg20Ni59,C-Fe-Mg-Ni,4,Supercon,Mg1C1Ni2.95Fe0.05,MP-mp-10700,Mg1Ni3C1,C-Mg-Ni,C20Mg20Ni60,P m -3 m,cubic,3.810209,3.810209,3.810209,data/final/MP/cifs/C1Fe0.05Mg1Ni2.95-MP-mp-10700-synth_doped.cif,data/source/MP/raw/cifs/mp-10700.cif,mp-10700,0.0,,2011-05-28 10:04:44,6.376007671789427,10.17188/1187303,"@misc{osti_1187303,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MgNi3C (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187303"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678621'}},0.0,6.64260176,520.0,-28.85099542,-5.770199084,{'tags': ['Magnesium nickel carbide (1/3/1)']},-28.85099542,-5.770199084,-0.1367049259999994,"['xas', 'elasticity', 'bandstructure']",True,[77152],True,2021-05-12 10:56:10.715000,NM,5,8,mp-10700,,MgNi3C,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Ni_pv', 'C'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",GGA,mp-10700,"['mp-927245', 'mp-927653', 'mp-911184', 'mp-10700', 'mp-1438083', 'mp-1678621', 'mp-1791467', 'mp-1591421']",0.0387875,"{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",55.31544309398296,[],NM,False,221,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",0.0007012056277683,0.0387875,0,0.0387875,MP,data/source/MP/cleaned/cifs/MP-mp-10700.cif,True,,data/final/MP/graphs/C1Fe0.05Mg1Ni2.95-MP-mp-10700-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
As2Th1,1,0.0,2.0,False,As4Th2,As4Th2,0.0,Other,True,As66.667Th33.333,As-Th,2,Supercon,As2Th1,MP-mp-7097,Th2As4,As-Th,As66.667Th33.333,P 4/n m m,tetragonal,4.127654,4.127654,8.544002,data/final/MP/cifs/As2Th1-MP-mp-7097.cif,data/source/MP/raw/cifs/mp-7097.cif,mp-7097,0.0,,2011-05-27 16:48:57,8.71243453153557,10.17188/1282237,"@misc{osti_1282237,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ThAs2 (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1282237"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698936'}},0.0,6.0094618,520.0,-39.75697235,-6.626162058333333,{'tags': ['Thorium arsenide (1/2)']},-39.75697235,-6.626162058333333,-1.0487970383333334,['bandstructure'],True,[42351],True,2021-05-12 10:58:53.520000,NM,6,8,mp-7097,,ThAs2,"{'functional': 'PBE', 'labels': ['Th', 'As'], 'pot_type': 'paw'}","{'Th': 1.0, 'As': 2.0}",GGA,mp-7097,"['mp-925705', 'mp-910243', 'mp-926121', 'mp-7097', 'mp-1413170', 'mp-1698936', 'mp-1872242', 'mp-1592925']",7.43e-05,"{'Th': 2.0, 'As': 4.0}",145.5686694085646,[],NM,False,129,0,"[0, 0, 0, 0, 0, 0]",1.020824059213782e-06,7.43e-05,0,0.0001486,MP,data/source/MP/cleaned/cifs/MP-mp-7097.cif,False,,data/final/MP/graphs/As2Th1-MP-mp-7097.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B4Ce1Co4,1,0.0,2.0,False,B8Ce2Co8,B8Ce2Co8,0.0,Heavy_fermion,True,B44.444Ce11.111Co44.444,B-Ce-Co,3,Supercon,Ce1Co4B4,MP-mp-22165,Ce2Co8B8,B-Ce-Co,B44.444Ce11.111Co44.444,P 42/n m c,tetragonal,5.043719,5.043719,7.03329,data/final/MP/cifs/B4Ce1Co4-MP-mp-22165.cif,data/source/MP/raw/cifs/mp-22165.cif,mp-22165,0.0,,2014-02-22 11:26:24,7.779093325556825,10.17188/1197391,"@misc{osti_1197391,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ce(CoB)4 (SG:137) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197391"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1669609'}},0.0041185368888925,7.6893217,520.0,-130.63327355,-7.257404086111112,{'tags': ['Cerium cobalt boride (1/4/4)']},-130.63327355,-7.257404086111112,-0.4703010396296305,"['xas', 'bandstructure']",True,"[654433, 16193]",True,2021-05-12 10:56:59.077000,NM,18,8,mp-22165,,Ce(CoB)4,"{'functional': 'PBE', 'labels': ['Ce', 'Co', 'B'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Co': 4.0, 'B': 4.0}",GGA,mp-22165,"['mp-990732', 'mp-913827', 'mp-930639', 'mp-22165', 'mp-1418502', 'mp-1669609', 'mp-1787754', 'mp-1586131']",0.0006245,"{'Ce': 2.0, 'Co': 8.0, 'B': 8.0}",178.92057714070052,[],NM,False,137,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.980751012320985e-06,0.0006245,0,0.001249,MP,data/source/MP/cleaned/cifs/MP-mp-22165.cif,False,,data/final/MP/graphs/B4Ce1Co4-MP-mp-22165.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
C1Mo0.75Ta0.25,3,0.0833333333333333,3.0,False,C3Mo2.25Ta0.75,C3Mo2Ta1,8.5,Other,True,C50Mo37.5Ta12.5,C-Mo-Ta,3,Supercon,C1Mo0.75Ta0.25,MP-mp-1217903,Ta1Mo2C3,C-Mo-Ta,C50Mo33.333Ta16.667,P -3 m 1,trigonal,3.116635997131777,3.11663604,7.686316,data/final/MP/cifs/C1Mo0.75Ta0.25-MP-mp-1217903-synth_doped.cif,data/source/MP/raw/cifs/mp-1217903.cif,mp-1217903,0.0,,2019-01-12 19:09:43.831000,10.5003230315958,,,{'GGA': {'task_id': 'mp-1760076'}},0.1970839783333335,9.22941997,520.0,-61.53899175,-10.256498625,{'tags': []},-61.53899175,-10.256498625,-0.0515976599999999,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,6,5,mp-1217903,,TaMo2C3,"{'functional': 'PBE', 'labels': ['Ta_pv', 'Mo_pv', 'C'], 'pot_type': 'paw'}","{'Ta': 1.0, 'Mo': 2.0, 'C': 3.0}",GGA,mp-1217903,"['mp-1217903', 'mp-1390242', 'mp-1760076', 'mp-1783296', 'mp-1626393']",0.0018701,"{'Ta': 1.0, 'Mo': 2.0, 'C': 3.0}",64.65781743250938,[],NM,False,164,0,"[0, 0, 0, 0, 0, 0]",2.892303010308125e-05,0.0018701,0,0.0018701,MP,data/source/MP/cleaned/cifs/MP-mp-1217903.cif,True,,data/final/MP/graphs/C1Mo0.75Ta0.25-MP-mp-1217903-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ga0.35Nb3Sn0.65,3,0.075,2.0,False,Ga0.7Nb6Sn1.3,Ga1Nb6Sn1,16.5,Other,True,Ga8.75Nb75Sn16.25,Ga-Nb-Sn,3,Supercon,Nb3Sn0.65Ga0.35,MP-mp-1220342,Nb6Ga1Sn1,Ga-Nb-Sn,Ga12.5Nb75Sn12.5,P m -3,cubic,5.267319,5.267319,5.267319,data/final/MP/cifs/Ga0.35Nb3Sn0.65-MP-mp-1220342-synth_doped.cif,data/source/MP/raw/cifs/mp-1220342.cif,mp-1220342,0.0,,2019-01-12 21:12:16.669000,8.475086109299342,,,{'GGA': {'task_id': 'mp-1733533'}},0.0480318309375,5.78514107,520.0,-68.8247362,-8.603092025,{'tags': []},-68.8247362,-8.603092025,-0.1474047603125008,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,8,5,mp-1220342,,Nb6GaSn,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Ga_d', 'Sn_d'], 'pot_type': 'paw'}","{'Nb': 6.0, 'Ga': 1.0, 'Sn': 1.0}",GGA,mp-1220342,"['mp-1220342', 'mp-1392260', 'mp-1733533', 'mp-1929075', 'mp-1619541']",0.5383733,"{'Nb': 6.0, 'Ga': 1.0, 'Sn': 1.0}",146.13991918453098,[],NM,False,200,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0036839578330421,0.5383733,0,0.5383733,MP,data/source/MP/cleaned/cifs/MP-mp-1220342.cif,True,,data/final/MP/graphs/Ga0.35Nb3Sn0.65-MP-mp-1220342-synth_doped.json,0,True,m-3,2,0,0,0,0,0,0,1,0,0,0,1.0,False
Al1Hf1Pd2,1,0.0,1.0,True,Al1Hf1Pd2,Al1Hf1Pd2,3.6216666665,Other,True,Al25Hf25Pd50,Al-Hf-Pd,3,Supercon,Pd2Hf1Al1,MP-mp-16501,Hf1Al1Pd2,Al-Hf-Pd,Al25Hf25Pd50,F m -3 m,cubic,4.54692712,4.546927119999999,4.546927119999999,data/final/MP/cifs/Al1Hf1Pd2-MP-mp-16501.cif,data/source/MP/raw/cifs/mp-16501.cif,mp-16501,0.0,,2011-05-27 21:56:24,10.44984767592138,10.17188/1191910,"@misc{osti_1191910,
    author = ""Persson, Kristin"",
    title = ""Materials Data on HfAlPd2 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191910"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700405'}},0.0,6.61493459,520.0,-27.37713212,-6.84428303,{'tags': ['Aluminium hafnium palladium (1/1/2)']},-27.37713212,-6.84428303,-0.8286509549999996,"['xas', 'elasticity', 'bandstructure']",True,[57906],True,2021-05-12 10:56:14.760000,NM,4,9,mp-16501,,HfAlPd2,"{'functional': 'PBE', 'labels': ['Hf_pv', 'Al', 'Pd'], 'pot_type': 'paw'}","{'Hf': 1.0, 'Al': 1.0, 'Pd': 2.0}",GGA,mp-16501,"['mp-992272', 'mp-991913', 'mp-16501', 'mp-1259704', 'mp-1441337', 'mp-1700405', 'mp-1791306', 'mp-993887', 'mp-1592387']",0.0011945,"{'Hf': 1.0, 'Al': 1.0, 'Pd': 2.0}",66.47203609057466,[],NM,False,225,0,"[0, 0, 0, 0]",1.7969962562488334e-05,0.0011945,0,0.0011945,MP,data/source/MP/cleaned/cifs/MP-mp-16501.cif,False,,data/final/MP/graphs/Al1Hf1Pd2-MP-mp-16501.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
In0.12Pb0Sn0.88Te1,3,0.12,1.0,True,In0.12Sn0.88Te1,Sn1Te1,1.76,Other,True,In6Sn44Te50,In-Sn-Te,3,Supercon,Sn0.8798Pb0.0002In0.12Te1,MP-mp-1883,Sn1Te1,Sn-Te,Sn50Te50,F m -3 m,cubic,4.53766968,4.53766968,4.53766968,data/final/MP/cifs/In0.12Pb0Sn0.88Te1-MP-mp-1883-synth_doped.cif,data/source/MP/raw/cifs/mp-1883.cif,mp-1883,0.6623999999999999,,2011-05-12 18:43:07,6.19081042904143,10.17188/1193534,"@misc{osti_1193534,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SnTe (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1193534"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686906'}},0.0,6.06645058,520.0,-7.72519638,-3.86259819,"{'tags': ['Tin telluride (1/1)', 'Tin telluride']}",-7.72519638,-3.86259819,-0.4971617975000004,"['eos', 'elasticity', 'bandstructure', 'xas']",True,"[52489, 652760, 652744, 652756, 652761, 600865, 652763, 652745, 652742, 604177, 600813, 652741, 601065, 652750, 652755, 652753, 652751, 652749, 652752, 600136, 652754, 652746, 652759]",True,2021-05-12 10:56:14.760000,NM,2,9,mp-1883,,SnTe,"{'functional': 'PBE', 'labels': ['Sn_d', 'Te'], 'pot_type': 'paw'}","{'Sn': 1.0, 'Te': 1.0}",GGA,mp-1883,"['mp-663289', 'mp-655511', 'mp-657302', 'mp-1883', 'mp-1440781', 'mp-1686906', 'mp-1784332', 'mp-1596407', 'mp-1596974']",0.0,"{'Sn': 1.0, 'Te': 1.0}",66.06685541129963,[],NM,False,225,0,"[0, 0]",0.0,0.0,0,0.0,MP,data/source/MP/cleaned/cifs/MP-mp-1883.cif,True,,data/final/MP/graphs/In0.12Pb0Sn0.88Te1-MP-mp-1883-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Be13Th0.007U0.993,2,0.001,2.0,False,Be26Th0.014U1.986,Be26U2,0.67,Heavy_fermion,True,Be92.857Th0.05U7.093,Be-Th-U,3,Supercon,Be13U0.9934Th0.0066,MP-mp-1163,U2Be26,Be-U,Be92.857U7.143,F m -3 c,cubic,7.174675929999999,7.174675929999999,7.174675929999999,data/final/MP/cifs/Be13Th0.007U0.993-MP-mp-1163-synth_doped.cif,data/source/MP/raw/cifs/mp-1163.cif,mp-1163,0.0,,2011-05-15 13:39:09,4.516943134220159,10.17188/1188115,"@misc{osti_1188115,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UBe13 (SG:226) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188115"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1676276'}},0.0,5.60901004,520.0,-121.44122023,-4.337186436785714,"{'tags': ['Uranium beryllium (1/13)', 'Beryllium uranium (13/1)']}",-121.44122023,-4.337186436785714,-0.0583452042857146,"['xas', 'bandstructure']",True,"[616470, 58748, 616481, 58747, 58749, 659562, 107528, 600563, 58750, 616488, 58751]",True,2021-05-12 10:56:51.169000,NM,28,8,mp-1163,,UBe13,"{'functional': 'PBE', 'labels': ['U', 'Be_sv'], 'pot_type': 'paw'}","{'U': 1.0, 'Be': 13.0}",GGA,mp-1163,"['mp-1163', 'mp-906858', 'mp-920459', 'mp-921486', 'mp-1381018', 'mp-1676276', 'mp-1775695', 'mp-1603627']",0.0460573,"{'U': 2.0, 'Be': 26.0}",261.15110606061,[],NM,False,226,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0003527252914587,0.0460573,0,0.0921146,MP,data/source/MP/cleaned/cifs/MP-mp-1163.cif,True,,data/final/MP/graphs/Be13Th0.007U0.993-MP-mp-1163-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
H0.985Pd1,2,0.0075566750629723,2.0,False,H1.97Pd2,H2Pd2,7.39,Other,True,H49.622Pd50.378,H-Pd,2,Supercon,H0.985Pd1,MP-mp-1184548,H2Pd2,H-Pd,H50Pd50,P 63 m c,hexagonal,2.968136003881316,2.96813585,5.040799,data/final/MP/cifs/H0.985Pd1-MP-mp-1184548-synth_doped.cif,data/source/MP/raw/cifs/mp-1184548.cif,mp-1184548,0.0,,2019-01-11 12:52:40.348000,9.276812227294194,,,{'GGA': {'task_id': 'mp-1734957'}},0.0,3.52113336,520.0,-17.47744839,-4.3693620975,{'tags': []},-17.47744839,-4.3693620975,-0.0830581699999992,['bandstructure'],True,[],True,2021-05-12 10:58:27.755000,NM,4,5,mp-1184548,,HPd,"{'functional': 'PBE', 'labels': ['H', 'Pd'], 'pot_type': 'paw'}","{'H': 1.0, 'Pd': 1.0}",GGA,mp-1184548,"['mp-1184548', 'mp-1426775', 'mp-1734957', 'mp-1792734', 'mp-1612181']",3.7e-05,"{'H': 2.0, 'Pd': 2.0}",38.45896345503417,[],NM,False,186,0,"[0, 0, 0, 0]",1.924128820749941e-06,3.7e-05,0,7.4e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1184548.cif,True,,data/final/MP/graphs/H0.985Pd1-MP-mp-1184548-synth_doped.json,0,True,6mm,0,5,0,0,0,0,0,1,0,0,0,1.0,False
Cl1N1Na0.16Ti1,2,0.0237341772151898,10.0,False,Cl10N10Na1.6Ti10,Cl10N10Na2Ti10,14.0,Other,True,Cl31.646N31.646Na5.063Ti31.646,Cl-N-Na-Ti,4,Supercon,Na0.16Ti1N1Cl1,MP-mp-1220939,Na2Ti10N10Cl10,Cl-N-Na-Ti,Cl31.25N31.25Na6.25Ti31.25,P -1,triclinic,5.217901,9.47050067,12.45463306,data/final/MP/cifs/Cl1N1Na0.16Ti1-MP-mp-1220939-synth_doped.cif,data/source/MP/raw/cifs/mp-1220939.cif,mp-1220939,0.0,,2019-01-12 21:42:30.774000,2.9350330293838813,,,,0.0251034734375004,3.42907999,520.0,-233.55696383,-7.2986551196875,{'tags': []},-233.55696383,-7.2986551196875,-1.87052116332615,[],False,[],True,2021-05-12 11:00:47.244000,NM,32,3,mp-1220939,,NaTi5(NCl)5,"{'functional': 'PBE', 'labels': ['Na_pv', 'Ti_pv', 'N', 'Cl'], 'pot_type': 'paw'}","{'Na': 1.0, 'Ti': 5.0, 'N': 5.0, 'Cl': 5.0}",GGA,mp-1220939,"['mp-1220939', 'mp-1362352', 'mp-1893331']",0.00109445,"{'Na': 2.0, 'Ti': 10.0, 'N': 10.0, 'Cl': 10.0}",576.6540542581188,[],NM,False,2,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.795863367016608e-06,0.00109445,0,0.0021889,MP,data/source/MP/cleaned/cifs/MP-mp-1220939.cif,True,,data/final/MP/graphs/Cl1N1Na0.16Ti1-MP-mp-1220939-synth_doped.json,0,True,-1,0,0,0,0,0,2,0,1,0,0,0,1.0,False
As1V3,1,0.0,2.0,False,As2V6,As2V6,0.0,Other,True,As25V75,As-V,2,Supercon,As1V3,MP-mp-292,V6As2,As-V,As25V75,P m -3 n,cubic,4.735801,4.735801,4.735801,data/final/MP/cifs/As1V3-MP-mp-292.cif,data/source/MP/raw/cifs/mp-292.cif,mp-292,0.0,,2011-05-13 19:05:48,7.1211430034229615,10.17188/1203573,"@misc{osti_1203573,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3As (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1203573"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696529'}},0.0,7.37408906,520.0,-67.43317546,-8.4291469325,{'tags': ['Vanadium arsenide (3/1)']},-67.43317546,-8.4291469325,-0.4514377787499999,"['xas', 'elasticity', 'bandstructure']",True,"[611575, 44084]",True,2021-05-12 10:56:18.721000,NM,8,8,mp-292,,V3As,"{'functional': 'PBE', 'labels': ['V_pv', 'As'], 'pot_type': 'paw'}","{'V': 3.0, 'As': 1.0}",GGA,mp-292,"['mp-913615', 'mp-292', 'mp-929939', 'mp-930453', 'mp-1414765', 'mp-1696529', 'mp-1921016', 'mp-1593688']",0.00011,"{'V': 6.0, 'As': 2.0}",106.21365029013114,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",2.0712968568451635e-06,0.00011,0,0.00022,MP,data/source/MP/cleaned/cifs/MP-mp-292.cif,False,,data/final/MP/graphs/As1V3-MP-mp-292.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Cu3Lu0.6Pr0.4O7,2,0.0153846153846153,2.0,False,Ba4Cu6Lu1.2Pr0.8O14,Ba4Cu6Lu1Pr1O14,56.55,Cuprate,True,Ba15.385Cu23.077Lu4.615Pr3.077O53.84615384615385,Ba-Cu-Lu-Pr-O,5,Supercon,Lu0.6Pr0.4Ba2Cu3O7,MP-mp-1228451,Ba4Pr1Lu1Cu6O14,Ba-Cu-Lu-Pr-O,Ba15.385Cu23.077Lu3.846Pr3.846O53.84615384615385,P m m m,orthorhombic,3.85332897,3.93705867,23.77502289,data/final/MP/cifs/Ba2Cu3Lu0.6Pr0.4O7-MP-mp-1228451-synth_doped.cif,data/source/MP/raw/cifs/mp-1228451.cif,mp-1228451,0.0,,2019-01-13 04:09:43.598000,6.769717016837828,,,,0.0433511599198643,3.24286517,520.0,-157.50752741,-6.057981823461538,{'tags': []},-157.50752741,-6.057981823461538,-2.164657705192308,[],False,[],True,2021-05-12 11:00:59.151000,NM,26,1,mp-1228451,oxide,Ba4PrLu(Cu3O7)2,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Pr_3', 'Lu_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 4.0, 'Pr': 1.0, 'Lu': 1.0, 'Cu': 6.0, 'O': 14.0}",GGA,mp-1228451,['mp-1228451'],0.0002024,"{'Ba': 4.0, 'Pr': 1.0, 'Lu': 1.0, 'Cu': 6.0, 'O': 14.0}",360.6856947703386,[],NM,False,47,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.61153389043819e-07,0.0002024,0,0.0002024,MP,data/source/MP/cleaned/cifs/MP-mp-1228451.cif,True,,data/final/MP/graphs/Ba2Cu3Lu0.6Pr0.4O7-MP-mp-1228451-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Mo0.036Si1V2.964,2,0.018,2.0,False,Mo0.072Si2V5.928,Si2V6,14.0,Other,True,Mo0.9Si25V74.1,Mo-Si-V,3,Supercon,V2.964Mo0.036Si1,MP-mp-2567,V6Si2,Si-V,Si25V75,P m -3 n,cubic,4.702381,4.702381,4.702381,data/final/MP/cifs/Mo0.036Si1V2.964-MP-mp-2567-synth_doped.cif,data/source/MP/raw/cifs/mp-2567.cif,mp-2567,0.0,,2011-05-13 19:15:43,5.778142190030859,10.17188/1200874,"@misc{osti_1200874,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Si (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1200874"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668672'}},0.0,7.30599425,520.0,-69.05773321,-8.63221665125,{'tags': ['Vanadium silicide (3/1)']},-69.05773321,-8.63221665125,-0.4452085937499994,"['xas', 'elasticity', 'bandstructure']",True,"[652491, 87328, 652522, 652502, 652510, 652520, 600518, 186003, 652507, 652513, 652497, 601150, 652514, 652487, 22412, 652509, 652529, 652532, 652499, 652539, 652537, 652533, 652512, 652538, 652490, 652493, 652494, 652511, 652519, 87329, 652526, 652500]",True,2021-05-12 10:56:18.721000,FM,8,13,mp-2567,,V3Si,"{'functional': 'PBE', 'labels': ['V_pv', 'Si'], 'pot_type': 'paw'}","{'V': 3.0, 'Si': 1.0}",GGA,mp-2567,"['mp-920081', 'mp-906309', 'mp-919083', 'mp-2567', 'mp-1078474', 'mp-1078852', 'mp-1138781', 'mp-1145907', 'mp-1440678', 'mp-1668672', 'mp-1795955', 'mp-1593554', 'mp-1596575']",0.8382519,"{'V': 6.0, 'Si': 2.0}",103.98086881866836,[],FM,True,131,1,"[0.2, 0.3, 0.3, 0.2, 0.3, 0.3, 0.0, 0.0]",0.0161231947669493,0.8382519,6,1.6765038,MP,data/source/MP/cleaned/cifs/MP-mp-2567.cif,True,,data/final/MP/graphs/Mo0.036Si1V2.964-MP-mp-2567-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Al0.991Ge0.009Nb3,2,0.0045,2.0,False,Al1.982Ge0.018Nb6,Al2Nb6,19.0,Other,True,Al24.775Ge0.225Nb75,Al-Ge-Nb,3,Supercon,Nb3Al0.991Ge0.009,MP-mp-796,Nb6Al2,Al-Nb,Al25Nb75,P m -3 n,cubic,5.215254,5.215254,5.215254,data/final/MP/cifs/Al0.991Ge0.009Nb3-MP-mp-796-synth_doped.cif,data/source/MP/raw/cifs/mp-796.cif,mp-796,0.0,,2011-05-13 16:07:37,7.157298025966356,,,{'GGA': {'task_id': 'mp-1686893'}},0.0460773865000003,5.52947534,520.0,-69.48918494,-8.6861481175,"{'tags': ['Aluminium niobium (1/3)', 'Niobium aluminide (3/1)', 'Aluminum niobium (1/3)']}",-69.48918494,-8.6861481175,-0.1737753800000003,"['bandstructure', 'elasticity']",True,"[608675, 608654, 608688, 608668, 608669, 608685, 608676, 608683, 58014, 608657, 107856, 608655, 608666, 608691, 608656, 608665, 608673, 608653, 608661]",True,2021-05-12 10:56:31.128000,NM,8,10,mp-796,,Nb3Al,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Al': 1.0}",GGA,mp-796,"['mp-911586', 'mp-927906', 'mp-796', 'mp-927472', 'mp-1260512', 'mp-1440919', 'mp-1686893', 'mp-1927652', 'mp-1591599', 'mp-1587739']",0.16323955,"{'Nb': 6.0, 'Al': 2.0}",141.8490379078192,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0023015954483396,0.16323955,0,0.3264791,MP,data/source/MP/cleaned/cifs/MP-mp-796.cif,True,,data/final/MP/graphs/Al0.991Ge0.009Nb3-MP-mp-796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
C1Cd1Ti2,1,0.0,2.0,False,C2Cd2Ti4,C2Cd2Ti4,0.0,Other,True,C25Cd25Ti50,C-Cd-Ti,3,Supercon,C1Cd1Ti2,MP-mp-9961,Ti4Cd2C2,C-Cd-Ti,C25Cd25Ti50,P 63/m m c,hexagonal,3.1051120006443544,3.105112109999999,14.543701,data/final/MP/cifs/C1Cd1Ti2-MP-mp-9961.cif,data/source/MP/raw/cifs/mp-9961.cif,mp-9961,0.0,,2011-05-29 02:39:41,6.02072649069647,10.17188/1317059,"@misc{osti_1317059,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ti2CdC (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1317059"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672076'}},0.0,4.86657236,520.0,-56.17632461,-7.02204057625,{'tags': ['Titanium cadmium carbide (2/1/1)']},-56.17632461,-7.02204057625,-0.5368769529166668,"['xas', 'elasticity', 'bandstructure']",True,[42924],True,2021-05-12 10:56:37.246000,NM,8,8,mp-9961,,Ti2CdC,"{'functional': 'PBE', 'labels': ['Ti_pv', 'Cd', 'C'], 'pot_type': 'paw'}","{'Ti': 2.0, 'Cd': 1.0, 'C': 1.0}",GGA,mp-9961,"['mp-909905', 'mp-925467', 'mp-925875', 'mp-9961', 'mp-1300882', 'mp-1672076', 'mp-1803338', 'mp-1593847']",0.0019419,"{'Ti': 4.0, 'Cd': 2.0, 'C': 2.0}",121.43954426416072,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",3.198134531493123e-05,0.0019419,0,0.0038838,MP,data/source/MP/cleaned/cifs/MP-mp-9961.cif,False,,data/final/MP/graphs/C1Cd1Ti2-MP-mp-9961.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Os2Sc1,1,0.0,4.0,False,Os8Sc4,Os8Sc4,4.6,Other,True,Os66.667Sc33.333,Os-Sc,2,Supercon,Os2Sc1,MP-mp-567612,Sc4Os8,Os-Sc,Os66.667Sc33.333,P 63/m m c,hexagonal,5.206073996351425,5.206074570000001,8.612706,data/final/MP/cifs/Os2Sc1-MP-mp-567612.cif,data/source/MP/raw/cifs/mp-567612.cif,mp-567612,0.0,,2014-02-24 13:06:17,13.977574857637462,10.17188/1273957,"@misc{osti_1273957,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ScOs2 (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1273957"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697765'}},0.0,6.63235736,520.0,-119.70980935,-9.975817445833334,"{'tags': ['Scandium osmium (1/2)', 'Osmium scandium (2/1)']}",-119.70980935,-9.975817445833334,-0.3800835741666664,"['xas', 'elasticity', 'bandstructure']",True,"[150515, 647766]",True,2021-05-12 10:56:22.739000,NM,12,8,mp-567612,,ScOs2,"{'functional': 'PBE', 'labels': ['Sc_sv', 'Os_pv'], 'pot_type': 'paw'}","{'Sc': 1.0, 'Os': 2.0}",GGA,mp-567612,"['mp-914504', 'mp-1001391', 'mp-567612', 'mp-1428217', 'mp-1697765', 'mp-1832657', 'mp-1007816', 'mp-1601622']",0.0111358,"{'Sc': 4.0, 'Os': 8.0}",202.15802773348025,[],NM,False,194,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0002203385168494,0.0111358,0,0.0445432,MP,data/source/MP/cleaned/cifs/MP-mp-567612.cif,False,,data/final/MP/graphs/Os2Sc1-MP-mp-567612.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Pr1Ru2,1,0.0,2.0,False,Pr2Ru4,Pr2Ru4,0.0,Heavy_fermion,True,Pr33.333Ru66.667,Pr-Ru,2,Supercon,Pr1Ru2,MP-mp-2665,Pr2Ru4,Pr-Ru,Pr33.333Ru66.667,F d -3 m,cubic,5.45219351,5.45219351,5.45219351,data/final/MP/cifs/Pr1Ru2-MP-mp-2665.cif,data/source/MP/raw/cifs/mp-2665.cif,mp-2665,0.0,,2011-05-13 21:43:28,9.94110718158072,10.17188/1201210,"@misc{osti_1201210,
    author = ""Persson, Kristin"",
    title = ""Materials Data on PrRu2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201210"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678270'}},0.0,5.88467535,520.0,-47.23968937,-7.873281561666666,{'tags': ['Praseodymium ruthenium (1/2)']},-47.23968937,-7.873281561666666,-0.0967220766666668,"['xas', 'elasticity', 'bandstructure']",True,"[649234, 108690, 649232, 649240, 649241, 150509]",True,2021-05-12 10:56:18.721000,NM,6,8,mp-2665,,PrRu2,"{'functional': 'PBE', 'labels': ['Pr_3', 'Ru_pv'], 'pot_type': 'paw'}","{'Pr': 1.0, 'Ru': 2.0}",GGA,mp-2665,"['mp-992115', 'mp-990616', 'mp-914485', 'mp-2665', 'mp-1437776', 'mp-1678270', 'mp-1803648', 'mp-1591737']",0.0018642,"{'Pr': 2.0, 'Ru': 4.0}",114.60373862295393,[],NM,False,74,0,"[0.0, 0.0, -0.0, 0.0, -0.0, 0.0]",3.2532970082821025e-05,0.0018642,0,0.0037284,MP,data/source/MP/cleaned/cifs/MP-mp-2665.cif,False,,data/final/MP/graphs/Pr1Ru2-MP-mp-2665.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Mo6Se8Sn1,1,0.0,1.0,True,Mo6Se8Sn1,Mo6Se8Sn1,3.4,Chevrel,True,Mo40Se53.333Sn6.667,Mo-Se-Sn,3,Supercon,Sn1Mo6Se8,MP-mp-1104129,Sn1Mo6Se8,Mo-Se-Sn,Mo40Se53.333Sn6.667,R -3,trigonal,6.86148826,6.86148826,6.86148828,data/final/MP/cifs/Mo6Se8Sn1-MP-mp-1104129.cif,data/source/MP/raw/cifs/mp-1104129.cif,mp-1104129,0.0,,2018-07-18 21:21:19,6.817016464212601,,,{'GGA': {'task_id': 'mp-1708759'}},0.054078349,5.1021027,520.0,-104.31621584,-6.954414389333333,"{'tags': ['Tin molybdenum selenide (1/6/8)', 'Tin(IV) molybdenum(IV) selenide (1/6/8)']}",-104.31621584,-6.954414389333333,-0.7360995989166658,['bandstructure'],True,"[603586, 644359]",True,2021-05-12 10:58:20.361000,NM,15,6,mp-1104129,,Sn(Mo3Se4)2,"{'functional': 'PBE', 'labels': ['Sn_d', 'Mo_pv', 'Se'], 'pot_type': 'paw'}","{'Sn': 1.0, 'Mo': 6.0, 'Se': 8.0}",GGA,mp-1104129,"['mp-1104129', 'mp-1104524', 'mp-1431192', 'mp-1708759', 'mp-1812492', 'mp-1608378']",0.0002011,"{'Sn': 1.0, 'Mo': 6.0, 'Se': 8.0}",323.00415145585697,[],NM,False,148,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.225926171338487e-07,0.0002011,0,0.0002011,MP,data/source/MP/cleaned/cifs/MP-mp-1104129.cif,False,,data/final/MP/graphs/Mo6Se8Sn1-MP-mp-1104129.json,0,True,-3,0,0,0,0,0,0,2,1,0,0,0,1.0,False
Bi1La0.8S2Zr0.2O1,3,0.0799999999999999,2.0,False,Bi2La1.6S4Zr0.4O2,Bi2La2S4O2,1.66,Oxide,True,Bi20La16S40Zr4O20,Bi-La-S-Zr-O,5,Supercon,La0.8Zr0.2Bi1S2O1,MP-mp-1078397,La2Bi2S4O2,Bi-La-S-O,Bi20La20S40O20,P 4/n m m,tetragonal,4.055497,4.055497,14.173265,data/final/MP/cifs/Bi1La0.8S2Zr0.2O1-MP-mp-1078397-synth_doped.cif,data/source/MP/raw/cifs/mp-1078397.cif,mp-1078397,1.0743999999999998,,2018-04-11 10:57:38,6.097899749460756,,,{'GGA': {'task_id': 'mp-1676377'}},0.0053330699999989,4.69184382,520.0,-61.66700475,-6.166700475,{'tags': ['Lanthanum bismuth oxodisulphate']},-61.66700475,-6.166700475,-2.09592004425,['bandstructure'],True,[196231],True,2021-05-12 10:58:14.654000,NM,10,5,mp-1078397,oxide,LaBiS2O,"{'functional': 'PBE', 'labels': ['La', 'Bi', 'S', 'O'], 'pot_type': 'paw'}","{'La': 1.0, 'Bi': 1.0, 'S': 2.0, 'O': 1.0}",GGA,mp-1078397,"['mp-1078397', 'mp-1380859', 'mp-1676377', 'mp-1776923', 'mp-1600973']",6.57e-05,"{'La': 2.0, 'Bi': 2.0, 'S': 4.0, 'O': 2.0}",233.1084819815865,[],NM,False,129,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.636860524465146e-07,6.57e-05,0,0.0001314,MP,data/source/MP/cleaned/cifs/MP-mp-1078397.cif,True,,data/final/MP/graphs/Bi1La0.8S2Zr0.2O1-MP-mp-1078397-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ba2Cu4Pr0.15Y0.85O8,2,0.02,1.0,True,Ba2Cu4Pr0.15Y0.85O8,Ba2Cu4Y1O8,72.3,Cuprate,True,Ba13.333Cu26.667Pr1Y5.667O53.333333333333336,Ba-Cu-Pr-Y-O,5,Supercon,Y0.85Pr0.15Ba2Cu4O8,MP-mp-6790,Ba2Y1Cu4O8,Ba-Cu-Y-O,Ba13.333Cu26.667Y6.667O53.333333333333336,C m m m,orthorhombic,3.889922,3.899603999537882,13.88942687,data/final/MP/cifs/Ba2Cu4Pr0.15Y0.85O8-MP-mp-6790-synth_doped.cif,data/source/MP/raw/cifs/mp-6790.cif,mp-6790,0.0,,2011-05-16 03:21:24,5.936250568336678,10.17188/1283441,"@misc{osti_1283441,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Y(CuO2)4 (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1283441"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686864'}},0.0,3.31391536,520.0,-91.58381472,-6.105587648,"{'tags': ['Yttrium barium copper oxide (1/2/4/8)', 'High pressure experimental phase']}",-91.58381472,-6.105587648,-2.0529924817777783,"['xas', 'bandstructure']",True,"[72261, 85273, 74251, 400273, 85277, 85275, 400280, 67632, 85272, 67631, 83920, 66613, 85279, 400277, 75689, 74259, 85278, 85280, 66603, 94265, 400276, 88873, 71417, 75712, 97052, 66605, 72258, 85281, 85274, 400279, 66604, 69698]",True,2021-05-12 10:57:34.594000,NM,15,10,mp-6790,oxide,Ba2Y(CuO2)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-6790,"['mp-1000664', 'mp-6790', 'mp-1007136', 'mp-1237713', 'mp-1440937', 'mp-1686864', 'mp-1834179', 'mp-1011883', 'mp-1590064', 'mp-1590433']",0.0004643,"{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",208.60454115924333,[],NM,False,65,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.225742533790601e-06,0.0004643,0,0.0004643,MP,data/source/MP/cleaned/cifs/MP-mp-6790.cif,True,,data/final/MP/graphs/Ba2Cu4Pr0.15Y0.85O8-MP-mp-6790-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ir1.15Nb0.85,3,0.1499999999999999,1.0,True,Ir1.15Nb0.85,Ir1Nb1,4.675,Other,True,Ir57.5Nb42.5,Ir-Nb,2,Supercon,Ir1.15Nb0.85,MP-mp-1359,Nb1Ir1,Ir-Nb,Ir50Nb50,P 4/m m m,tetragonal,2.884095,2.884095,3.897234,data/final/MP/cifs/Ir1.15Nb0.85-MP-mp-1359-synth_doped.cif,data/source/MP/raw/cifs/mp-1359.cif,mp-1359,0.0,,2011-05-12 22:45:42,14.60516010633782,10.17188/1189675,"@misc{osti_1189675,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbIr (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189675"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688420'}},0.0,7.1614056,520.0,-19.97897518,-9.98948759,{'tags': ['Iridium niobium (1/1)']},-19.97897518,-9.98948759,-0.5196198599999988,"['xas', 'elasticity', 'bandstructure']",True,"[640846, 104509, 640836, 104510, 640829]",True,2021-05-12 10:56:12.755000,NM,2,8,mp-1359,,NbIr,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Ir'], 'pot_type': 'paw'}","{'Nb': 1.0, 'Ir': 1.0}",GGA,mp-1359,"['mp-929389', 'mp-912591', 'mp-929015', 'mp-1359', 'mp-1476237', 'mp-1688420', 'mp-1790803', 'mp-1587899']",2e-06,"{'Nb': 1.0, 'Ir': 1.0}",32.41720788021917,[],NM,False,123,0,"[0, 0]",6.169562805624574e-08,2e-06,0,2e-06,MP,data/source/MP/cleaned/cifs/MP-mp-1359.cif,True,,data/final/MP/graphs/Ir1.15Nb0.85-MP-mp-1359-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Be1H3Li1,1,0.0,12.0,False,Be12H36Li12,Be12H36Li12,0.0,Other,True,Be20H60Li20,Be-H-Li,3,Supercon,Li1Be1H3,MP-mp-570218,Li12Be12H36,Be-H-Li,Be20H60Li20,P 1 21/c 1,monoclinic,6.054225000000001,6.165801,13.21218816,data/final/MP/cifs/Be1H3Li1-MP-mp-570218.cif,data/source/MP/raw/cifs/mp-570218.cif,mp-570218,4.8396,,2013-09-26 16:28:58,0.7736296479348087,10.17188/1275586,"@misc{osti_1275586,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LiBeH3 (SG:14) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1275586"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1017684'}},0.0,-2.000146,520.0,-203.37729862,-3.389621643666666,{'tags': ['Lithium beryllium hydride - alpha']},-203.37729862,-3.389621643666666,-0.3317188703333334,"['xas', 'bandstructure']",True,[162770],True,2021-05-12 10:57:24.969000,NM,60,8,mp-570218,,LiBeH3,"{'functional': 'PBE', 'labels': ['Li_sv', 'Be_sv', 'H'], 'pot_type': 'paw'}","{'Li': 1.0, 'Be': 1.0, 'H': 3.0}",GGA,mp-570218,"['mp-665422', 'mp-1017684', 'mp-1017850', 'mp-657760', 'mp-570218', 'mp-680474', 'mp-1350214', 'mp-1824339']",0.0,"{'Li': 12.0, 'Be': 12.0, 'H': 36.0}",488.7928471521311,[],NM,False,14,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0,0.0,0,0.0,MP,data/source/MP/cleaned/cifs/MP-mp-570218.cif,False,,data/final/MP/graphs/Be1H3Li1-MP-mp-570218.json,0,True,2/m,0,0,3,0,0,0,0,1,0,0,0,1.0,False
As1F0.04Fe1Nd1O0.96,2,0.02,2.0,False,As2F0.08Fe2Nd2O1.92,As2Fe2Nd2O2,0.0,Ferrite,True,As25F1Fe25Nd25O24,As-F-Fe-Nd-O,5,Supercon,Nd1Fe1As1F0.04O0.96,MP-mp-622621,Nd2Fe2As2O2,As-Fe-Nd-O,As25Fe25Nd25O25,P 4/n m m,tetragonal,4.074653,4.074653,9.170967,data/final/MP/cifs/As1F0.04Fe1Nd1O0.96-MP-mp-622621-synth_doped.cif,data/source/MP/raw/cifs/mp-622621.cif,mp-622621,0.0,,2014-02-16 22:28:25,6.347279619112142,10.17188/1278150,"@misc{osti_1278150,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NdFeAsO (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278150"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-1677677'}},0.2809314202083302,3.74777613,520.0,-52.70842543,-6.58855317875,{'tags': ['Neodymium iron arsenic oxide (1/1/1/1)']},-52.70842543,-6.58855317875,-1.61299541125,"['xas', 'bandstructure']",True,"[163547, 164679, 422001, 163546, 236651, 236650, 602466, 164680, 164676]",True,2021-05-12 10:57:28.836000,FM,8,8,mp-622621,oxide,NdFeAsO,"{'functional': 'PBE', 'labels': ['Nd_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Nd': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-622621,"['mp-622621', 'mp-1079381', 'mp-1173401', 'mp-1438697', 'mp-1677677', 'mp-1772072', 'mp-1926310', 'mp-1592869']",3.83954265,"{'Nd': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",152.26370404041757,[],FM,True,129,1,"[0.0, 0.0, 3.6, 3.6, -0.0, -0.0, -0.0, -0.0]",0.0504328024094411,3.83954265,2,7.6790853,MP,data/source/MP/cleaned/cifs/MP-mp-622621.cif,True,,data/final/MP/graphs/As1F0.04Fe1Nd1O0.96-MP-mp-622621-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B2C1Pr1Pt2,1,0.0,1.0,True,B2C1Pr1Pt2,B2C1Pr1Pt2,6.0,Heavy_fermion,True,B33.333C16.667Pr16.667Pt33.333,B-C-Pr-Pt,4,Supercon,Pr1Pt2B2C1,MP-mp-12986,Pr1B2Pt2C1,B-C-Pr-Pt,B33.333C16.667Pr16.667Pt33.333,I 4/m m m,tetragonal,3.874301999939181,3.874301999939181,6.0582614,data/final/MP/cifs/B2C1Pr1Pt2-MP-mp-12986.cif,data/source/MP/raw/cifs/mp-12986.cif,mp-12986,0.0,,2011-05-28 00:52:16,11.561497857095128,10.17188/1189311,"@misc{osti_1189311,
    author = ""Persson, Kristin"",
    title = ""Materials Data on PrB2Pt2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189311"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703744'}},0.0298345505555595,6.85371324,520.0,-43.15227043,-7.192045071666667,{'tags': ['Praseodymium platinum boride carbide (1/2/2/1)']},-43.15227043,-7.192045071666667,-0.6073319372222225,"['xas', 'bandstructure']",True,[157584],True,2021-05-12 10:56:53.126000,NM,6,7,mp-12986,,PrB2Pt2C,"{'functional': 'PBE', 'labels': ['Pr_3', 'B', 'Pt', 'C'], 'pot_type': 'paw'}","{'Pr': 1.0, 'B': 2.0, 'Pt': 2.0, 'C': 1.0}",GGA,mp-12986,"['mp-1007565', 'mp-1001203', 'mp-12986', 'mp-1427524', 'mp-1703744', 'mp-1801864', 'mp-1586140']",0.0008944,"{'Pr': 1.0, 'B': 2.0, 'Pt': 2.0, 'C': 1.0}",81.10716171908128,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",1.1027386251016886e-05,0.0008944,0,0.0008944,MP,data/source/MP/cleaned/cifs/MP-mp-12986.cif,False,,data/final/MP/graphs/B2C1Pr1Pt2-MP-mp-12986.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B2C1Gd0.8Ni2Y0.2,3,0.0666666666666666,1.0,True,B2C1Gd0.8Ni2Y0.2,B2C1Gd1Ni2,0.0,Other,True,B33.333C16.667Gd13.333Ni33.333Y3.333,B-C-Gd-Ni-Y,5,Supercon,Y0.2Gd0.8Ni2B2C1,MP-mp-20728,Gd1Ni2B2C1,B-C-Gd-Ni,B33.333C16.667Gd16.667Ni33.333,I 4/m m m,tetragonal,3.585321997303853,3.585321997303853,5.73680392,data/final/MP/cifs/B2C1Gd0.8Ni2Y0.2-MP-mp-20728-synth_doped.cif,data/source/MP/raw/cifs/mp-20728.cif,mp-20728,0.0,,2014-02-21 09:39:31,7.738100830211668,10.17188/1195889,"@misc{osti_1195889,
    author = ""Persson, Kristin"",
    title = ""Materials Data on GdNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195889"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671216'}},0.0,6.43293366,520.0,-51.21064634,-8.535107723333333,{'tags': []},-51.21064634,-8.535107723333333,-0.4981144163888882,"['xas', 'bandstructure']",True,[79563],True,2021-05-12 10:56:57.051000,FM,6,5,mp-20728,,GdNi2B2C,"{'functional': 'PBE', 'labels': ['Gd', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Gd': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-20728,"['mp-20728', 'mp-1300449', 'mp-1671216', 'mp-1879352', 'mp-1593615']",7.0502106,"{'Gd': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",66.15234913878038,[],FM,True,139,1,"[6.9, 0.0, 0.0, 0.0, 0.0, 0.0]",0.1065753626558208,7.0502106,1,7.0502106,MP,data/source/MP/cleaned/cifs/MP-mp-20728.cif,True,,data/final/MP/graphs/B2C1Gd0.8Ni2Y0.2-MP-mp-20728-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Cu1Ga2,1,0.0,1.0,True,Cu1Ga2,Cu1Ga2,0.0,Other,True,Cu33.333Ga66.667,Cu-Ga,2,Supercon,Cu1Ga2,MP-mp-11359,Ga2Cu1,Cu-Ga,Cu33.333Ga66.667,P 4/m m m,tetragonal,2.839537,2.839537,5.89699,data/final/MP/cifs/Cu1Ga2-MP-mp-11359.cif,data/source/MP/raw/cifs/mp-11359.cif,mp-11359,0.0,,2011-05-28 01:08:44,7.089287099160112,10.17188/1187760,"@misc{osti_1187760,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ga2Cu (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187760"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1670404'}},0.0,4.693622,520.0,-10.40793342,-3.4693111400000003,{'tags': ['Copper gallium (1/2) - phi']},-10.40793342,-3.4693111400000003,-0.0841782350000001,"['xas', 'elasticity', 'bandstructure']",True,[102906],True,2021-05-12 10:56:10.715000,NM,3,9,mp-11359,,Ga2Cu,"{'functional': 'PBE', 'labels': ['Ga_d', 'Cu_pv'], 'pot_type': 'paw'}","{'Ga': 2.0, 'Cu': 1.0}",GGA,mp-11359,"['mp-993392', 'mp-991435', 'mp-11359', 'mp-1140854', 'mp-1438740', 'mp-1670404', 'mp-1791919', 'mp-994697', 'mp-1592742']",0.0004672,"{'Ga': 2.0, 'Cu': 1.0}",47.547255667950246,[],NM,False,123,0,"[0, 0, 0]",9.826014003052577e-06,0.0004672,0,0.0004672,MP,data/source/MP/cleaned/cifs/MP-mp-11359.cif,False,,data/final/MP/graphs/Cu1Ga2-MP-mp-11359.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Fe0.3V1.7Zr1,3,0.1333333333333333,2.0,False,Fe0.6V3.4Zr2,Fe1V3Zr2,4.49,Other,True,Fe10V56.667Zr33.333,Fe-V-Zr,3,Supercon,Zr1V1.7Fe0.3,MP-mp-1215479,Zr2V3Fe1,Fe-V-Zr,Fe16.667V50Zr33.333,R -3 m,trigonal,5.05886391,5.05886391,5.0588644,data/final/MP/cifs/Fe0.3V1.7Zr1-MP-mp-1215479-synth_doped.cif,data/source/MP/raw/cifs/mp-1215479.cif,mp-1215479,0.0,,2019-01-12 17:09:35.009000,6.763800959750897,,,{'GGA': {'task_id': 'mp-1735793'}},0.0,4.99976557,520.0,-53.6198327,-8.936638783333335,{'tags': []},-53.6198327,-8.936638783333335,-0.133784130000001,['bandstructure'],True,[],True,2021-05-12 10:58:39.488000,FM,6,5,mp-1215479,,Zr2V3Fe,"{'functional': 'PBE', 'labels': ['Zr_sv', 'V_pv', 'Fe_pv'], 'pot_type': 'paw'}","{'Zr': 2.0, 'V': 3.0, 'Fe': 1.0}",GGA,mp-1215479,"['mp-1215479', 'mp-1383650', 'mp-1735793', 'mp-1783920', 'mp-1625202']",0.1039697,"{'Zr': 2.0, 'V': 3.0, 'Fe': 1.0}",96.02084571170536,[],FM,True,166,1,"[-0.0, -0.0, -0.0, -0.0, -0.0, 0.1]",0.0010827825898572,0.1039697,1,0.1039697,MP,data/source/MP/cleaned/cifs/MP-mp-1215479.cif,True,,data/final/MP/graphs/Fe0.3V1.7Zr1-MP-mp-1215479-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
B2C1Ni1.94Ru0.06Y1,2,0.02,1.0,True,B2C1Ni1.94Ru0.06Y1,B2C1Ni2Y1,8.7,Other,True,B33.333C16.667Ni32.333Ru1Y16.667,B-C-Ni-Ru-Y,5,Supercon,Y1Ni1.94Ru0.06B2C1,MP-mp-6576,Y1Ni2B2C1,B-C-Ni-Y,B33.333C16.667Ni33.333Y16.667,I 4/m m m,tetragonal,3.548790000501972,3.548790000501972,5.76144136,data/final/MP/cifs/B2C1Ni1.94Ru0.06Y1-MP-mp-6576-synth_doped.cif,data/source/MP/raw/cifs/mp-6576.cif,mp-6576,0.0,,2011-05-13 05:21:43,6.099730998852292,10.17188/1281366,"@misc{osti_1281366,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281366"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688230'}},0.0,6.81083016,520.0,-43.677878,-7.279646333333333,{'tags': []},-43.677878,-7.279646333333333,-0.5109282141666659,"['xas', 'bandstructure']",True,"[75816, 89142, 83231, 79574, 41549]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6576,,YNi2B2C,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6576,"['mp-6576', 'mp-1007054', 'mp-1000583', 'mp-1439516', 'mp-1688230', 'mp-1794280', 'mp-1011792', 'mp-1597064']",0.0006603,"{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.3152437079014,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",1.010943177297096e-05,0.0006603,0,0.0006603,MP,data/source/MP/cleaned/cifs/MP-mp-6576.cif,True,,data/final/MP/graphs/B2C1Ni1.94Ru0.06Y1-MP-mp-6576-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
In2O3,1,0.0,8.0,False,In16O24,In16O24,3.3,Oxide,True,In40O60,In-O,2,Supercon,In2O3,MP-mp-22598,In16O24,In-O,In40O60,I a -3,cubic,8.919682341977353,8.919682339999998,8.91968234,data/final/MP/cifs/In2O3-MP-mp-22598.cif,data/source/MP/raw/cifs/mp-22598.cif,mp-22598,0.9325,,2013-10-11 21:41:47,6.751274625874237,10.17188/1198812,"@misc{osti_1198812,
    author = ""Persson, Kristin"",
    title = ""Materials Data on In2O3 (SG:206) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198812"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1766487'}},0.0,5.1450695,520.0,-226.17253952,-5.654313488,"{'tags': ['Diindium trioxide', 'Indium oxide (2/3)', 'Diindium trioxide - C-type', 'Indium oxide']}",-226.17253952,-5.654313488,-1.997063393,"['diel', 'xas', 'elasticity', 'bandstructure']",True,"[181833, 190344, 182792, 169426, 184331, 14388, 169432, 190345, 182789, 41265, 169429, 640178, 33649, 640179, 169423, 187791, 14387, 169420]",True,2021-05-12 10:56:16.728000,NM,40,18,mp-22598,oxide,In2O3,"{'functional': 'PBE', 'labels': ['In_d', 'O'], 'pot_type': 'paw'}","{'In': 2.0, 'O': 3.0}",GGA,mp-22598,"['mp-682796', 'mp-648127', 'mp-702736', 'mp-713130', 'mp-562294', 'mp-22598', 'mp-1142068', 'mp-1197160', 'mp-1197373', 'mp-1197541', 'mp-1199264', 'mp-1199572', 'mp-1201543', 'mp-1204419', 'mp-1430484', 'mp-1766487', 'mp-1926903', 'mp-1616123']",6.58e-05,"{'In': 16.0, 'O': 24.0}",546.2938018339478,[],NM,False,206,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",9.635840608713428e-07,6.58e-05,0,0.0005264,MP,data/source/MP/cleaned/cifs/MP-mp-22598.cif,False,,data/final/MP/graphs/In2O3-MP-mp-22598.json,0,True,m-3,2,0,0,0,0,0,0,0,0,1,0,1.0,False
Dy1Pd2Sn1,1,0.0,1.0,True,Dy1Pd2Sn1,Dy1Pd2Sn1,0.0,Other,True,Dy25Pd50Sn25,Dy-Pd-Sn,3,Supercon,Pd2Dy1Sn1,MP-mp-21014,Dy1Sn1Pd2,Dy-Pd-Sn,Dy25Pd50Sn25,F m -3 m,cubic,4.8080758,4.8080758,4.8080758,data/final/MP/cifs/Dy1Pd2Sn1-MP-mp-21014.cif,data/source/MP/raw/cifs/mp-21014.cif,mp-21014,0.0,,2014-02-21 06:35:03,10.438091093838212,10.17188/1196258,"@misc{osti_1196258,
    author = ""Persson, Kristin"",
    title = ""Materials Data on DySnPd2 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196258"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668014'}},0.0,6.33062368,520.0,-22.48512809,-5.6212820225,{'tags': ['Dysprosium palladium tin (1/2/1)']},-22.48512809,-5.6212820225,-0.8772514437500005,"['xas', 'bandstructure']",True,"[103349, 630101, 103350]",True,2021-05-12 10:56:57.051000,NM,4,8,mp-21014,,DySnPd2,"{'functional': 'PBE', 'labels': ['Dy_3', 'Sn_d', 'Pd'], 'pot_type': 'paw'}","{'Dy': 1.0, 'Sn': 1.0, 'Pd': 2.0}",GGA,mp-21014,"['mp-993715', 'mp-991991', 'mp-21014', 'mp-1438831', 'mp-1668014', 'mp-1798523', 'mp-995006', 'mp-1588604']",0.0012057,"{'Dy': 1.0, 'Sn': 1.0, 'Pd': 2.0}",78.59572391910051,[],NM,False,225,0,"[0, 0, 0, 0]",1.5340529228295436e-05,0.0012057,0,0.0012057,MP,data/source/MP/cleaned/cifs/MP-mp-21014.cif,False,,data/final/MP/graphs/Dy1Pd2Sn1-MP-mp-21014.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Fe3Lu1.94Sc0.06Si5,2,0.012,4.0,False,Fe12Lu7.76Sc0.24Si20,Fe12Lu8Si20,4.83,Other,True,Fe30Lu19.4Sc0.6Si50,Fe-Lu-Sc-Si,4,Supercon,Lu1.94Sc0.06Fe3Si5,MP-mp-541557,Lu8Fe12Si20,Fe-Lu-Si,Fe30Lu20Si50,P 4/m n c,tetragonal,5.385917,10.270814,10.270814,data/final/MP/cifs/Fe3Lu1.94Sc0.06Si5-MP-mp-541557-synth_doped.cif,data/source/MP/raw/cifs/mp-541557.cif,mp-541557,0.0,,2014-03-04 18:23:36,7.69125622397548,10.17188/1265154,"@misc{osti_1265154,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Lu2Fe3Si5 (SG:128) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1265154"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1746411'}},0.0,7.47471245,520.0,-273.951322,-6.84878305,{'tags': ['Lutetium iron silicide (2/3/5)']},-273.951322,-6.84878305,-0.6554334009999998,"['xas', 'bandstructure']",True,"[84198, 247832, 632470]",True,2021-05-12 10:57:10.838000,NM,40,10,mp-541557,,Lu2Fe3Si5,"{'functional': 'PBE', 'labels': ['Lu_3', 'Fe_pv', 'Si'], 'pot_type': 'paw'}","{'Lu': 2.0, 'Fe': 3.0, 'Si': 5.0}",GGA,mp-541557,"['mp-939885', 'mp-916724', 'mp-937397', 'mp-541557', 'mp-1170743', 'mp-1200451', 'mp-1255960', 'mp-1383694', 'mp-1746411', 'mp-1892871']",0.000409375,"{'Lu': 8.0, 'Fe': 12.0, 'Si': 20.0}",568.1583388804236,[],NM,False,90,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",2.8821190994516645e-06,0.000409375,0,0.0016375,MP,data/source/MP/cleaned/cifs/MP-mp-541557.cif,True,,data/final/MP/graphs/Fe3Lu1.94Sc0.06Si5-MP-mp-541557-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
La1Mo6S8,1,0.0,1.0,True,La1Mo6S8,La1Mo6S8,6.73,Chevrel,True,La6.667Mo40S53.333,La-Mo-S,3,Supercon,La1Mo6S8,MP-mp-1103974,La1Mo6S8,La-Mo-S,La6.667Mo40S53.333,R -3,trigonal,6.57425946,6.57425946,6.57425947,data/final/MP/cifs/La1Mo6S8-MP-mp-1103974.cif,data/source/MP/raw/cifs/mp-1103974.cif,mp-1103974,0.0,,2018-07-18 20:45:56,5.677643205722519,,,{'GGA': {'task_id': 'mp-1697045'}},0.0,6.59308123,520.0,-117.30068689,-7.820045792666666,"{'tags': ['Lanthanum molybdenum sulfide (1/6/8)', 'Lanthanum molybdenum(II/III) sulfide  (1/6/8)', 'Lanthanum(III) molybdenum(II/III) sulfide (1/6/8)']}",-117.30068689,-7.820045792666666,-1.214881511333333,['bandstructure'],True,"[641455, 641457, 600655, 603455, 641458]",True,2021-05-12 10:58:20.361000,NM,15,9,mp-1103974,,La(Mo3S4)2,"{'functional': 'PBE', 'labels': ['La', 'Mo_pv', 'S'], 'pot_type': 'paw'}","{'La': 1.0, 'Mo': 6.0, 'S': 8.0}",GGA,mp-1103974,"['mp-1103974', 'mp-1104231', 'mp-1104351', 'mp-1104736', 'mp-1104992', 'mp-1419412', 'mp-1697045', 'mp-1924006', 'mp-1599522']",0.0016878,"{'La': 1.0, 'Mo': 6.0, 'S': 8.0}",284.0073056256957,[],NM,False,148,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.942804873563419e-06,0.0016878,0,0.0016878,MP,data/source/MP/cleaned/cifs/MP-mp-1103974.cif,False,,data/final/MP/graphs/La1Mo6S8-MP-mp-1103974.json,0,True,-3,0,0,0,0,0,0,2,1,0,0,0,1.0,False
Fe1Se0.98,2,0.0101010101010101,2.0,False,Fe2Se1.96,Fe2Se2,8.105,Ferrite,True,Fe50.505Se49.495,Fe-Se,2,Supercon,Fe1Se0.98,MP-mp-20311,Fe2Se2,Fe-Se,Fe50Se50,P 4/n m m,tetragonal,3.688905,3.688905,5.854194,data/final/MP/cifs/Fe1Se0.98-MP-mp-20311-synth_doped.cif,data/source/MP/raw/cifs/mp-20311.cif,mp-20311,0.0,,2013-10-20 07:09:24,5.619828229873189,10.17188/1195438,"@misc{osti_1195438,
    author = ""Persson, Kristin"",
    title = ""Materials Data on FeSe (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195438"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668877'}},0.0,3.48880228,520.0,-25.01949237,-6.2548730925,"{'tags': ['Iron selenide - NN AFM', 'Iron selenide - orthorhombic, LT', 'Iron selenide', 'Iron sulfide', 'Iron selenide (1/1) - nonmagnetic', 'Iron selenide - tetragonal', 'Iron selenide - alpha LT', 'Iron selenide - LT', 'High pressure experimental phase', 'Iron selenide - alpha']}",-25.01949237,-6.2548730925,-0.5079131286718743,"['xas', 'elasticity', 'bandstructure']",True,"[196301, 196298, 196299, 196297, 290701, 165958, 185464, 163561, 169257, 163560, 977900, 169311, 169303, 26889, 166440, 162901, 169283, 165957, 169271, 977903, 169259, 977901, 185465, 165959, 169306, 169267, 163557, 169287, 169297, 169289, 163556, 169299, 163562, 166441, 182544, 163559, 169269, 169263, 169265, 169315, 169255, 166439, 169293, 169313, 163555, 169291, 169301, 165960, 169253, 169295, 169970, 163558, 169285, 169261, 169309]",True,2021-05-12 10:56:14.760000,NM,4,55,mp-20311,,FeSe,"{'functional': 'PBE', 'labels': ['Fe_pv', 'Se'], 'pot_type': 'paw'}","{'Fe': 1.0, 'Se': 1.0}",GGA,mp-20311,"['mp-684656', 'mp-20311', 'mp-1063646', 'mp-1063662', 'mp-1063681', 'mp-1063669', 'mp-1063680', 'mp-1063695', 'mp-1063686', 'mp-1063699', 'mp-1063715', 'mp-1063717', 'mp-1063876', 'mp-1063734', 'mp-1063891', 'mp-1063735', 'mp-1063910', 'mp-1063918', 'mp-1063922', 'mp-1063931', 'mp-1063774', 'mp-1063781', 'mp-1064091', 'mp-1064111', 'mp-1063801', 'mp-1064112', 'mp-1064180', 'mp-1064138', 'mp-1064153', 'mp-1065102', 'mp-1065123', 'mp-1065075', 'mp-1065161', 'mp-1065131', 'mp-1065030', 'mp-1065055', 'mp-1065085', 'mp-1065094', 'mp-1440814', 'mp-1668877', 'mp-1799618', 'mp-1593782', 'mp-1592730', 'mp-1065081', 'mp-1065148', 'mp-1063928', 'mp-1063726', 'mp-1063683', 'mp-1063709', 'mp-1063911', 'mp-1063795', 'mp-1065121', 'mp-1063725', 'mp-1064139', 'mp-1064165']",3.455e-05,"{'Fe': 2.0, 'Se': 2.0}",79.66398961559156,[],NM,False,129,0,"[0, 0, 0, 0]",8.673931638803586e-07,3.455e-05,0,6.91e-05,MP,data/source/MP/cleaned/cifs/MP-mp-20311.cif,True,,data/final/MP/graphs/Fe1Se0.98-MP-mp-20311-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
As2Ba0.9Fe2K0.1,3,0.0933333333333333,3.0,False,As6Ba2.7Fe6K0.3,As6Ba2Fe6K1,3.5,Ferrite,True,As40Ba18Fe40K2,As-Ba-Fe-K,4,Supercon,Ba0.9K0.1Fe2As2,MP-mp-1223567,K1Ba2Fe6As6,As-Ba-Fe-K,As40Ba13.333Fe40K6.667,C 1 2/m 1,monoclinic,5.48060788,7.102799640000001,8.784942288492543,data/final/MP/cifs/As2Ba0.9Fe2K0.1-MP-mp-1223567-synth_doped.cif,data/source/MP/raw/cifs/mp-1223567.cif,mp-1223567,0.0,,2019-01-12 23:56:38.667000,6.101417464045543,,,,0.0186882046666676,4.38014394,520.0,-90.51509253,-6.034339502,{'tags': []},-90.51509253,-6.034339502,-0.4527993862000007,[],False,[],True,2021-05-12 11:00:52.054000,FM,15,4,mp-1223567,,KBa2(FeAs)6,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 2.0, 'Fe': 6.0, 'As': 6.0}",GGA,mp-1223567,"['mp-1223567', 'mp-1374097', 'mp-1656306', 'mp-1808539']",1.3326448,"{'K': 1.0, 'Ba': 2.0, 'Fe': 6.0, 'As': 6.0}",298.92336486922324,[],FM,True,12,2,"[0.0, 0.0, 0.0, 0.3, 0.3, 0.1, 0.3, 0.1, 0.3, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0044581486649028,1.3326448,6,1.3326448,MP,data/source/MP/cleaned/cifs/MP-mp-1223567.cif,True,,data/final/MP/graphs/As2Ba0.9Fe2K0.1-MP-mp-1223567-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
Rh4Sn13Yb3,1,0.0,2.0,False,Rh8Sn26Yb6,Rh8Sn26Yb6,7.833333333,Heavy_fermion,True,Rh20Sn65Yb15,Rh-Sn-Yb,3,Supercon,Yb3Rh4Sn13,MP-mp-3046,Yb6Sn26Rh8,Rh-Sn-Yb,Rh20Sn65Yb15,P m -3 n,cubic,9.79411,9.79411,9.79411,data/final/MP/cifs/Rh4Sn13Yb3-MP-mp-3046.cif,data/source/MP/raw/cifs/mp-3046.cif,mp-3046,0.0,,2014-02-16 00:36:43,8.745385156575146,10.17188/1204867,"@misc{osti_1204867,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Yb3Sn13Rh4 (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1204867"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-942088'}},0.0,7.35116175,520.0,-193.6328374,-4.840820935,"{'tags': ['Yttterbium rhodium tin (3/4/13)', 'Ytterbium rhodium stannide (3/4/13)', 'Rhodium ytterbium tin (4/3/13)']}",-193.6328374,-4.840820935,-0.5307964132499997,"['xas', 'bandstructure']",True,"[105936, 650408, 604422]",True,2021-05-12 10:57:04.957000,NM,40,6,mp-3046,,Yb3Sn13Rh4,"{'functional': 'PBE', 'labels': ['Yb_2', 'Sn_d', 'Rh_pv'], 'pot_type': 'paw'}","{'Yb': 3.0, 'Sn': 13.0, 'Rh': 4.0}",GGA,mp-3046,"['mp-943137', 'mp-942088', 'mp-932826', 'mp-3046', 'mp-1199717', 'mp-1347562']",0.0011911,"{'Yb': 6.0, 'Sn': 26.0, 'Rh': 8.0}",939.4959929434036,[],NM,False,115,0,"[0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",2.535614859342468e-06,0.0011911,0,0.0023822,MP,data/source/MP/cleaned/cifs/MP-mp-3046.cif,False,,data/final/MP/graphs/Rh4Sn13Yb3-MP-mp-3046.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ce0.95Co1In5Yb0.05,2,0.0142857142857142,1.0,True,Ce0.95Co1In5Yb0.05,Ce1Co1In5,1.945,Heavy_fermion,True,Ce13.571Co14.286In71.429Yb0.714,Ce-Co-In-Yb,4,Supercon,Ce0.95Yb0.05Co1In5,MP-mp-19961,Ce1In5Co1,Ce-Co-In,Ce14.286Co14.286In71.429,P 4/m m m,tetragonal,4.635989,4.635989,7.564124,data/final/MP/cifs/Ce0.95Co1In5Yb0.05-MP-mp-19961-synth_doped.cif,data/source/MP/raw/cifs/mp-19961.cif,mp-19961,0.0,,2014-02-21 14:08:25,7.897022127398995,10.17188/1195145,"@misc{osti_1195145,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeIn5Co (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195145"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701944'}},0.0,7.80626318,520.0,-28.52795357,-4.075421938571429,{'tags': ['Cerium cobalt indium (1/1/5)']},-28.52795357,-4.075421938571429,-0.2468754242857146,"['xas', 'bandstructure']",True,[102108],True,2021-05-12 10:56:57.051000,FM,7,8,mp-19961,,CeIn5Co,"{'functional': 'PBE', 'labels': ['Ce', 'In_d', 'Co'], 'pot_type': 'paw'}","{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",GGA,mp-19961,"['mp-928775', 'mp-912209', 'mp-928270', 'mp-19961', 'mp-1504062', 'mp-1701944', 'mp-1785253', 'mp-1593180']",0.9310323,"{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",162.57113333428427,[],FM,True,123,1,"[0.7, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0057269226147644,0.9310323,1,0.9310323,MP,data/source/MP/cleaned/cifs/MP-mp-19961.cif,True,,data/final/MP/graphs/Ce0.95Co1In5Yb0.05-MP-mp-19961-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Be13Mo1,2,0.0109890109890109,0.9230384615384616,True,Be12Mo0.923,Be12Mo1,0.0,Other,True,Be92.857Mo7.143,Be-Mo,2,Supercon,Be13Mo1,MP-mp-1475,Be12Mo1,Be-Mo,Be92.308Mo7.692,I 4/m m m,tetragonal,4.196968002060744,5.520535490728164,5.520535490000001,data/final/MP/cifs/Be13Mo1-MP-mp-1475-synth_doped.cif,data/source/MP/raw/cifs/mp-1475.cif,mp-1475,0.0,,2011-05-13 08:19:46,3.0970015373398945,10.17188/1190877,"@misc{osti_1190877,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Be12Mo (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1190877"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701877'}},0.0,5.13670239,520.0,-57.38006194,-4.413850918461538,{'tags': ['Beryllium molybdenum (12/1)']},-57.38006194,-4.413850918461538,-0.1278049638461541,"['xas', 'elasticity', 'bandstructure']",True,"[58717, 616334, 616339]",True,2021-05-12 10:56:12.755000,NM,13,8,mp-1475,,Be12Mo,"{'functional': 'PBE', 'labels': ['Be_sv', 'Mo_pv'], 'pot_type': 'paw'}","{'Be': 12.0, 'Mo': 1.0}",GGA,mp-1475,"['mp-930536', 'mp-913636', 'mp-929990', 'mp-1475', 'mp-1418995', 'mp-1701877', 'mp-1803804', 'mp-1601858']",0.0024745,"{'Be': 12.0, 'Mo': 1.0}",109.42619091380918,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0]",2.261341621540193e-05,0.0024745,0,0.0024745,MP,data/source/MP/cleaned/cifs/MP-mp-1475.cif,True,,data/final/MP/graphs/Be13Mo1-MP-mp-1475-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Gd0.05Pd2Sn1Y0.95,2,0.025,1.0,True,Gd0.05Pd2Sn1Y0.95,Pd2Sn1Y1,2.41,Other,True,Gd1.25Pd50Sn25Y23.75,Gd-Pd-Sn-Y,4,Supercon,Pd2Y0.95Gd0.05Sn1,MP-mp-5538,Y1Sn1Pd2,Pd-Sn-Y,Pd50Sn25Y25,F m -3 m,cubic,4.81595014,4.81595014,4.81595014,data/final/MP/cifs/Gd0.05Pd2Sn1Y0.95-MP-mp-5538-synth_doped.cif,data/source/MP/raw/cifs/mp-5538.cif,mp-5538,0.0,,2011-05-13 01:04:13,8.839720826473608,10.17188/1267618,"@misc{osti_1267618,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YSnPd2 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1267618"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687523'}},0.0,6.33853657,520.0,-24.32859047,-6.0821476175,"{'tags': ['Palladium yttrium stannide (2/1/1)', 'Palladium tin yttrium (2/1/1)']}",-24.32859047,-6.0821476175,-0.873195970416667,"['xas', 'elasticity', 'bandstructure']",True,"[105699, 648949, 105700, 424011, 648950]",True,2021-05-12 10:56:22.739000,NM,4,12,mp-5538,,YSnPd2,"{'functional': 'PBE', 'labels': ['Y_sv', 'Sn_d', 'Pd'], 'pot_type': 'paw'}","{'Y': 1.0, 'Sn': 1.0, 'Pd': 2.0}",GGA,mp-5538,"['mp-1008093', 'mp-1001657', 'mp-5538', 'mp-1065654', 'mp-1065644', 'mp-1065683', 'mp-1439031', 'mp-1687523', 'mp-1801498', 'mp-1012418', 'mp-1593849', 'mp-1065696']",0.0001592,"{'Y': 1.0, 'Sn': 1.0, 'Pd': 2.0}",78.98251295612837,[],NM,False,225,0,"[0, 0, 0, 0]",2.015636044505563e-06,0.0001592,0,0.0001592,MP,data/source/MP/cleaned/cifs/MP-mp-5538.cif,True,,data/final/MP/graphs/Gd0.05Pd2Sn1Y0.95-MP-mp-5538-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ge1.9Pd2Si0.1Sr1,2,0.04,1.0,True,Ge1.9Pd2Si0.1Sr1,Ge2Pd2Sr1,2.7,Other,True,Ge38Pd40Si2Sr20,Ge-Pd-Si-Sr,4,Supercon,Sr1Pd2Si0.1Ge1.9,MP-mp-978986,Sr1Ge2Pd2,Ge-Pd-Sr,Ge40Pd40Sr20,I 4/m m m,tetragonal,4.438671999438209,4.438671999438209,6.03054834,data/final/MP/cifs/Ge1.9Pd2Si0.1Sr1-MP-mp-978986-synth_doped.cif,data/source/MP/raw/cifs/mp-978986.cif,mp-978986,0.0,,2015-10-09 03:56:43,7.295677176868866,10.17188/1316057,"@misc{osti_1316057,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr(GePd)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1316057"",
    place = ""United States"",
    year = ""2016"",
    month = ""9"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688092'}},0.0,4.0155429,520.0,-24.8627221,-4.97254442,"{'tags': ['Strontium palladium germanide (1/2/2)', 'Strontium palladium germanium (1/2/2)', 'High pressure experimental phase']}",-24.8627221,-4.97254442,-0.7134818633333324,"['xas', 'elasticity', 'bandstructure']",True,"[165985, 181157, 181155, 181156, 168133]",True,2021-05-12 10:56:37.246000,NM,5,9,mp-978986,,Sr(GePd)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ge_d', 'Pd'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Ge': 2.0, 'Pd': 2.0}",GGA,mp-978986,"['mp-1005776', 'mp-978986', 'mp-1005866', 'mp-979737', 'mp-1438850', 'mp-1688092', 'mp-1782349', 'mp-1011093', 'mp-1589601']",0.0012593,"{'Sr': 1.0, 'Ge': 2.0, 'Pd': 2.0}",101.45304755163892,[],NM,False,139,0,"[0, 0, 0, 0, 0]",1.2412638460752248e-05,0.0012593,0,0.0012593,MP,data/source/MP/cleaned/cifs/MP-mp-978986.cif,True,,data/final/MP/graphs/Ge1.9Pd2Si0.1Sr1-MP-mp-978986-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Pt2Th1,1,0.0,2.0,False,Pt4Th2,Pt4Th2,0.0,Other,True,Pt66.667Th33.333,Pt-Th,2,Supercon,Pt2Th1,MP-mp-1070844,Th2Pt4,Pt-Th,Pt66.667Th33.333,I 4/m m m,tetragonal,4.201485997420738,4.201485997420737,7.84620758,data/final/MP/cifs/Pt2Th1-MP-mp-1070844.cif,data/source/MP/raw/cifs/mp-1070844.cif,mp-1070844,0.0,,2018-03-22 04:06:16,16.119474696671197,,,{'GGA': {'task_id': 'mp-1688629'}},0.0,7.37071254,520.0,-46.51312747,-7.752187911666667,{'tags': ['Thorium platinum (1/2)']},-46.51312747,-7.752187911666667,-1.2336300216666665,['bandstructure'],True,[251818],True,2021-05-12 10:58:14.654000,NM,6,8,mp-1070844,,ThPt2,"{'functional': 'PBE', 'labels': ['Th', 'Pt'], 'pot_type': 'paw'}","{'Th': 1.0, 'Pt': 2.0}",GGA,mp-1070844,"['mp-1070963', 'mp-1070844', 'mp-1070885', 'mp-1300926', 'mp-1688629', 'mp-1803736', 'mp-1594576', 'mp-1070956']",3.95e-05,"{'Th': 2.0, 'Pt': 4.0}",128.192449139627,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",6.162609461806391e-07,3.95e-05,0,7.9e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1070844.cif,False,,data/final/MP/graphs/Pt2Th1-MP-mp-1070844.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
P2Pd2Pr1,1,0.0,1.0,True,P2Pd2Pr1,P2Pd2Pr1,0.0,Heavy_fermion,True,P40Pd40Pr20,P-Pd-Pr,3,Supercon,Pr1Pd2P2,MP-mp-1206418,Pr1P2Pd2,P-Pd-Pr,P40Pd40Pr20,I 4/m m m,tetragonal,4.18881600159648,4.18881600159648,5.81992065,data/final/MP/cifs/P2Pd2Pr1-MP-mp-1206418.cif,data/source/MP/raw/cifs/mp-1206418.cif,mp-1206418,0.0,,2019-01-12 09:44:00.165000,7.852692838921624,,,{'GGA': {'task_id': 'mp-1757860'}},0.0,6.76763843,520.0,-30.7677743,-6.15355486,"{'tags': ['PrPd2P2', 'CeAl2Ga2']}",-30.7677743,-6.15355486,-0.9601013043333324,['bandstructure'],True,[],True,2021-05-12 10:58:37.524000,NM,5,5,mp-1206418,,Pr(PPd)2,"{'functional': 'PBE', 'labels': ['Pr_3', 'P', 'Pd'], 'pot_type': 'paw'}","{'Pr': 1.0, 'P': 2.0, 'Pd': 2.0}",GGA,mp-1206418,"['mp-1206418', 'mp-1392642', 'mp-1757860', 'mp-1783494', 'mp-1585664']",0.0001747,"{'Pr': 1.0, 'P': 2.0, 'Pd': 2.0}",87.90335880740717,[],NM,False,139,0,"[0, 0, 0, 0, 0]",1.98740983700931e-06,0.0001747,0,0.0001747,MP,data/source/MP/cleaned/cifs/MP-mp-1206418.cif,False,,data/final/MP/graphs/P2Pd2Pr1-MP-mp-1206418.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ga1La3,1,0.0,1.0,True,Ga1La3,Ga1La3,5.82,Other,True,Ga25La75,Ga-La,2,Supercon,Ga1La3,MP-mp-20487,La3Ga1,Ga-La,Ga25La75,P m -3 m,cubic,4.932381,4.932381,4.932381,data/final/MP/cifs/Ga1La3-MP-mp-20487.cif,data/source/MP/raw/cifs/mp-20487.cif,mp-20487,0.0,,2014-02-21 07:00:58,6.731440356272905,10.17188/1195615,"@misc{osti_1195615,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La3Ga (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195615"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702598'}},0.0454965302083332,7.83763566,520.0,-18.88500927,-4.7212523175,{'tags': ['Gallium lanthanum (1/3)']},-18.88500927,-4.7212523175,-0.2622229831250005,"['xas', 'elasticity', 'bandstructure']",True,"[103765, 603198]",True,2021-05-12 10:56:14.760000,NM,4,8,mp-20487,,La3Ga,"{'functional': 'PBE', 'labels': ['La', 'Ga_d'], 'pot_type': 'paw'}","{'La': 3.0, 'Ga': 1.0}",GGA,mp-20487,"['mp-929280', 'mp-912447', 'mp-928894', 'mp-20487', 'mp-1438162', 'mp-1702598', 'mp-1803959', 'mp-1594323']",0.0012565,"{'La': 3.0, 'Ga': 1.0}",119.99685076108948,[],NM,False,221,0,"[0, 0, 0, 0]",1.0471108133509754e-05,0.0012565,0,0.0012565,MP,data/source/MP/cleaned/cifs/MP-mp-20487.cif,False,,data/final/MP/graphs/Ga1La3-MP-mp-20487.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Nb3Te4,1,0.0,2.0,False,Nb6Te8,Nb6Te8,1.746666667,Chevrel,True,Nb42.857Te57.143,Nb-Te,2,Supercon,Nb3Te4,MP-mp-7564,Nb6Te8,Nb-Te,Nb42.857Te57.143,P 63/m,hexagonal,3.663095,10.83943400351878,10.83943469,data/final/MP/cifs/Nb3Te4-MP-mp-7564.cif,data/source/MP/raw/cifs/mp-7564.cif,mp-7564,0.0,,2011-06-03 03:06:59,7.031202556166284,10.17188/1290498,"@misc{osti_1290498,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Te4 (SG:176) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1290498"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1676660'}},0.0,6.07828308,520.0,-92.21999746,-6.5871426757142855,{'tags': ['Niobium telluride (3/4)']},-92.21999746,-6.5871426757142855,-0.7029828414285717,['bandstructure'],True,"[16606, 645534]",True,2021-05-12 10:58:59.602000,NM,14,9,mp-7564,,Nb3Te4,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Te'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Te': 4.0}",GGA,mp-7564,"['mp-925066', 'mp-924294', 'mp-909328', 'mp-7564', 'mp-1104147', 'mp-1380979', 'mp-1676660', 'mp-1842592', 'mp-1604151']",0.0006377,"{'Nb': 6.0, 'Te': 8.0}",372.7280361231014,[],NM,False,176,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.4217978697442872e-06,0.0006377,0,0.0012754,MP,data/source/MP/cleaned/cifs/MP-mp-7564.cif,False,,data/final/MP/graphs/Nb3Te4-MP-mp-7564.json,0,True,6/m,0,3,0,0,0,0,0,1,0,0,0,1.0,False
Ru2Th1,1,0.0,2.0,False,Ru4Th2,Ru4Th2,3.68,Other,True,Ru66.667Th33.333,Ru-Th,2,Supercon,Ru2Th1,MP-mp-574438,Th2Ru4,Ru-Th,Ru66.667Th33.333,F d -3 m,cubic,5.433971360000001,5.43397136,5.43397136,data/final/MP/cifs/Ru2Th1-MP-mp-574438.cif,data/source/MP/raw/cifs/mp-574438.cif,mp-574438,0.0,,2014-02-28 05:45:15,12.708957533514832,10.17188/1276579,"@misc{osti_1276579,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ThRu2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1276579"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-918592'}},0.0384871966666633,8.28589698,520.0,-53.8389712,-8.973161866666667,"{'tags': ['Ruthenium thorium (2/1)', 'Thorium ruthenium (1/2)']}",-53.8389712,-8.973161866666667,-0.3189493466666668,"['xas', 'elasticity', 'bandstructure']",True,"[650730, 150740, 106002, 650723, 650729, 650731, 106003]",True,2021-05-12 10:56:27.046000,NM,6,7,mp-574438,,ThRu2,"{'functional': 'PBE', 'labels': ['Th', 'Ru_pv'], 'pot_type': 'paw'}","{'Th': 1.0, 'Ru': 2.0}",GGA,mp-574438,"['mp-919588', 'mp-905408', 'mp-918592', 'mp-574438', 'mp-1439663', 'mp-1802924', 'mp-1592175']",0.00057545,"{'Th': 2.0, 'Ru': 4.0}",113.45850020968712,[],NM,False,166,0,"[0.0, 0.0, 0.0, 0.0, 0.0, -0.0]",1.0143797052428654e-05,0.00057545,0,0.0011509,MP,data/source/MP/cleaned/cifs/MP-mp-574438.cif,False,,data/final/MP/graphs/Ru2Th1-MP-mp-574438.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ir2P1,1,0.0,1.0,True,Ir2P1,Ir2P1,0.0,Other,True,Ir66.667P33.333,Ir-P,2,Supercon,Ir2P1,MP-mp-2082,P1Ir2,Ir-P,Ir66.667P33.333,F m -3 m,cubic,3.95654104,3.956541039999999,3.956541039999999,data/final/MP/cifs/Ir2P1-MP-mp-2082.cif,data/source/MP/raw/cifs/mp-2082.cif,mp-2082,0.0,,2011-05-12 19:20:52,15.75040325840687,10.17188/1196023,"@misc{osti_1196023,
    author = ""Persson, Kristin"",
    title = ""Materials Data on PIr2 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196023"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686712'}},0.0,9.48099712,520.0,-24.32393407,-8.107978023333333,"{'tags': ['Iridium phosphide (2/1)', 'Iridium platinum (2/1)']}",-24.32393407,-8.107978023333333,-0.4112569077777775,"['xas', 'elasticity', 'bandstructure']",True,"[640920, 640898]",True,2021-05-12 10:56:14.760000,NM,3,8,mp-2082,,PIr2,"{'functional': 'PBE', 'labels': ['P', 'Ir'], 'pot_type': 'paw'}","{'P': 1.0, 'Ir': 2.0}",GGA,mp-2082,"['mp-1008301', 'mp-1001958', 'mp-2082', 'mp-1439721', 'mp-1686712', 'mp-1794760', 'mp-1012592', 'mp-1589169']",0.0005614,"{'P': 1.0, 'Ir': 2.0}",43.795755959561845,[],NM,False,225,0,"[0, 0, 0]",1.2818593667348962e-05,0.0005614,0,0.0005614,MP,data/source/MP/cleaned/cifs/MP-mp-2082.cif,False,,data/final/MP/graphs/Ir2P1-MP-mp-2082.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ag2O1,1,0.0,2.0,False,Ag4O2,Ag4O2,0.0,Oxide,True,Ag66.667O33.333333333333336,Ag-O,2,Supercon,Ag2O1,MP-mp-353,Ag4O2,Ag-O,Ag66.667O33.333333333333336,P n -3 m,cubic,4.840837,4.840837,4.840837,data/final/MP/cifs/Ag2O1-MP-mp-353.cif,data/source/MP/raw/cifs/mp-353.cif,mp-353,0.0597999999999999,,2011-05-13 05:32:13,6.784390642779099,10.17188/1206976,"@misc{osti_1206976,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ag2O (SG:224) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1206976"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686802'}},0.0,0.82387898,520.0,-21.78747587,-3.6312459783333337,{'tags': ['Silver oxide']},-21.78747587,-3.6312459783333337,-0.3225549744444442,"['diel', 'xas', 'elasticity', 'bandstructure']",True,"[174090, 174091, 174089, 174088, 247821, 31058, 605623, 174087, 173984, 281041, 174092, 35540, 246904]",True,2021-05-12 10:56:20.740000,NM,6,11,mp-353,oxide,Ag2O,"{'functional': 'PBE', 'labels': ['Ag', 'O'], 'pot_type': 'paw'}","{'Ag': 2.0, 'O': 1.0}",GGA,mp-353,"['mp-920667', 'mp-907227', 'mp-921713', 'mp-353', 'mp-1076982', 'mp-1140511', 'mp-1476244', 'mp-1686802', 'mp-1802767', 'mp-1596147', 'mp-1587357']",1.5e-07,"{'Ag': 4.0, 'O': 2.0}",113.43873585444824,[],NM,False,224,0,"[0, 0, 0, 0, 0, 0]",2.644599287362705e-09,1.5e-07,0,3e-07,MP,data/source/MP/cleaned/cifs/MP-mp-353.cif,False,,data/final/MP/graphs/Ag2O1-MP-mp-353.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Pd2Sn1Y1,1,0.0,1.0,True,Pd2Sn1Y1,Pd2Sn1Y1,4.814444444333333,Other,True,Pd50Sn25Y25,Pd-Sn-Y,3,Supercon,Pd2Y1Sn1,MP-mp-5538,Y1Sn1Pd2,Pd-Sn-Y,Pd50Sn25Y25,F m -3 m,cubic,4.81595014,4.81595014,4.81595014,data/final/MP/cifs/Pd2Sn1Y1-MP-mp-5538.cif,data/source/MP/raw/cifs/mp-5538.cif,mp-5538,0.0,,2011-05-13 01:04:13,8.839720826473608,10.17188/1267618,"@misc{osti_1267618,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YSnPd2 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1267618"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687523'}},0.0,6.33853657,520.0,-24.32859047,-6.0821476175,"{'tags': ['Palladium yttrium stannide (2/1/1)', 'Palladium tin yttrium (2/1/1)']}",-24.32859047,-6.0821476175,-0.873195970416667,"['xas', 'elasticity', 'bandstructure']",True,"[105699, 648949, 105700, 424011, 648950]",True,2021-05-12 10:56:22.739000,NM,4,12,mp-5538,,YSnPd2,"{'functional': 'PBE', 'labels': ['Y_sv', 'Sn_d', 'Pd'], 'pot_type': 'paw'}","{'Y': 1.0, 'Sn': 1.0, 'Pd': 2.0}",GGA,mp-5538,"['mp-1008093', 'mp-1001657', 'mp-5538', 'mp-1065654', 'mp-1065644', 'mp-1065683', 'mp-1439031', 'mp-1687523', 'mp-1801498', 'mp-1012418', 'mp-1593849', 'mp-1065696']",0.0001592,"{'Y': 1.0, 'Sn': 1.0, 'Pd': 2.0}",78.98251295612837,[],NM,False,225,0,"[0, 0, 0, 0]",2.015636044505563e-06,0.0001592,0,0.0001592,MP,data/source/MP/cleaned/cifs/MP-mp-5538.cif,False,,data/final/MP/graphs/Pd2Sn1Y1-MP-mp-5538.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Au1Pb3,1,0.0,4.0,False,Au4Pb12,Au4Pb12,4.325,Other,True,Au25Pb75,Au-Pb,2,Supercon,Au1Pb3,MP-mp-30412,Pb12Au4,Au-Pb,Au25Pb75,I -4 2 m,tetragonal,6.079497998074419,9.16035451912678,9.16035452,data/final/MP/cifs/Au1Pb3-MP-mp-30412.cif,data/source/MP/raw/cifs/mp-30412.cif,mp-30412,0.0,,2014-02-24 14:40:47,11.97670815314032,10.17188/1204821,"@misc{osti_1204821,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Pb3Au (SG:121) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1204821"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671362'}},0.0,6.50941652,520.0,-58.64719404,-3.6654496275,"{'tags': ['Lead auride (3/1)', 'Gold lead (1/3)']}",-58.64719404,-3.6654496275,-0.0624939399999999,"['xas', 'bandstructure']",True,"[612239, 58567]",True,2021-05-12 10:57:04.957000,NM,16,8,mp-30412,,Pb3Au,"{'functional': 'PBE', 'labels': ['Pb_d', 'Au'], 'pot_type': 'paw'}","{'Pb': 3.0, 'Au': 1.0}",GGA,mp-30412,"['mp-941045', 'mp-934503', 'mp-940886', 'mp-30412', 'mp-1415712', 'mp-1671362', 'mp-1814938', 'mp-1605827']",0.0004437,"{'Pb': 12.0, 'Au': 4.0}",453.9684023546395,[],NM,False,121,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.909523197637726e-06,0.0004437,0,0.0017748,MP,data/source/MP/cleaned/cifs/MP-mp-30412.cif,False,,data/final/MP/graphs/Au1Pb3-MP-mp-30412.json,0,True,-42m,0,0,0,0,6,0,0,0,0,1,0,1.0,False
Ba0.103Cu1La1.897O4,2,0.0294285714285714,1.0,True,Ba0.103Cu1La1.897O4,Cu1La2O4,14.5,Cuprate,True,Ba1.471Cu14.286La27.1O57.142857142857146,Ba-Cu-La-O,4,Supercon,La1.897Ba0.103Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ba0.103Cu1La1.897O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ba0.103Cu1La1.897O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ni22Zr78,3,0.06,0.0769160839160839,False,Ni1.692Zr6,Ni2Zr6,3.47,Other,True,Ni22Zr78,Ni-Zr,2,Supercon,Ni22Zr78,MP-mp-1188073,Zr6Ni2,Ni-Zr,Ni25Zr75,P 63/m m c,hexagonal,4.896295,6.064418005027057,6.06441883,data/final/MP/cifs/Ni22Zr78-MP-mp-1188073-synth_doped.cif,data/source/MP/raw/cifs/mp-1188073.cif,mp-1188073,0.0,,2019-01-11 15:34:08.753000,7.07812709883652,,,{'GGA': {'task_id': 'mp-1730307'}},0.2678923887499991,4.81016384,520.0,-62.64172784,-7.83021598,{'tags': []},-62.64172784,-7.83021598,0.0255936624999986,['bandstructure'],True,[],True,2021-05-12 10:58:31.620000,NM,8,5,mp-1188073,,Zr3Ni,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Ni_pv'], 'pot_type': 'paw'}","{'Zr': 3.0, 'Ni': 1.0}",GGA,mp-1188073,"['mp-1188073', 'mp-1399727', 'mp-1730307', 'mp-1929912', 'mp-1619498']",0.00082625,"{'Zr': 6.0, 'Ni': 2.0}",155.94682700084778,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.0596560582736426e-05,0.00082625,0,0.0016525,MP,data/source/MP/cleaned/cifs/MP-mp-1188073.cif,True,,data/final/MP/graphs/Ni22Zr78-MP-mp-1188073-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
As2Ta1,1,0.0,2.0,False,As4Ta2,As4Ta2,0.0,Other,True,As66.667Ta33.333,As-Ta,2,Supercon,As2Ta1,MP-mp-12561,Ta2As4,As-Ta,As66.667Ta33.333,C 1 2/m 1,monoclinic,3.4259379964219963,5.02115168,7.077656617431876,data/final/MP/cifs/As2Ta1-MP-mp-12561.cif,data/source/MP/raw/cifs/mp-12561.cif,mp-12561,0.0,,2011-05-28 01:36:15,9.966510324273676,10.17188/1188980,"@misc{osti_1188980,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TaAs2 (SG:12) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188980"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699797'}},0.0,6.29026893,520.0,-45.1603521,-7.526725349999999,{'tags': ['Tantalum arsenide (1/2)']},-45.1603521,-7.526725349999999,-0.4680538699999997,"['xas', 'elasticity', 'bandstructure']",True,[44069],True,2021-05-12 10:56:12.755000,NM,6,13,mp-12561,,TaAs2,"{'functional': 'PBE', 'labels': ['Ta_pv', 'As'], 'pot_type': 'paw'}","{'Ta': 1.0, 'As': 2.0}",GGA,mp-12561,"['mp-920483', 'mp-921526', 'mp-906891', 'mp-12561', 'mp-13465', 'mp-1071660', 'mp-1071692', 'mp-1071754', 'mp-1417686', 'mp-1699797', 'mp-1803904', 'mp-1591719', 'mp-1071715']",0.000186,"{'Ta': 2.0, 'As': 4.0}",110.22745040156998,[],NM,False,12,0,"[0, 0, 0, 0, 0, 0]",3.374839920952227e-06,0.000186,0,0.000372,MP,data/source/MP/cleaned/cifs/MP-mp-12561.cif,False,,data/final/MP/graphs/As2Ta1-MP-mp-12561.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
Pb3Zr5,1,0.0,2.0,False,Pb6Zr10,Pb6Zr10,4.6,Other,True,Pb37.5Zr62.5,Pb-Zr,2,Supercon,Pb3Zr5,MP-mp-681992,Zr10Pb6,Pb-Zr,Pb37.5Zr62.5,P 63/m c m,hexagonal,6.213825,8.99217399750745,8.99217476,data/final/MP/cifs/Pb3Zr5-MP-mp-681992.cif,data/source/MP/raw/cifs/mp-681992.cif,mp-681992,0.0,,2013-10-11 13:16:04,8.225568677394543,10.17188/1283750,"@misc{osti_1283750,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Zr5Pb3 (SG:193) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1283750"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1709000'}},0.0,5.31049595,520.0,-110.0881661,-6.88051038125,"{'tags': ['Lead zirconium (3/5)', 'Zirconium plumbide (5/3)']}",-110.0881661,-6.88051038125,-0.1459548362499996,"['xas', 'bandstructure']",True,"[105649, 604082, 648672]",True,2021-05-12 10:57:38.495000,NM,16,8,mp-681992,,Zr5Pb3,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Pb_d'], 'pot_type': 'paw'}","{'Zr': 5.0, 'Pb': 3.0}",GGA,mp-681992,"['mp-943062', 'mp-942042', 'mp-681992', 'mp-935256', 'mp-1423506', 'mp-1709000', 'mp-1819879', 'mp-1608375']",0.0002385,"{'Zr': 10.0, 'Pb': 6.0}",435.1300762400316,[],NM,False,193,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.0962239248589005e-06,0.0002385,0,0.000477,MP,data/source/MP/cleaned/cifs/MP-mp-681992.cif,False,,data/final/MP/graphs/Pb3Zr5-MP-mp-681992.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ba1.972Ca0.028Cu4Y1O8,2,0.0037333333333333,1.0,True,Ba1.972Ca0.028Cu4Y1O8,Ba2Cu4Y1O8,79.7,Cuprate,True,Ba13.147Ca0.187Cu26.667Y6.667O53.333333333333336,Ba-Ca-Cu-Y-O,5,Supercon,Y1Ba1.972Ca0.028Cu4O8,MP-mp-6790,Ba2Y1Cu4O8,Ba-Cu-Y-O,Ba13.333Cu26.667Y6.667O53.333333333333336,C m m m,orthorhombic,3.889922,3.899603999537882,13.88942687,data/final/MP/cifs/Ba1.972Ca0.028Cu4Y1O8-MP-mp-6790-synth_doped.cif,data/source/MP/raw/cifs/mp-6790.cif,mp-6790,0.0,,2011-05-16 03:21:24,5.936250568336678,10.17188/1283441,"@misc{osti_1283441,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Y(CuO2)4 (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1283441"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686864'}},0.0,3.31391536,520.0,-91.58381472,-6.105587648,"{'tags': ['Yttrium barium copper oxide (1/2/4/8)', 'High pressure experimental phase']}",-91.58381472,-6.105587648,-2.0529924817777783,"['xas', 'bandstructure']",True,"[72261, 85273, 74251, 400273, 85277, 85275, 400280, 67632, 85272, 67631, 83920, 66613, 85279, 400277, 75689, 74259, 85278, 85280, 66603, 94265, 400276, 88873, 71417, 75712, 97052, 66605, 72258, 85281, 85274, 400279, 66604, 69698]",True,2021-05-12 10:57:34.594000,NM,15,10,mp-6790,oxide,Ba2Y(CuO2)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-6790,"['mp-1000664', 'mp-6790', 'mp-1007136', 'mp-1237713', 'mp-1440937', 'mp-1686864', 'mp-1834179', 'mp-1011883', 'mp-1590064', 'mp-1590433']",0.0004643,"{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",208.60454115924333,[],NM,False,65,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.225742533790601e-06,0.0004643,0,0.0004643,MP,data/source/MP/cleaned/cifs/MP-mp-6790.cif,True,,data/final/MP/graphs/Ba1.972Ca0.028Cu4Y1O8-MP-mp-6790-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Co1Ge0.96Si0.04U1,2,0.0266666666666666,4.0,False,Co4Ge3.84Si0.16U4,Co4Ge4U4,0.541,Heavy_fermion,True,Co33.333Ge32Si1.333U33.333,Co-Ge-Si-U,4,Supercon,U1Co1Ge0.96Si0.04,MP-mp-20671,U4Co4Ge4,Co-Ge-U,Co33.333Ge33.333U33.333,P n m a,orthorhombic,4.28722,6.693007,7.099451,data/final/MP/cifs/Co1Ge0.96Si0.04U1-MP-mp-20671-synth_doped.cif,data/source/MP/raw/cifs/mp-20671.cif,mp-20671,0.0,,2014-02-22 17:09:25,12.050961791187769,10.17188/1195831,"@misc{osti_1195831,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UCoGe (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195831"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696056'}},0.0092126219444441,8.81618313,520.0,-96.12146646,-8.010122205,"{'tags': ['Uranium nickel germanium (1/1/1)', 'Uranium cobalt germanium (1/1/1)', 'Uranium cobalt germanide (1/1/1)', 'Uranium cobalt germanium hydride (1/1/1/0.1)']}",-96.12146646,-8.010122205,-0.3358703183333335,"['xas', 'bandstructure']",True,"[55538, 184392, 184389, 184388]",True,2021-05-12 10:56:57.051000,NM,12,11,mp-20671,,UCoGe,"{'functional': 'PBE', 'labels': ['U', 'Co', 'Ge_d'], 'pot_type': 'paw'}","{'U': 1.0, 'Co': 1.0, 'Ge': 1.0}",GGA,mp-20671,"['mp-921572', 'mp-906970', 'mp-920534', 'mp-20671', 'mp-1102081', 'mp-1102694', 'mp-1103716', 'mp-1433082', 'mp-1696056', 'mp-1832133', 'mp-1602688']",0.006528975,"{'U': 4.0, 'Co': 4.0, 'Ge': 4.0}",203.71444041881864,[],NM,False,62,0,"[0.0, 0.0, 0.0, 0.0, -0.0, -0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0]",0.0001281985702452,0.006528975,0,0.0261159,MP,data/source/MP/cleaned/cifs/MP-mp-20671.cif,True,,data/final/MP/graphs/Co1Ge0.96Si0.04U1-MP-mp-20671-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ag2S1,1,0.0,2.0,False,Ag4S2,Ag4S2,0.0,Other,True,Ag66.667S33.333,Ag-S,2,Supercon,Ag2S1,MP-mp-31053,Ag4S2,Ag-S,Ag66.667S33.333,P 1 21 1,monoclinic,4.345211,5.898564,5.91127983,data/final/MP/cifs/Ag2S1-MP-mp-31053.cif,data/source/MP/raw/cifs/mp-31053.cif,mp-31053,1.3874,,2013-10-03 01:38:51,5.62219714213187,10.17188/1205380,"@misc{osti_1205380,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ag2S (SG:4) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1205380"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1756778'}},0.0,1.01906417,520.0,-19.93320786,-3.32220131,"{'tags': [""Silver sulfide - alpha', T-type""]}",-19.93320786,-3.32220131,-0.2226806854861109,"['piezo', 'xas', 'bandstructure', 'diel', 'elasticity']",True,[98454],True,2021-05-12 10:56:18.721000,NM,6,11,mp-31053,,Ag2S,"{'functional': 'PBE', 'labels': ['Ag', 'S'], 'pot_type': 'paw'}","{'Ag': 2.0, 'S': 1.0}",GGA,mp-31053,"['mp-678268', 'mp-663146', 'mp-985451', 'mp-1142178', 'mp-1114934', 'mp-1391694', 'mp-1756778', 'mp-1779558', 'mp-845085', 'mp-1624622', 'mp-31053']",0.0008799,"{'Ag': 4.0, 'S': 2.0}",146.3783268553772,[],NM,False,4,0,"[0, 0, 0, 0, 0, 0]",1.202227158764217e-05,0.0008799,0,0.0017598,MP,data/source/MP/cleaned/cifs/MP-mp-31053.cif,False,,data/final/MP/graphs/Ag2S1-MP-mp-31053.json,0,True,2,0,0,1,0,0,0,0,1,0,0,0,1.0,False
Sr1,1,0.0,4.0,False,Sr4,Sr4,3.5375,Other,True,Sr100,Sr,1,Supercon,Sr1,MP-mp-567826,Sr4,Sr,Sr100,I 4/m c m,tetragonal,6.732281421037859,6.73228142,6.7322814200000005,data/final/MP/cifs/Sr1-MP-mp-567826.cif,data/source/MP/raw/cifs/mp-567826.cif,mp-567826,0.0,,2014-12-22 16:29:29,2.501809848326379,10.17188/1274068,"@misc{osti_1274068,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1274068"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704994'}},0.1483362033333333,1.33316262,520.0,-6.164629,-1.54115725,"{'tags': ['Strontium - V, HP', 'High pressure experimental phase']}",-6.164629,-1.54115725,0.1483362033333333,"['xas', 'bandstructure']",True,[109026],True,2021-05-12 10:57:23.123000,NM,4,9,mp-567826,,Sr,"{'functional': 'PBE', 'labels': ['Sr_sv'], 'pot_type': 'paw'}",{'Sr': 1.0},GGA,mp-567826,"['mp-914337', 'mp-977827', 'mp-567826', 'mp-1179321', 'mp-1419069', 'mp-1704994', 'mp-1774705', 'mp-1005321', 'mp-1589243']",0.00118685,{'Sr': 4.0},232.6258857967545,[],NM,False,140,0,"[0, 0, 0, 0]",2.040787500384978e-05,0.00118685,0,0.0047474,MP,data/source/MP/cleaned/cifs/MP-mp-567826.cif,False,,data/final/MP/graphs/Sr1-MP-mp-567826.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Cu1Sr0.8Y0.2O2,3,0.0999999999999999,2.0,False,Cu2Sr1.6Y0.4O4,Cu2Sr2O4,38.6,Cuprate,True,Cu25Sr20Y5O50,Cu-Sr-Y-O,4,Supercon,Sr0.8Y0.2Cu1O2,MP-mp-5787,Sr2Cu2O4,Cu-Sr-O,Cu25Sr25O50,C m c m,orthorhombic,3.644437999912225,3.974263,8.32909336,data/final/MP/cifs/Cu1Sr0.8Y0.2O2-MP-mp-5787-synth_doped.cif,data/source/MP/raw/cifs/mp-5787.cif,mp-5787,0.0,,2011-05-13 22:43:08,5.167573150857569,10.17188/1276630,"@misc{osti_1276630,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SrCuO2 (SG:63) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1276630"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703560'}},0.0,3.45760864,520.0,-45.24374469,-5.65546808625,"{'tags': ['Strontium cuprate', 'Strontium copper oxide']}",-45.24374469,-5.65546808625,-2.0778125529166664,"['xas', 'elasticity', 'bandstructure']",True,"[77291, 93653, 202992, 16217, 83051, 77293]",True,2021-05-12 10:56:27.046000,NM,8,8,mp-5787,oxide,SrCuO2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Cu': 1.0, 'O': 2.0}",GGA,mp-5787,"['mp-924142', 'mp-909103', 'mp-5787', 'mp-924940', 'mp-1475985', 'mp-1703560', 'mp-1802910', 'mp-1593696']",4e-07,"{'Sr': 2.0, 'Cu': 2.0, 'O': 4.0}",117.71572347282628,[],NM,False,63,0,"[0, 0, 0, 0, 0, 0, 0, 0]",6.796033498317439e-09,4e-07,0,8e-07,MP,data/source/MP/cleaned/cifs/MP-mp-5787.cif,True,,data/final/MP/graphs/Cu1Sr0.8Y0.2O2-MP-mp-5787-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Be13Th0.045U0.955,2,0.0064285714285714,2.0,False,Be26Th0.09U1.91,Be26U2,0.46,Heavy_fermion,True,Be92.857Th0.321U6.821,Be-Th-U,3,Supercon,U0.9545Th0.0455Be13,MP-mp-1163,U2Be26,Be-U,Be92.857U7.143,F m -3 c,cubic,7.174675929999999,7.174675929999999,7.174675929999999,data/final/MP/cifs/Be13Th0.045U0.955-MP-mp-1163-synth_doped.cif,data/source/MP/raw/cifs/mp-1163.cif,mp-1163,0.0,,2011-05-15 13:39:09,4.516943134220159,10.17188/1188115,"@misc{osti_1188115,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UBe13 (SG:226) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188115"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1676276'}},0.0,5.60901004,520.0,-121.44122023,-4.337186436785714,"{'tags': ['Uranium beryllium (1/13)', 'Beryllium uranium (13/1)']}",-121.44122023,-4.337186436785714,-0.0583452042857146,"['xas', 'bandstructure']",True,"[616470, 58748, 616481, 58747, 58749, 659562, 107528, 600563, 58750, 616488, 58751]",True,2021-05-12 10:56:51.169000,NM,28,8,mp-1163,,UBe13,"{'functional': 'PBE', 'labels': ['U', 'Be_sv'], 'pot_type': 'paw'}","{'U': 1.0, 'Be': 13.0}",GGA,mp-1163,"['mp-1163', 'mp-906858', 'mp-920459', 'mp-921486', 'mp-1381018', 'mp-1676276', 'mp-1775695', 'mp-1603627']",0.0460573,"{'U': 2.0, 'Be': 26.0}",261.15110606061,[],NM,False,226,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0003527252914587,0.0460573,0,0.0921146,MP,data/source/MP/cleaned/cifs/MP-mp-1163.cif,True,,data/final/MP/graphs/Be13Th0.045U0.955-MP-mp-1163-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
As2Ba0.788Fe2K0.212,3,0.1152,2.0,False,As4Ba1.576Fe4K0.424,As4Ba1Fe4K1,19.0,Ferrite,True,As40Ba15.76Fe40K4.24,As-Ba-Fe-K,4,Supercon,Ba0.788K0.212Fe2As2,MP-mp-1223517,K1Ba1Fe4As4,As-Ba-Fe-K,As40Ba10Fe40K10,C m m m,orthorhombic,5.479027,5.480024002658328,7.13170472,data/final/MP/cifs/As2Ba0.788Fe2K0.212-MP-mp-1223517-synth_doped.cif,data/source/MP/raw/cifs/mp-1223517.cif,mp-1223517,0.0,,2019-01-12 23:54:03.876000,5.87534599912672,,,{'GGA': {'task_id': 'mp-1743010'}},0.0132513644999994,4.21185628,520.0,-59.66633886,-5.966633886,{'tags': []},-59.66633886,-5.966633886,-0.4120461663000007,[],False,[],True,2021-05-12 11:00:52.054000,FM,10,4,mp-1223517,,KBa(FeAs)4,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",GGA,mp-1223517,"['mp-1223517', 'mp-1396881', 'mp-1743010', 'mp-1827585']",0.9947188,"{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",197.6961518155852,[],FM,True,65,1,"[0.0, 0.0, 0.3, 0.3, 0.3, 0.3, 0.0, 0.0, 0.0, 0.0]",0.0050315536790412,0.9947188,4,0.9947188,MP,data/source/MP/cleaned/cifs/MP-mp-1223517.cif,True,,data/final/MP/graphs/As2Ba0.788Fe2K0.212-MP-mp-1223517-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
As1Co1Sm1O1,1,0.0,2.0,False,As2Co2Sm2O2,As2Co2Sm2O2,0.0,Oxide,True,As25Co25Sm25O25,As-Co-Sm-O,4,Supercon,Sm1Co1As1O1,MP-mp-1091397,Sm2Co2As2O2,As-Co-Sm-O,As25Co25Sm25O25,P 4/n m m,tetragonal,4.017896,4.017896,7.985917,data/final/MP/cifs/As1Co1Sm1O1-MP-mp-1091397.cif,data/source/MP/raw/cifs/mp-1091397.cif,mp-1091397,0.0,,2018-04-26 12:22:11,7.733714610620748,,,{'GGA+U': {'task_id': 'mp-1701017'}},0.2742675134374988,5.10038984,520.0,-51.72406173,-6.46550771625,{'tags': []},-51.72406173,-6.46550771625,-1.68826188125,['bandstructure'],True,[169487],True,2021-05-12 10:58:18.470000,FM,8,5,mp-1091397,oxide,SmCoAsO,"{'functional': 'PBE', 'labels': ['Sm_3', 'Co', 'As', 'O'], 'pot_type': 'paw'}","{'Sm': 1.0, 'Co': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-1091397,"['mp-1091397', 'mp-1430646', 'mp-1701017', 'mp-1784627', 'mp-1589707']",0.65230055,"{'Sm': 2.0, 'Co': 2.0, 'As': 2.0, 'O': 2.0}",128.92055738926646,[],FM,True,129,1,"[0.0, 0.0, 0.7, 0.7, 0.0, 0.0, 0.0, 0.0]",0.0101194187057448,0.65230055,2,1.3046011,MP,data/source/MP/cleaned/cifs/MP-mp-1091397.cif,False,,data/final/MP/graphs/As1Co1Sm1O1-MP-mp-1091397.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ge3N4,1,0.0,4.0,False,Ge12N16,Ge12N16,0.0,Other,True,Ge42.857N57.143,Ge-N,2,Supercon,Ge3N4,MP-mp-672289,Ge12N16,Ge-N,Ge42.857N57.143,P 3 1 c,trigonal,5.989562,8.278560001491215,8.27855977,data/final/MP/cifs/Ge3N4-MP-mp-672289.cif,data/source/MP/raw/cifs/mp-672289.cif,mp-672289,2.0807,,2013-10-13 18:08:31,5.118468545139695,10.17188/1281824,"@misc{osti_1281824,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ge3N4 (SG:159) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281824"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1764171'}},0.0,4.68777305,520.0,-190.02212316,-6.786504398571429,"{'tags': ['Germanium nitride', 'Germanium nitride (3/4)']}",-190.02212316,-6.786504398571429,-0.2477810750000009,"['xas', 'elasticity', 'bandstructure']",True,"[637162, 637158]",True,2021-05-12 10:56:27.046000,NM,28,9,mp-672289,,Ge3N4,"{'functional': 'PBE', 'labels': ['Ge_d', 'N'], 'pot_type': 'paw'}","{'Ge': 3.0, 'N': 4.0}",GGA,mp-672289,"['mp-729425', 'mp-740900', 'mp-672289', 'mp-1192678', 'mp-1423532', 'mp-1764171', 'mp-1841716', 'mp-1609962', 'mp-748001']",0.00019595,"{'Ge': 12.0, 'N': 16.0}",355.49646114520885,[],NM,False,159,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.2048039450942462e-06,0.00019595,0,0.0007838,MP,data/source/MP/cleaned/cifs/MP-mp-672289.cif,False,,data/final/MP/graphs/Ge3N4-MP-mp-672289.json,0,True,3m,0,0,0,0,0,0,5,1,0,0,0,1.0,False
Na1Te1,1,0.0,24.0,False,Na24Te24,Na24Te24,0.0,Other,True,Na50Te50,Na-Te,2,Supercon,Na1Te1,MP-mp-28353,Na24Te24,Na-Te,Na50Te50,P b c n,orthorhombic,9.223614,10.028847,16.026804,data/final/MP/cifs/Na1Te1-MP-mp-28353.cif,data/source/MP/raw/cifs/mp-28353.cif,mp-28353,0.5388000000000002,,2016-05-10 23:35:35,4.048151484579065,10.17188/1202472,"@misc{osti_1202472,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NaTe (SG:60) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1202472"",
    place = ""United States"",
    year = ""2016"",
    month = ""5"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-998671'}},0.0067534291250006,2.9191051,520.0,-141.03249845,-2.9381770510416665,{'tags': ['Sodium telluride']},-141.03249845,-2.9381770510416665,-0.916263939317528,['xas'],False,[61382],True,2021-05-12 10:57:03.017000,NM,48,5,mp-28353,,NaTe,"{'functional': 'PBE', 'labels': ['Na_pv', 'Te'], 'pot_type': 'paw'}","{'Na': 1.0, 'Te': 1.0}",GGA,mp-28353,"['mp-998290', 'mp-998671', 'mp-28353', 'mp-1361404', 'mp-1011510']",4.3391666666666667e-05,"{'Na': 24.0, 'Te': 24.0}",1482.5148468220762,[],NM,False,60,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",7.024550224453728e-07,4.3391666666666667e-05,0,0.0010414,MP,data/source/MP/cleaned/cifs/MP-mp-28353.cif,False,,data/final/MP/graphs/Na1Te1-MP-mp-28353.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Pb0.989Te1Tl0.011,2,0.011,1.0,True,Pb0.989Te1Tl0.011,Pb1Te1,1.16,Other,True,Pb49.45Te50Tl0.55,Pb-Te-Tl,3,Supercon,Pb0.989Tl0.011Te1,MP-mp-19717,Te1Pb1,Pb-Te,Pb50Te50,F m -3 m,cubic,4.64263261,4.64263261,4.64263261,data/final/MP/cifs/Pb0.989Te1Tl0.011-MP-mp-19717-synth_doped.cif,data/source/MP/raw/cifs/mp-19717.cif,mp-19717,1.0581999999999994,,2013-09-21 09:56:54,7.856997090559908,10.17188/1194927,"@misc{osti_1194927,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TePb (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1194927"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686920'}},0.0,4.9735213,520.0,-7.66743933,-3.833719665,"{'tags': ['Altaite', 'Lead telluride (1/1)', 'High pressure experimental phase', 'Lead telluride']}",-7.66743933,-3.833719665,-0.6167456649999998,"['eos', 'xas', 'bandstructure', 'diel', 'phonons', 'elasticity']",True,"[194220, 648583, 648588, 648607, 63099, 648584, 648590, 604178, 648595, 96500, 648608, 648596, 648597, 182660, 648599, 648593, 648603, 96504, 648591, 648586, 96506, 600843, 600522, 648614, 182662, 648606, 186788, 96505, 153711, 648581, 648605, 648587, 248494, 648585, 190437, 648600, 648617, 602956, 38295, 648589, 648615, 63098, 648592, 290707, 648612, 648594, 182661, 648616, 248495, 648613]",True,2021-05-12 10:56:14.760000,NM,2,34,mp-19717,,TePb,"{'functional': 'PBE', 'labels': ['Te', 'Pb_d'], 'pot_type': 'paw'}","{'Te': 1.0, 'Pb': 1.0}",GGA,mp-19717,"['mp-658057', 'mp-655294', 'mp-656827', 'mp-19717', 'mp-1056883', 'mp-1056867', 'mp-1056875', 'mp-1059285', 'mp-1059296', 'mp-1059300', 'mp-1059866', 'mp-1059872', 'mp-1059851', 'mp-1060231', 'mp-1060244', 'mp-1060254', 'mp-1061267', 'mp-1061381', 'mp-1061396', 'mp-1061412', 'mp-1061239', 'mp-1061250', 'mp-1142129', 'mp-1440755', 'mp-1686920', 'mp-1801248', 'mp-1594316', 'mp-1595339', 'mp-1059310', 'mp-1060260', 'mp-1061273', 'mp-1061416', 'mp-1056891', 'mp-1059878']",0.0014838,"{'Te': 1.0, 'Pb': 1.0}",70.75839192630549,[],NM,False,225,0,"[0, 0]",2.096995083700277e-05,0.0014838,0,0.0014838,MP,data/source/MP/cleaned/cifs/MP-mp-19717.cif,True,,data/final/MP/graphs/Pb0.989Te1Tl0.011-MP-mp-19717-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Pd2Sn1Tb1,1,0.0,1.0,True,Pd2Sn1Tb1,Pd2Sn1Tb1,0.0,Other,True,Pd50Sn25Tb25,Pd-Sn-Tb,3,Supercon,Pd2Tb1Sn1,MP-mp-5385,Tb1Sn1Pd2,Pd-Sn-Tb,Pd50Sn25Tb25,F m -3 m,cubic,4.82099181,4.820991809999999,4.820991809999999,data/final/MP/cifs/Pd2Sn1Tb1-MP-mp-5385.cif,data/source/MP/raw/cifs/mp-5385.cif,mp-5385,0.0,,2011-05-13 00:06:55,10.279502590555657,10.17188/1263602,"@misc{osti_1263602,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TbSnPd2 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1263602"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700819'}},0.0,6.30878919,520.0,-22.47811883,-5.6195297075,{'tags': ['Palladium tin terbium (2/1/1)']},-22.47811883,-5.6195297075,-0.8686043137499997,"['xas', 'bandstructure']",True,"[105693, 105694]",True,2021-05-12 10:57:10.838000,NM,4,8,mp-5385,,TbSnPd2,"{'functional': 'PBE', 'labels': ['Tb_3', 'Sn_d', 'Pd'], 'pot_type': 'paw'}","{'Tb': 1.0, 'Sn': 1.0, 'Pd': 2.0}",GGA,mp-5385,"['mp-991538', 'mp-993486', 'mp-5385', 'mp-1438643', 'mp-1700819', 'mp-1800786', 'mp-994800', 'mp-1590315']",0.0015626,"{'Tb': 1.0, 'Sn': 1.0, 'Pd': 2.0}",79.23082587941477,[],NM,False,225,0,"[0, 0, 0, 0]",1.9722121821350146e-05,0.0015626,0,0.0015626,MP,data/source/MP/cleaned/cifs/MP-mp-5385.cif,False,,data/final/MP/graphs/Pd2Sn1Tb1-MP-mp-5385.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Fe3Lu1.9Sc0.1Si5,2,0.02,4.0,False,Fe12Lu7.6Sc0.4Si20,Fe12Lu8Si20,4.33,Other,True,Fe30Lu19Sc1Si50,Fe-Lu-Sc-Si,4,Supercon,Lu1.9Sc0.1Fe3Si5,MP-mp-541557,Lu8Fe12Si20,Fe-Lu-Si,Fe30Lu20Si50,P 4/m n c,tetragonal,5.385917,10.270814,10.270814,data/final/MP/cifs/Fe3Lu1.9Sc0.1Si5-MP-mp-541557-synth_doped.cif,data/source/MP/raw/cifs/mp-541557.cif,mp-541557,0.0,,2014-03-04 18:23:36,7.69125622397548,10.17188/1265154,"@misc{osti_1265154,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Lu2Fe3Si5 (SG:128) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1265154"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1746411'}},0.0,7.47471245,520.0,-273.951322,-6.84878305,{'tags': ['Lutetium iron silicide (2/3/5)']},-273.951322,-6.84878305,-0.6554334009999998,"['xas', 'bandstructure']",True,"[84198, 247832, 632470]",True,2021-05-12 10:57:10.838000,NM,40,10,mp-541557,,Lu2Fe3Si5,"{'functional': 'PBE', 'labels': ['Lu_3', 'Fe_pv', 'Si'], 'pot_type': 'paw'}","{'Lu': 2.0, 'Fe': 3.0, 'Si': 5.0}",GGA,mp-541557,"['mp-939885', 'mp-916724', 'mp-937397', 'mp-541557', 'mp-1170743', 'mp-1200451', 'mp-1255960', 'mp-1383694', 'mp-1746411', 'mp-1892871']",0.000409375,"{'Lu': 8.0, 'Fe': 12.0, 'Si': 20.0}",568.1583388804236,[],NM,False,90,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",2.8821190994516645e-06,0.000409375,0,0.0016375,MP,data/source/MP/cleaned/cifs/MP-mp-541557.cif,True,,data/final/MP/graphs/Fe3Lu1.9Sc0.1Si5-MP-mp-541557-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B4Co4Lu1,1,0.0,2.0,False,B8Co8Lu2,B8Co8Lu2,0.0,Other,True,B44.444Co44.444Lu11.111,B-Co-Lu,3,Supercon,Lu1Co4B4,MP-mp-1189538,Lu2Co8B8,B-Co-Lu,B44.444Co44.444Lu11.111,P 42/n m c,tetragonal,4.978483,4.978483,6.921442,data/final/MP/cifs/B4Co4Lu1-MP-mp-1189538.cif,data/source/MP/raw/cifs/mp-1189538.cif,mp-1189538,0.0,,2019-01-11 20:16:14.182000,8.788009584563952,,,,0.0,6.23130843,520.0,-128.83562461,-7.157534700555555,{'tags': ['Lutetium cobalt boride (1/4/4)']},-128.83562461,-7.157534700555555,-0.5273359468518516,[],False,[613152],True,2021-05-12 10:59:54.607000,NM,18,2,mp-1189538,,Lu(CoB)4,"{'functional': 'PBE', 'labels': ['Lu_3', 'Co', 'B'], 'pot_type': 'paw'}","{'Lu': 1.0, 'Co': 4.0, 'B': 4.0}",GGA,mp-1189538,"['mp-1189538', 'mp-1987628']",0.12770425,"{'Lu': 2.0, 'Co': 8.0, 'B': 8.0}",171.54996782299887,[],NM,False,137,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.001488828609187,0.12770425,0,0.2554085,MP,data/source/MP/cleaned/cifs/MP-mp-1189538.cif,False,,data/final/MP/graphs/B4Co4Lu1-MP-mp-1189538.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Mo6Pb1S4Se4,1,0.0,1.0,True,Mo6Pb1S4Se4,Mo6Pb1S4Se4,3.2,Chevrel,True,Mo40Pb6.667S26.667Se26.667,Mo-Pb-S-Se,4,Supercon,Pb1Mo6S4Se4,MP-mp-1221608,Mo6Pb1Se4S4,Mo-Pb-S-Se,Mo40Pb6.667S26.667Se26.667,P 1,triclinic,6.711331,6.768600659999999,6.81658188,data/final/MP/cifs/Mo6Pb1S4Se4-MP-mp-1221608.cif,data/source/MP/raw/cifs/mp-1221608.cif,mp-1221608,0.0,,2019-01-12 22:16:24.326000,6.58529154820057,,,,0.0635678273333342,5.40823227,520.0,-107.70981268,-7.180654178666667,{'tags': []},-107.70981268,-7.180654178666667,-0.819590803458333,[],False,[],True,2021-05-12 11:00:47.244000,NM,15,3,mp-1221608,,Mo6Pb(SeS)4,"{'functional': 'PBE', 'labels': ['Mo_pv', 'Pb_d', 'Se', 'S'], 'pot_type': 'paw'}","{'Mo': 6.0, 'Pb': 1.0, 'Se': 4.0, 'S': 4.0}",GGA,mp-1221608,"['mp-1221608', 'mp-1345843', 'mp-1808931']",0.0001123,"{'Mo': 6.0, 'Pb': 1.0, 'Se': 4.0, 'S': 4.0}",309.38369052633936,[],NM,False,1,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.629797026758247e-07,0.0001123,0,0.0001123,MP,data/source/MP/cleaned/cifs/MP-mp-1221608.cif,False,,data/final/MP/graphs/Mo6Pb1S4Se4-MP-mp-1221608.json,0,True,1,0,0,0,0,0,1,0,1,0,0,0,1.0,False
Ce1Ge12Pt4,1,0.0,1.0,True,Ce1Ge12Pt4,Ce1Ge12Pt4,0.0,Heavy_fermion,True,Ce5.882Ge70.588Pt23.529,Ce-Ge-Pt,3,Supercon,Ce1Pt4Ge12,MP-mp-1190040,Ce1Ge12Pt4,Ce-Ge-Pt,Ce5.882Ge70.588Pt23.529,I m -3,cubic,7.554374241674687,7.55437424,7.55437424,data/final/MP/cifs/Ce1Ge12Pt4-MP-mp-1190040.cif,data/source/MP/raw/cifs/mp-1190040.cif,mp-1190040,0.0,,2019-01-11 20:38:55.889000,8.966965437997649,,,{'GGA': {'task_id': 'mp-1707713'}},0.0,4.51971036,520.0,-92.33742426,-5.431613191764706,{'tags': ['Cerium platinum germanide (1/4/12)']},-92.33742426,-5.431613191764706,-0.3908452944117654,['bandstructure'],True,[174553],True,2021-05-12 10:58:33.577000,FM,17,5,mp-1190040,,Ce(Ge3Pt)4,"{'functional': 'PBE', 'labels': ['Ce', 'Ge_d', 'Pt'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Ge': 12.0, 'Pt': 4.0}",GGA,mp-1190040,"['mp-1190040', 'mp-1428966', 'mp-1707713', 'mp-1812627', 'mp-1638005']",0.0676464,"{'Ce': 1.0, 'Ge': 12.0, 'Pt': 4.0}",331.87427999817515,[],FM,True,204,1,"[0.1, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0002038314026635,0.0676464,1,0.0676464,MP,data/source/MP/cleaned/cifs/MP-mp-1190040.cif,False,,data/final/MP/graphs/Ce1Ge12Pt4-MP-mp-1190040.json,0,True,m-3,2,0,0,0,0,0,0,0,0,1,0,1.0,False
B1Li2Ni0.06Pd2.94,2,0.02,4.0,False,B4Li8Ni0.24Pd11.76,B4Li8Pd12,7.7,Other,True,B16.667Li33.333Ni1Pd49,B-Li-Ni-Pd,4,Supercon,Li2Pd2.94Ni0.06B1,MP-mp-20657,Li8B4Pd12,B-Li-Pd,B16.667Li33.333Pd50,P 43 3 2,cubic,6.834153,6.834153,6.834153,data/final/MP/cifs/B1Li2Ni0.06Pd2.94-MP-mp-20657-synth_doped.cif,data/source/MP/raw/cifs/mp-20657.cif,mp-20657,0.0,,2014-02-22 22:20:25,7.157380380013985,10.17188/1195787,"@misc{osti_1195787,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Li2BPd3 (SG:212) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195787"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672514'}},0.0,3.54739631,520.0,-115.20693246,-4.8002888525000005,{'tags': ['Lithium palladium boride (2/3/1)']},-115.20693246,-4.8002888525000005,-0.4608083634722219,"['xas', 'bandstructure']",True,"[156465, 246447, 84931]",True,2021-05-12 10:56:57.051000,NM,24,9,mp-20657,,Li2BPd3,"{'functional': 'PBE', 'labels': ['Li_sv', 'B', 'Pd'], 'pot_type': 'paw'}","{'Li': 2.0, 'B': 1.0, 'Pd': 3.0}",GGA,mp-20657,"['mp-921382', 'mp-906713', 'mp-920352', 'mp-20657', 'mp-1116014', 'mp-1415525', 'mp-1672514', 'mp-1806936', 'mp-1654311']",4.895e-05,"{'Li': 8.0, 'B': 4.0, 'Pd': 12.0}",319.1935391161389,[],NM,False,212,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.134209374731673e-07,4.895e-05,0,0.0001958,MP,data/source/MP/cleaned/cifs/MP-mp-20657.cif,True,,data/final/MP/graphs/B1Li2Ni0.06Pd2.94-MP-mp-20657-synth_doped.json,0,True,432,4,0,0,0,0,0,0,1,0,0,0,1.0,False
B2C1Er0.775Ni2Tb0.225,3,0.075,1.0,True,B2C1Er0.775Ni2Tb0.225,B2C1Er1Ni2,5.9,Other,True,B33.333C16.667Er12.917Ni33.333Tb3.75,B-C-Er-Ni-Tb,5,Supercon,Tb0.225Er0.775Ni2B2C1,MP-mp-6098,Er1Ni2B2C1,B-C-Er-Ni,B33.333C16.667Er16.667Ni33.333,I 4/m m m,tetragonal,3.5122880026935177,3.5122880026935173,5.77805085,data/final/MP/cifs/B2C1Er0.775Ni2Tb0.225-MP-mp-6098-synth_doped.cif,data/source/MP/raw/cifs/mp-6098.cif,mp-6098,0.0,,2011-05-13 04:24:02,8.212015229638553,10.17188/1277667,"@misc{osti_1277667,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ErNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277667"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700042'}},0.0,6.72687579,520.0,-41.84324782,-6.973874636666667,{'tags': []},-41.84324782,-6.973874636666667,-0.5216152347222227,"['xas', 'elasticity', 'bandstructure']",True,"[246431, 79576, 56651]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-6098,,ErNi2B2C,"{'functional': 'PBE', 'labels': ['Er_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Er': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6098,"['mp-1006980', 'mp-1000513', 'mp-6098', 'mp-1441533', 'mp-1700042', 'mp-1793903', 'mp-1011723', 'mp-1589040']",0.0020747,"{'Er': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",64.35860973581151,[],NM,False,139,0,"[0.0, -0.0, -0.0, 0.0, 0.0, 0.0]",3.2236557136900987e-05,0.0020747,0,0.0020747,MP,data/source/MP/cleaned/cifs/MP-mp-6098.cif,True,,data/final/MP/graphs/B2C1Er0.775Ni2Tb0.225-MP-mp-6098-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As2Co0.208Fe1.792Sr1,3,0.0831999999999999,1.0,True,As2Co0.208Fe1.792Sr1,As2Fe2Sr1,13.9,Ferrite,True,As40Co4.16Fe35.84Sr20,As-Co-Fe-Sr,4,Supercon,Sr1Fe1.792Co0.208As2,MP-mp-4488,Sr1Fe2As2,As-Fe-Sr,As40Fe40Sr20,I 4/m m m,tetragonal,3.9729799997357778,3.9729799997357778,6.45523327,data/final/MP/cifs/As2Co0.208Fe1.792Sr1-MP-mp-4488-synth_doped.cif,data/source/MP/raw/cifs/mp-4488.cif,mp-4488,0.0,,2011-05-13 03:37:13,6.319998834487784,10.17188/1208187,"@misc{osti_1208187,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr(FeAs)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208187"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672865'}},0.0,5.13397273,520.0,-30.61898897,-6.123797794,"{'tags': ['Strontium diiron arsenide - HT', 'Strontium diiron arsenide', 'Strontium diiron diarsenide', 'Iron strontium arsenide (2/1/2)', 'Strontium diiron arsenide - LT']}",-30.61898897,-6.123797794,-0.5342483613333335,"['xas', 'elasticity', 'bandstructure']",True,"[182330, 181993, 610527, 163209, 163208, 163869]",True,2021-05-12 10:56:20.740000,NM,5,8,mp-4488,,Sr(FeAs)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Fe': 2.0, 'As': 2.0}",GGA,mp-4488,"['mp-906356', 'mp-920135', 'mp-919110', 'mp-4488', 'mp-1439153', 'mp-1672865', 'mp-1873948', 'mp-1592272']",0.0029206,"{'Sr': 1.0, 'Fe': 2.0, 'As': 2.0}",91.7377588211838,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",3.183640016422098e-05,0.0029206,0,0.0029206,MP,data/source/MP/cleaned/cifs/MP-mp-4488.cif,True,,data/final/MP/graphs/As2Co0.208Fe1.792Sr1-MP-mp-4488-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ca2In1N1,1,0.0,2.0,False,Ca4In2N2,Ca4In2N2,0.6,Other,True,Ca50In25N25,Ca-In-N,3,Supercon,Ca2In1N1,MP-mp-510086,Ca4In2N2,Ca-In-N,Ca50In25N25,C m c m,orthorhombic,3.514032000937404,5.003007,10.33736409,data/final/MP/cifs/Ca2In1N1-MP-mp-510086.cif,data/source/MP/raw/cifs/mp-510086.cif,mp-510086,0.0,,2014-02-25 20:13:51,3.875289845324338,10.17188/1262832,"@misc{osti_1262832,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ca2InN (SG:63) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1262832"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671309'}},0.0,4.01083781,520.0,-35.65557273,-4.45694659125,{'tags': []},-35.65557273,-4.45694659125,-0.7723519875000004,"['xas', 'elasticity', 'bandstructure']",True,[96228],True,2021-05-12 10:56:20.740000,NM,8,11,mp-510086,,Ca2InN,"{'functional': 'PBE', 'labels': ['Ca_sv', 'In_d', 'N'], 'pot_type': 'paw'}","{'Ca': 2.0, 'In': 1.0, 'N': 1.0}",GGA,mp-510086,"['mp-928063', 'mp-911941', 'mp-928586', 'mp-510086', 'mp-1118702', 'mp-1119441', 'mp-1118683', 'mp-1299951', 'mp-1671309', 'mp-1787003', 'mp-1602524']",0.01122795,"{'Ca': 4.0, 'In': 2.0, 'N': 2.0}",179.09401895917856,[],NM,False,63,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0001253860968138,0.01122795,0,0.0224559,MP,data/source/MP/cleaned/cifs/MP-mp-510086.cif,False,,data/final/MP/graphs/Ca2In1N1-MP-mp-510086.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
C1Co0.2Mg1Ni2.8,3,0.08,1.0,True,C1Co0.2Mg1Ni2.8,C1Mg1Ni3,7.2,Other,True,C20Co4Mg20Ni56,C-Co-Mg-Ni,4,Supercon,Mg1C1Ni2.8Co0.2,MP-mp-10700,Mg1Ni3C1,C-Mg-Ni,C20Mg20Ni60,P m -3 m,cubic,3.810209,3.810209,3.810209,data/final/MP/cifs/C1Co0.2Mg1Ni2.8-MP-mp-10700-synth_doped.cif,data/source/MP/raw/cifs/mp-10700.cif,mp-10700,0.0,,2011-05-28 10:04:44,6.376007671789427,10.17188/1187303,"@misc{osti_1187303,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MgNi3C (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187303"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678621'}},0.0,6.64260176,520.0,-28.85099542,-5.770199084,{'tags': ['Magnesium nickel carbide (1/3/1)']},-28.85099542,-5.770199084,-0.1367049259999994,"['xas', 'elasticity', 'bandstructure']",True,[77152],True,2021-05-12 10:56:10.715000,NM,5,8,mp-10700,,MgNi3C,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Ni_pv', 'C'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",GGA,mp-10700,"['mp-927245', 'mp-927653', 'mp-911184', 'mp-10700', 'mp-1438083', 'mp-1678621', 'mp-1791467', 'mp-1591421']",0.0387875,"{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",55.31544309398296,[],NM,False,221,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",0.0007012056277683,0.0387875,0,0.0387875,MP,data/source/MP/cleaned/cifs/MP-mp-10700.cif,True,,data/final/MP/graphs/C1Co0.2Mg1Ni2.8-MP-mp-10700-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Cu1Sm2O4,1,0.0,1.0,True,Cu1Sm2O4,Cu1Sm2O4,0.0,Cuprate,True,Cu14.286Sm28.571O57.142857142857146,Cu-Sm-O,3,Supercon,Sm2Cu1O4,MP-mp-4210,Sm2Cu1O4,Cu-Sm-O,Cu14.286Sm28.571O57.142857142857146,I 4/m m m,tetragonal,3.936481999770292,3.936481999770292,6.66682973,data/final/MP/cifs/Cu1Sm2O4-MP-mp-4210.cif,data/source/MP/raw/cifs/mp-4210.cif,mp-4210,0.0,,2011-05-13 10:20:22,7.575626216473968,10.17188/1207966,"@misc{osti_1207966,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sm2CuO4 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207966"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-670158'}},0.0084157301785579,3.24265454,520.0,-51.71666507,-7.38809501,"{'tags': ['Samarium cuprate', 'Disamarium copper oxide', 'Disamarium copper tetraoxide']}",-51.71666507,-7.38809501,-3.0194917299999995,"['xas', 'elasticity', 'bandstructure']",True,"[261378, 72243, 71182, 95371, 261377]",True,2021-05-12 10:56:20.740000,NM,7,8,mp-4210,oxide,Sm2CuO4,"{'functional': 'PBE', 'labels': ['Sm_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sm': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-4210,"['mp-660482', 'mp-670158', 'mp-4210', 'mp-1412888', 'mp-1702500', 'mp-1798108', 'mp-1589420', 'mp-688388']",0.0004776,"{'Sm': 2.0, 'Cu': 1.0, 'O': 4.0}",93.8732216032902,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",5.087712894507291e-06,0.0004776,0,0.0004776,MP,data/source/MP/cleaned/cifs/MP-mp-4210.cif,False,,data/final/MP/graphs/Cu1Sm2O4-MP-mp-4210.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Al3Pd2Th0.1U0.9,2,0.0333333333333333,1.0,True,Al3Pd2Th0.1U0.9,Al3Pd2U1,1.28,Heavy_fermion,True,Al50Pd33.333Th1.667U15,Al-Pd-Th-U,4,Supercon,U0.9Th0.1Pd2Al3,MP-mp-4561,U1Al3Pd2,Al-Pd-U,Al50Pd33.333U16.667,P 6/m m m,hexagonal,4.239652,5.384229999094356,5.3842309,data/final/MP/cifs/Al3Pd2Th0.1U0.9-MP-mp-4561-synth_doped.cif,data/source/MP/raw/cifs/mp-4561.cif,mp-4561,0.0,,2011-05-12 23:59:10,8.296603403902926,10.17188/1208253,"@misc{osti_1208253,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UAl3Pd2 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208253"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700804'}},0.0796314472916668,8.0468212,520.0,-36.36476907,-6.060794845,"{'tags': ['Aluminium palladium uranium (3/2/1)', 'Aluminum palladium uranium (3/2/1)']}",-36.36476907,-6.060794845,-0.5794779916666665,"['xas', 'elasticity', 'bandstructure']",True,"[657574, 106242, 659234]",True,2021-05-12 10:56:20.740000,FM,6,9,mp-4561,,UAl3Pd2,"{'functional': 'PBE', 'labels': ['U', 'Al', 'Pd'], 'pot_type': 'paw'}","{'U': 1.0, 'Al': 3.0, 'Pd': 2.0}",GGA,mp-4561,"['mp-4561', 'mp-991619', 'mp-993538', 'mp-1251974', 'mp-1441898', 'mp-1700804', 'mp-1933710', 'mp-994863', 'mp-1593816']",2.2050571,"{'U': 1.0, 'Al': 3.0, 'Pd': 2.0}",106.4408038742404,[],FM,True,191,1,"[2.2, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0207162762750765,2.2050571,1,2.2050571,MP,data/source/MP/cleaned/cifs/MP-mp-4561.cif,True,,data/final/MP/graphs/Al3Pd2Th0.1U0.9-MP-mp-4561-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Ca0.05Cu4Y0.95O8,2,0.0066666666666666,1.0,True,Ba2Ca0.05Cu4Y0.95O8,Ba2Cu4Y1O8,85.16,Cuprate,True,Ba13.333Ca0.333Cu26.667Y6.333O53.333333333333336,Ba-Ca-Cu-Y-O,5,Supercon,Y0.95Ca0.05Ba2Cu4O8,MP-mp-6790,Ba2Y1Cu4O8,Ba-Cu-Y-O,Ba13.333Cu26.667Y6.667O53.333333333333336,C m m m,orthorhombic,3.889922,3.899603999537882,13.88942687,data/final/MP/cifs/Ba2Ca0.05Cu4Y0.95O8-MP-mp-6790-synth_doped.cif,data/source/MP/raw/cifs/mp-6790.cif,mp-6790,0.0,,2011-05-16 03:21:24,5.936250568336678,10.17188/1283441,"@misc{osti_1283441,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Y(CuO2)4 (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1283441"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686864'}},0.0,3.31391536,520.0,-91.58381472,-6.105587648,"{'tags': ['Yttrium barium copper oxide (1/2/4/8)', 'High pressure experimental phase']}",-91.58381472,-6.105587648,-2.0529924817777783,"['xas', 'bandstructure']",True,"[72261, 85273, 74251, 400273, 85277, 85275, 400280, 67632, 85272, 67631, 83920, 66613, 85279, 400277, 75689, 74259, 85278, 85280, 66603, 94265, 400276, 88873, 71417, 75712, 97052, 66605, 72258, 85281, 85274, 400279, 66604, 69698]",True,2021-05-12 10:57:34.594000,NM,15,10,mp-6790,oxide,Ba2Y(CuO2)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-6790,"['mp-1000664', 'mp-6790', 'mp-1007136', 'mp-1237713', 'mp-1440937', 'mp-1686864', 'mp-1834179', 'mp-1011883', 'mp-1590064', 'mp-1590433']",0.0004643,"{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",208.60454115924333,[],NM,False,65,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.225742533790601e-06,0.0004643,0,0.0004643,MP,data/source/MP/cleaned/cifs/MP-mp-6790.cif,True,,data/final/MP/graphs/Ba2Ca0.05Cu4Y0.95O8-MP-mp-6790-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Cu0.8Sn0.2,3,0.1,8.0,False,Cu6.4Sn1.6,Cu6Sn2,0.0,Other,True,Cu80Sn20,Cu-Sn,2,Supercon,Cu0.8Sn0.2,MP-mp-13138,Cu6Sn2,Cu-Sn,Cu75Sn25,P 63/m m c,hexagonal,4.349665,5.540460003793306,5.54045991,data/final/MP/cifs/Cu0.8Sn0.2-MP-mp-13138-synth_doped.cif,data/source/MP/raw/cifs/mp-13138.cif,mp-13138,0.0,,2011-06-04 08:14:21,8.88481370954905,10.17188/1189408,"@misc{osti_1189408,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Cu3Sn (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189408"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701654'}},0.0119013687500002,8.51612743,520.0,-32.61241801,-4.07655225125,{'tags': ['Copper tin (3/1)']},-32.61241801,-4.07655225125,0.0002457150000001,"['xas', 'elasticity', 'bandstructure']",True,[162569],True,2021-05-12 10:56:12.755000,NM,8,8,mp-13138,,Cu3Sn,"{'functional': 'PBE', 'labels': ['Cu_pv', 'Sn_d'], 'pot_type': 'paw'}","{'Cu': 3.0, 'Sn': 1.0}",GGA,mp-13138,"['mp-920121', 'mp-919081', 'mp-906310', 'mp-13138', 'mp-1420922', 'mp-1701654', 'mp-1925297', 'mp-1588029']",0.0004278,"{'Cu': 6.0, 'Sn': 2.0}",115.63201119737352,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",7.399335107469221e-06,0.0004278,0,0.0008556,MP,data/source/MP/cleaned/cifs/MP-mp-13138.cif,True,,data/final/MP/graphs/Cu0.8Sn0.2-MP-mp-13138-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
B6Er0.01Y0.99,2,0.0028571428571428,1.0,True,B6Er0.01Y0.99,B6Y1,0.0,Other,True,B85.714Er0.143Y14.143,B-Er-Y,3,Supercon,B6Er0.01Y0.99,MP-mp-2203,Y1B6,B-Y,B85.714Y14.286,P m -3 m,cubic,4.1021,4.1021,4.1021,data/final/MP/cifs/B6Er0.01Y0.99-MP-mp-2203-synth_doped.cif,data/source/MP/raw/cifs/mp-2203.cif,mp-2203,0.0,,2011-05-12 20:11:15,3.699194842606093,10.17188/1197299,"@misc{osti_1197299,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YB6 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197299"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686414'}},0.0285229421428576,6.62579631,520.0,-49.33978236,-7.048540337142858,"{'tags': ['Yttrium boride (1/6)', 'Yttrium octahedro-hexaboride', 'Yttrium hexaboride']}",-49.33978236,-7.048540337142858,-0.3995658030952376,"['xas', 'elasticity', 'bandstructure']",True,"[194635, 615723, 54730, 615726, 615714, 659505, 76126, 615728, 615710]",True,2021-05-12 10:56:16.728000,NM,7,9,mp-2203,,YB6,"{'functional': 'PBE', 'labels': ['Y_sv', 'B'], 'pot_type': 'paw'}","{'Y': 1.0, 'B': 6.0}",GGA,mp-2203,"['mp-1000404', 'mp-1006875', 'mp-2203', 'mp-1077859', 'mp-1440131', 'mp-1686414', 'mp-1801281', 'mp-1011609', 'mp-1592923']",3.48e-05,"{'Y': 1.0, 'B': 6.0}",69.026957252261,[],NM,False,221,0,"[0, 0, 0, 0, 0, 0, 0]",5.041508620005138e-07,3.48e-05,0,3.48e-05,MP,data/source/MP/cleaned/cifs/MP-mp-2203.cif,True,,data/final/MP/graphs/B6Er0.01Y0.99-MP-mp-2203-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Sn2O3,3,0.1333333333333333,1.0,True,Sn2O3,Sn2O4,0.0,Oxide,True,Sn40O60,Sn-O,2,Supercon,O3Sn2,MP-mp-856,Sn2O4,Sn-O,Sn33.333O66.66666666666667,P 42/m n m,tetragonal,3.243221,4.832336,4.832336,data/final/MP/cifs/Sn2O3-MP-mp-856-synth_doped.cif,data/source/MP/raw/cifs/mp-856.cif,mp-856,1.4067999999999996,,2011-05-13 03:58:00,6.60886550603123,10.17188/1272823,"@misc{osti_1272823,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SnO2 (SG:136) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1272823"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686908'}},0.0,5.43456316,700.0,-37.70787699,-6.284646165000001,"{'tags': ['Cassiterite', 'Tin dioxide - rutile-type, NP stable', 'Tin(IV) oxide', 'Tin dioxide', 'Tin(IV) dioxide', 'Tin dioxide - rutile-type', 'High pressure experimental phase', 'Tin oxide']}",-37.70787699,-6.284646165000001,-2.107481543333334,"['xas', 'bandstructure', 'diel', 'phonons', 'elasticity']",True,"[92552, 262767, 262771, 39173, 290013, 184420, 39174, 181276, 647470, 647469, 184326, 157448, 39175, 191344, 39176, 262770, 169032, 647465, 160667, 183984, 262769, 84576, 181277, 16635, 56001, 9163, 39178, 91517, 56671, 184325, 56673, 169033, 181109, 262768, 189463, 157449, 184324, 154960, 39177, 191343, 56674, 56672]",True,2021-05-12 10:56:31.128000,NM,6,49,mp-856,oxide,SnO2,"{'functional': 'PBE', 'labels': ['Sn_d', 'O'], 'pot_type': 'paw'}","{'Sn': 1.0, 'O': 2.0}",GGA,mp-856,"['mp-656468', 'mp-659608', 'mp-856', 'mp-2745', 'mp-1071834', 'mp-1071846', 'mp-1071841', 'mp-1071827', 'mp-1071856', 'mp-1071822', 'mp-1072049', 'mp-1072044', 'mp-1072060', 'mp-1072251', 'mp-1072254', 'mp-1072263', 'mp-1072681', 'mp-1072692', 'mp-1072723', 'mp-1072727', 'mp-1072683', 'mp-1072733', 'mp-1072959', 'mp-1077124', 'mp-1077189', 'mp-1077042', 'mp-1077342', 'mp-1077408', 'mp-1077414', 'mp-1077501', 'mp-1077597', 'mp-1077819', 'mp-1080383', 'mp-1173288', 'mp-1441018', 'mp-1539437', 'mp-1540940', 'mp-1686908', 'mp-1801901', 'mp-1932788', 'mp-1593707', 'mp-1594499', 'mp-1072266', 'mp-1072688', 'mp-1071854', 'mp-1072057', 'mp-1072732', 'mp-1071832', 'mp-665122']",3.7e-06,"{'Sn': 2.0, 'O': 4.0}",75.73398183153266,[],NM,False,136,0,"[0, 0, 0, 0, 0, 0]",9.771043091938592e-08,3.7e-06,0,7.4e-06,MP,data/source/MP/cleaned/cifs/MP-mp-856.cif,True,,data/final/MP/graphs/Sn2O3-MP-mp-856-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ba2Cu3Pr0.55Y0.45O7,2,0.0076923076923076,2.0,False,Ba4Cu6Pr1.1Y0.9O14,Ba4Cu6Pr1Y1O14,0.0,Cuprate,True,Ba15.385Cu23.077Pr4.231Y3.462O53.84615384615385,Ba-Cu-Pr-Y-O,5,Supercon,Y0.45Pr0.55Ba2Cu3O7,MP-mp-1228182,Ba4Pr1Y1Cu6O14,Ba-Cu-Pr-Y-O,Ba15.385Cu23.077Pr3.846Y3.846O53.84615384615385,C m m m,orthorhombic,3.949929,7.74232199751255,12.49432076,data/final/MP/cifs/Ba2Cu3Pr0.55Y0.45O7-MP-mp-1228182-synth_doped.cif,data/source/MP/raw/cifs/mp-1228182.cif,mp-1228182,0.0,,2019-01-13 03:55:31.194000,6.327747434820984,,,,0.0237480683814448,3.26863064,520.0,-159.60355051,-6.138598096538461,{'tags': []},-159.60355051,-6.138598096538461,-2.1704462631410246,[],False,[],True,2021-05-12 11:00:59.151000,NM,26,3,mp-1228182,oxide,Ba4PrY(Cu3O7)2,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Pr_3', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 4.0, 'Pr': 1.0, 'Y': 1.0, 'Cu': 6.0, 'O': 14.0}",GGA,mp-1228182,"['mp-1228182', 'mp-1368338', 'mp-1838576']",0.0118757,"{'Ba': 4.0, 'Pr': 1.0, 'Y': 1.0, 'Cu': 6.0, 'O': 14.0}",363.293922142809,[],NM,False,65,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",3.268895865351615e-05,0.0118757,0,0.0118757,MP,data/source/MP/cleaned/cifs/MP-mp-1228182.cif,True,,data/final/MP/graphs/Ba2Cu3Pr0.55Y0.45O7-MP-mp-1228182-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Al1Mo1.5Nb1.5,1,0.0,2.0,False,Al2Mo3Nb3,Al2Mo3Nb3,4.9,Other,True,Al25Mo37.5Nb37.5,Al-Mo-Nb,3,Supercon,Nb1.5Mo1.5Al1,MP-mp-1220636,Nb3Al2Mo3,Al-Mo-Nb,Al25Mo37.5Nb37.5,R 3 2,trigonal,5.09565044,5.09565044,5.09564994,data/final/MP/cifs/Al1Mo1.5Nb1.5-MP-mp-1220636.cif,data/source/MP/raw/cifs/mp-1220636.cif,mp-1220636,0.0,,2019-01-12 21:27:08.746000,7.787614395573825,,,{'GGA': {'task_id': 'mp-1754984'}},0.024551298900004,6.60798069,520.0,-72.06117606,-9.0076470075,{'tags': []},-72.06117606,-9.0076470075,-0.2161475237499992,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,8,5,mp-1220636,,Nb3Al2Mo3,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al', 'Mo_pv'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Al': 2.0, 'Mo': 3.0}",GGA,mp-1220636,"['mp-1220636', 'mp-1410880', 'mp-1754984', 'mp-1779379', 'mp-1622334']",0.3244129,"{'Nb': 3.0, 'Al': 2.0, 'Mo': 3.0}",132.30857618709769,[],NM,False,155,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.00245194158496,0.3244129,0,0.3244129,MP,data/source/MP/cleaned/cifs/MP-mp-1220636.cif,False,,data/final/MP/graphs/Al1Mo1.5Nb1.5-MP-mp-1220636.json,0,True,32,0,0,0,0,0,0,4,1,0,0,0,1.0,False
Rh1Th1,1,0.0,2.0,False,Rh2Th2,Rh2Th2,0.36,Other,True,Rh50Th50,Rh-Th,2,Supercon,Rh1Th1,MP-mp-12755,Th2Rh2,Rh-Th,Rh50Th50,C m c m,orthorhombic,3.903507997958689,4.188032,6.07142169,data/final/MP/cifs/Rh1Th1-MP-mp-12755.cif,data/source/MP/raw/cifs/mp-12755.cif,mp-12755,0.0,,2011-05-28 08:27:52,11.835358452076443,10.17188/1189167,"@misc{osti_1189167,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ThRh (SG:63) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189167"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677793'}},0.0,7.40882284,520.0,-33.37687983,-8.3442199575,"{'tags': ['Thorium rhodium (1/1)', 'Rhodium thorium (1/1)']}",-33.37687983,-8.3442199575,-0.9551368975,"['xas', 'bandstructure']",True,"[650464, 150542, 650471]",True,2021-05-12 10:56:53.126000,NM,4,8,mp-12755,,ThRh,"{'functional': 'PBE', 'labels': ['Th', 'Rh_pv'], 'pot_type': 'paw'}","{'Th': 1.0, 'Rh': 1.0}",GGA,mp-12755,"['mp-905356', 'mp-918559', 'mp-919571', 'mp-12755', 'mp-1438797', 'mp-1677793', 'mp-1783733', 'mp-1591863']",1.55e-06,"{'Th': 2.0, 'Rh': 2.0}",93.98732936364952,[],NM,False,63,0,"[0, 0, 0, 0]",3.2983169337706003e-08,1.55e-06,0,3.1e-06,MP,data/source/MP/cleaned/cifs/MP-mp-12755.cif,False,,data/final/MP/graphs/Rh1Th1-MP-mp-12755.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Al2Ce1Pd5,1,0.0,1.0,True,Al2Ce1Pd5,Al2Ce1Pd5,0.735,Heavy_fermion,True,Al25Ce12.5Pd62.5,Al-Ce-Pd,3,Supercon,Ce1Pd5Al2,MP-mp-1025445,Ce1Al2Pd5,Al-Ce-Pd,Al25Ce12.5Pd62.5,I 4/m m m,tetragonal,4.204624000521601,4.2046240005216005,8.03190164,data/final/MP/cifs/Al2Ce1Pd5-MP-mp-1025445.cif,data/source/MP/raw/cifs/mp-1025445.cif,mp-1025445,0.0,,2016-10-09 17:26:35,9.141554213337376,10.17188/1355614,"@article{osti_1355614,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeAl2Pd5 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1355614"",
    place = ""United States"",
    year = ""2017"",
    month = ""5""
}
",{'GGA': {'task_id': 'mp-1754741'}},0.0,7.00147751,520.0,-46.32664988,-5.790831235,"{'tags': ['ZrNi2Al5', 'CePd5Al2 ht']}",-46.32664988,-5.790831235,-0.8753750018749988,['bandstructure'],True,[],True,2021-05-12 10:58:09.072000,FM,8,6,mp-1025445,,CeAl2Pd5,"{'functional': 'PBE', 'labels': ['Ce', 'Al', 'Pd'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Al': 2.0, 'Pd': 5.0}",GGA,mp-1025445,"['mp-1025445', 'mp-1248507', 'mp-1394390', 'mp-1754741', 'mp-1928951', 'mp-1619067']",0.3641648,"{'Ce': 1.0, 'Al': 2.0, 'Pd': 5.0}",131.90850252562348,[],FM,True,139,1,"[0.4, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0027607378829068,0.3641648,1,0.3641648,MP,data/source/MP/cleaned/cifs/MP-mp-1025445.cif,False,,data/final/MP/graphs/Al2Ce1Pd5-MP-mp-1025445.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Cu1Te2,1,0.0,1.0,True,Cu1Te2,Cu1Te2,1.3,Other,True,Cu33.333Te66.667,Cu-Te,2,Supercon,Cu1Te2,MP-mp-1207193,Cu1Te2,Cu-Te,Cu33.333Te66.667,P -3 m 1,trigonal,4.023488003705444,4.02348816,5.09807,data/final/MP/cifs/Cu1Te2-MP-mp-1207193.cif,data/source/MP/raw/cifs/mp-1207193.cif,mp-1207193,0.0,,2019-01-12 10:21:06.726000,7.405458826245299,,,,0.0,7.24133947,520.0,-10.38817898,-3.4627263266666666,"{'tags': ['CuTe2', 'CdI2', 'CdI2-PbI2 polytype']}",-10.38817898,-3.4627263266666666,-0.2821234833333328,[],False,[],True,2021-05-12 11:00:19.396000,NM,3,2,mp-1207193,,CuTe2,"{'functional': 'PBE', 'labels': ['Cu_pv', 'Te'], 'pot_type': 'paw'}","{'Cu': 1.0, 'Te': 2.0}",GGA,mp-1207193,"['mp-1207193', 'mp-1870598']",0.000169,"{'Cu': 1.0, 'Te': 2.0}",71.47297658946584,[],NM,False,164,0,"[0, 0, 0]",2.364530037285565e-06,0.000169,0,0.000169,MP,data/source/MP/cleaned/cifs/MP-mp-1207193.cif,False,,data/final/MP/graphs/Cu1Te2-MP-mp-1207193.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
B1Cr1,1,0.0,4.0,False,B4Cr4,B4Cr4,0.0,Other,True,B50Cr50,B-Cr,2,Supercon,B1Cr1,MP-mp-1080664,Cr4B4,B-Cr,B50Cr50,I 41/a m d,tetragonal,2.913629999202049,2.9136299992020493,8.10668601,data/final/MP/cifs/B1Cr1-MP-mp-1080664.cif,data/source/MP/raw/cifs/mp-1080664.cif,mp-1080664,0.0,,2018-04-24 12:47:02,6.267642517913936,,,{'GGA': {'task_id': 'mp-1698863'}},0.0,8.47024352,520.0,-69.56033101,-8.69504137625,{'tags': ['Chromium boride (1/1)']},-69.56033101,-8.69504137625,-0.5288217558333326,['bandstructure'],True,[613476],True,2021-05-12 10:58:18.470000,NM,8,5,mp-1080664,,CrB,"{'functional': 'PBE', 'labels': ['Cr_pv', 'B'], 'pot_type': 'paw'}","{'Cr': 1.0, 'B': 1.0}",GGA,mp-1080664,"['mp-1080664', 'mp-1415651', 'mp-1698863', 'mp-1790956', 'mp-1588717']",0.00199745,"{'Cr': 4.0, 'B': 4.0}",66.56004576634021,[],NM,False,141,0,"[-0.0, -0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0]",0.0001200389799617,0.00199745,0,0.0079898,MP,data/source/MP/cleaned/cifs/MP-mp-1080664.cif,False,,data/final/MP/graphs/B1Cr1-MP-mp-1080664.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ce0.9Co1In5La0.1,2,0.0285714285714285,1.0,True,Ce0.9Co1In5La0.1,Ce1Co1In5,1.22,Heavy_fermion,True,Ce12.857Co14.286In71.429La1.429,Ce-Co-In-La,4,Supercon,Ce0.9La0.1Co1In5,MP-mp-19961,Ce1In5Co1,Ce-Co-In,Ce14.286Co14.286In71.429,P 4/m m m,tetragonal,4.635989,4.635989,7.564124,data/final/MP/cifs/Ce0.9Co1In5La0.1-MP-mp-19961-synth_doped.cif,data/source/MP/raw/cifs/mp-19961.cif,mp-19961,0.0,,2014-02-21 14:08:25,7.897022127398995,10.17188/1195145,"@misc{osti_1195145,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeIn5Co (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195145"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701944'}},0.0,7.80626318,520.0,-28.52795357,-4.075421938571429,{'tags': ['Cerium cobalt indium (1/1/5)']},-28.52795357,-4.075421938571429,-0.2468754242857146,"['xas', 'bandstructure']",True,[102108],True,2021-05-12 10:56:57.051000,FM,7,8,mp-19961,,CeIn5Co,"{'functional': 'PBE', 'labels': ['Ce', 'In_d', 'Co'], 'pot_type': 'paw'}","{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",GGA,mp-19961,"['mp-928775', 'mp-912209', 'mp-928270', 'mp-19961', 'mp-1504062', 'mp-1701944', 'mp-1785253', 'mp-1593180']",0.9310323,"{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",162.57113333428427,[],FM,True,123,1,"[0.7, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0057269226147644,0.9310323,1,0.9310323,MP,data/source/MP/cleaned/cifs/MP-mp-19961.cif,True,,data/final/MP/graphs/Ce0.9Co1In5La0.1-MP-mp-19961-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ge2Pd1.99Pt0.01Sr1,2,0.004,1.0,True,Ge2Pd1.99Pt0.01Sr1,Ge2Pd2Sr1,2.82,Other,True,Ge40Pd39.8Pt0.2Sr20,Ge-Pd-Pt-Sr,4,Supercon,Sr1Pd1.99Pt0.01Ge2,MP-mp-978986,Sr1Ge2Pd2,Ge-Pd-Sr,Ge40Pd40Sr20,I 4/m m m,tetragonal,4.438671999438209,4.438671999438209,6.03054834,data/final/MP/cifs/Ge2Pd1.99Pt0.01Sr1-MP-mp-978986-synth_doped.cif,data/source/MP/raw/cifs/mp-978986.cif,mp-978986,0.0,,2015-10-09 03:56:43,7.295677176868866,10.17188/1316057,"@misc{osti_1316057,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr(GePd)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1316057"",
    place = ""United States"",
    year = ""2016"",
    month = ""9"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688092'}},0.0,4.0155429,520.0,-24.8627221,-4.97254442,"{'tags': ['Strontium palladium germanide (1/2/2)', 'Strontium palladium germanium (1/2/2)', 'High pressure experimental phase']}",-24.8627221,-4.97254442,-0.7134818633333324,"['xas', 'elasticity', 'bandstructure']",True,"[165985, 181157, 181155, 181156, 168133]",True,2021-05-12 10:56:37.246000,NM,5,9,mp-978986,,Sr(GePd)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ge_d', 'Pd'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Ge': 2.0, 'Pd': 2.0}",GGA,mp-978986,"['mp-1005776', 'mp-978986', 'mp-1005866', 'mp-979737', 'mp-1438850', 'mp-1688092', 'mp-1782349', 'mp-1011093', 'mp-1589601']",0.0012593,"{'Sr': 1.0, 'Ge': 2.0, 'Pd': 2.0}",101.45304755163892,[],NM,False,139,0,"[0, 0, 0, 0, 0]",1.2412638460752248e-05,0.0012593,0,0.0012593,MP,data/source/MP/cleaned/cifs/MP-mp-978986.cif,True,,data/final/MP/graphs/Ge2Pd1.99Pt0.01Sr1-MP-mp-978986-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Cu1Sr0.95Y0.05O2,2,0.025,2.0,False,Cu2Sr1.9Y0.1O4,Cu2Sr2O4,38.6,Cuprate,True,Cu25Sr23.75Y1.25O50,Cu-Sr-Y-O,4,Supercon,Sr0.95Y0.05Cu1O2,MP-mp-5787,Sr2Cu2O4,Cu-Sr-O,Cu25Sr25O50,C m c m,orthorhombic,3.644437999912225,3.974263,8.32909336,data/final/MP/cifs/Cu1Sr0.95Y0.05O2-MP-mp-5787-synth_doped.cif,data/source/MP/raw/cifs/mp-5787.cif,mp-5787,0.0,,2011-05-13 22:43:08,5.167573150857569,10.17188/1276630,"@misc{osti_1276630,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SrCuO2 (SG:63) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1276630"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703560'}},0.0,3.45760864,520.0,-45.24374469,-5.65546808625,"{'tags': ['Strontium cuprate', 'Strontium copper oxide']}",-45.24374469,-5.65546808625,-2.0778125529166664,"['xas', 'elasticity', 'bandstructure']",True,"[77291, 93653, 202992, 16217, 83051, 77293]",True,2021-05-12 10:56:27.046000,NM,8,8,mp-5787,oxide,SrCuO2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Cu': 1.0, 'O': 2.0}",GGA,mp-5787,"['mp-924142', 'mp-909103', 'mp-5787', 'mp-924940', 'mp-1475985', 'mp-1703560', 'mp-1802910', 'mp-1593696']",4e-07,"{'Sr': 2.0, 'Cu': 2.0, 'O': 4.0}",117.71572347282628,[],NM,False,63,0,"[0, 0, 0, 0, 0, 0, 0, 0]",6.796033498317439e-09,4e-07,0,8e-07,MP,data/source/MP/cleaned/cifs/MP-mp-5787.cif,True,,data/final/MP/graphs/Cu1Sr0.95Y0.05O2-MP-mp-5787-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ba2Cu3Eu0.3Pr0.7O7,3,0.0307692307692307,2.0,False,Ba4Cu6Eu0.6Pr1.4O14,Ba4Cu6Eu1Pr1O14,0.0,Cuprate,True,Ba15.385Cu23.077Eu2.308Pr5.385O53.84615384615385,Ba-Cu-Eu-Pr-O,5,Supercon,Eu0.3Pr0.7Ba2Cu3O7,MP-mp-1228601,Ba4Pr1Eu1Cu6O14,Ba-Cu-Eu-Pr-O,Ba15.385Cu23.077Eu3.846Pr3.846O53.84615384615385,C m m m,orthorhombic,3.879178,7.885327998393908,12.58992067,data/final/MP/cifs/Ba2Cu3Eu0.3Pr0.7O7-MP-mp-1228601-synth_doped.cif,data/source/MP/raw/cifs/mp-1228601.cif,mp-1228601,0.0,,2019-01-13 04:17:40.184000,6.571777011913311,,,,0.0156188576201969,3.16956422,520.0,-161.67470258,-6.218257791538462,{'tags': []},-161.67470258,-6.218257791538462,-2.1029685596153844,[],False,[],True,2021-05-12 11:00:59.151000,FM,26,3,mp-1228601,oxide,Ba4PrEu(Cu3O7)2,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Pr_3', 'Eu', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 4.0, 'Pr': 1.0, 'Eu': 1.0, 'Cu': 6.0, 'O': 14.0}",GGA,mp-1228601,"['mp-1228601', 'mp-1347083', 'mp-1836684']",6.3399007,"{'Ba': 4.0, 'Pr': 1.0, 'Eu': 1.0, 'Cu': 6.0, 'O': 14.0}",365.73710597766734,[],FM,True,65,1,"[0.0, 0.0, 0.0, 0.0, 0.0, 6.3, -0.0, -0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0173345843131025,6.3399007,1,6.3399007,MP,data/source/MP/cleaned/cifs/MP-mp-1228601.cif,True,,data/final/MP/graphs/Ba2Cu3Eu0.3Pr0.7O7-MP-mp-1228601-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
As2Eu0.78Fe2La0.22,3,0.088,1.0,True,As2Eu0.78Fe2La0.22,As2Eu1Fe2,0.0,Ferrite,True,As40Eu15.6Fe40La4.4,As-Eu-Fe-La,4,Supercon,Eu0.78La0.22Fe2As2,MP-mp-20890,Eu1Fe2As2,As-Eu-Fe,As40Eu20Fe40,I 4/m m m,tetragonal,3.9736679999368567,3.9736679999368567,6.07120609,data/final/MP/cifs/As2Eu0.78Fe2La0.22-MP-mp-20890-synth_doped.cif,data/source/MP/raw/cifs/mp-20890.cif,mp-20890,0.0,,2014-02-21 09:03:25,8.079887417044961,10.17188/1196086,"@misc{osti_1196086,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Eu(FeAs)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196086"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687595'}},0.0,5.69045342,520.0,-39.43180547,-7.886361094,"{'tags': ['High pressure experimental phase', 'Europium diiron diarsenide - HP', 'Europium diiron diarsenide', 'Europium iron arsenide (1/2/2)']}",-39.43180547,-7.886361094,-0.5763016570000005,"['xas', 'bandstructure']",True,"[169689, 169687, 185355, 169691, 163211, 185356, 610431, 169690, 169688, 163210]",True,2021-05-12 10:56:57.051000,FM,5,16,mp-20890,,Eu(FeAs)2,"{'functional': 'PBE', 'labels': ['Eu', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Eu': 1.0, 'Fe': 2.0, 'As': 2.0}",GGA,mp-20890,"['mp-991161', 'mp-993140', 'mp-20890', 'mp-1069324', 'mp-1069480', 'mp-1069596', 'mp-1069907', 'mp-1070115', 'mp-1069978', 'mp-1442076', 'mp-1687595', 'mp-1782260', 'mp-994461', 'mp-1594012', 'mp-1069557', 'mp-1070074']",6.9579645,"{'Eu': 1.0, 'Fe': 2.0, 'As': 2.0}",84.97992844321493,[],FM,True,139,1,"[6.7, -0.0, -0.0, 0.0, 0.0]",0.0818777401613068,6.9579645,1,6.9579645,MP,data/source/MP/cleaned/cifs/MP-mp-20890.cif,True,,data/final/MP/graphs/As2Eu0.78Fe2La0.22-MP-mp-20890-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Sn3Th1,1,0.0,1.0,True,Sn3Th1,Sn3Th1,3.33,Other,True,Sn75Th25,Sn-Th,2,Supercon,Sn3Th1,MP-mp-435,Th1Sn3,Sn-Th,Sn75Th25,P m -3 m,cubic,4.766161,4.766161,4.766161,data/final/MP/cifs/Sn3Th1-MP-mp-435.cif,data/source/MP/raw/cifs/mp-435.cif,mp-435,0.0,,2011-05-13 04:44:32,9.020786584768093,10.17188/1208088,"@misc{osti_1208088,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ThSn3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208088"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1670958'}},0.0,8.72220011,520.0,-21.23825961,-5.3095649025,{'tags': ['Tin thorium (3/1)']},-21.23825961,-5.3095649025,-0.4489214487500002,"['xas', 'elasticity', 'bandstructure']",True,"[652775, 106083, 106082, 652770]",True,2021-05-12 10:56:20.740000,NM,4,8,mp-435,,ThSn3,"{'functional': 'PBE', 'labels': ['Th', 'Sn_d'], 'pot_type': 'paw'}","{'Th': 1.0, 'Sn': 3.0}",GGA,mp-435,"['mp-929162', 'mp-912835', 'mp-929520', 'mp-435', 'mp-1437678', 'mp-1670958', 'mp-1781858', 'mp-1588601']",0.0015074,"{'Th': 1.0, 'Sn': 3.0}",108.26949869377064,[],NM,False,221,0,"[0, 0, 0, 0]",1.3922665369159314e-05,0.0015074,0,0.0015074,MP,data/source/MP/cleaned/cifs/MP-mp-435.cif,False,,data/final/MP/graphs/Sn3Th1-MP-mp-435.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Hf1Os1,1,0.0,1.0,True,Hf1Os1,Hf1Os1,0.0,Other,True,Hf50Os50,Hf-Os,2,Supercon,Hf1Os1,MP-mp-11452,Hf1Os1,Hf-Os,Hf50Os50,P m -3 m,cubic,3.258835,3.258835,3.258835,data/final/MP/cifs/Hf1Os1-MP-mp-11452.cif,data/source/MP/raw/cifs/mp-11452.cif,mp-11452,0.0,,2011-05-27 18:25:43,17.691256391406036,10.17188/1187841,"@misc{osti_1187841,
    author = ""Persson, Kristin"",
    title = ""Materials Data on HfOs (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187841"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1674351'}},0.0,6.72784813,520.0,-22.60216114,-11.30108057,"{'tags': ['Osmium hafnium (1/1)', 'Hafnium osmium (1/1)']}",-22.60216114,-11.30108057,-0.7088030174999993,"['xas', 'elasticity', 'bandstructure']",True,"[290935, 104252]",True,2021-05-12 10:56:10.715000,NM,2,12,mp-11452,,HfOs,"{'functional': 'PBE', 'labels': ['Hf_pv', 'Os_pv'], 'pot_type': 'paw'}","{'Hf': 1.0, 'Os': 1.0}",GGA,mp-11452,"['mp-678211', 'mp-657275', 'mp-663054', 'mp-11452', 'mp-1057565', 'mp-1057575', 'mp-1057589', 'mp-1440095', 'mp-1674351', 'mp-1791178', 'mp-1588516', 'mp-1057587']",0.0009378,"{'Hf': 1.0, 'Os': 1.0}",34.60884581007933,[],NM,False,221,0,"[0, 0]",2.709711861372965e-05,0.0009378,0,0.0009378,MP,data/source/MP/cleaned/cifs/MP-mp-11452.cif,False,,data/final/MP/graphs/Hf1Os1-MP-mp-11452.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
As2Ba0.65Fe2K0.35,3,0.06,2.0,False,As4Ba1.3Fe4K0.7,As4Ba1Fe4K1,38.0,Ferrite,True,As40Ba13Fe40K7,As-Ba-Fe-K,4,Supercon,Ba0.65K0.35Fe2As2,MP-mp-1223517,K1Ba1Fe4As4,As-Ba-Fe-K,As40Ba10Fe40K10,C m m m,orthorhombic,5.479027,5.480024002658328,7.13170472,data/final/MP/cifs/As2Ba0.65Fe2K0.35-MP-mp-1223517-synth_doped.cif,data/source/MP/raw/cifs/mp-1223517.cif,mp-1223517,0.0,,2019-01-12 23:54:03.876000,5.87534599912672,,,{'GGA': {'task_id': 'mp-1743010'}},0.0132513644999994,4.21185628,520.0,-59.66633886,-5.966633886,{'tags': []},-59.66633886,-5.966633886,-0.4120461663000007,[],False,[],True,2021-05-12 11:00:52.054000,FM,10,4,mp-1223517,,KBa(FeAs)4,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",GGA,mp-1223517,"['mp-1223517', 'mp-1396881', 'mp-1743010', 'mp-1827585']",0.9947188,"{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",197.6961518155852,[],FM,True,65,1,"[0.0, 0.0, 0.3, 0.3, 0.3, 0.3, 0.0, 0.0, 0.0, 0.0]",0.0050315536790412,0.9947188,4,0.9947188,MP,data/source/MP/cleaned/cifs/MP-mp-1223517.cif,True,,data/final/MP/graphs/As2Ba0.65Fe2K0.35-MP-mp-1223517-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Rh2Sn1Y1,1,0.0,1.0,True,Rh2Sn1Y1,Rh2Sn1Y1,4.1,Other,True,Rh50Sn25Y25,Rh-Sn-Y,3,Supercon,Y1Rh2Sn1,MP-mp-865518,Y1Sn1Rh2,Rh-Sn-Y,Rh50Sn25Y25,F m -3 m,cubic,4.71601756,4.716017559999999,4.716017559999999,data/final/MP/cifs/Rh2Sn1Y1-MP-mp-865518.cif,data/source/MP/raw/cifs/mp-865518.cif,mp-865518,0.0,,2014-08-31 11:27:42,9.256281034879466,10.17188/1310797,"@misc{osti_1310797,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YSnRh2 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1310797"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1767922'}},0.0,7.28477764,520.0,-28.30892244,-7.07723061,{'tags': []},-28.30892244,-7.07723061,-0.7760659329166666,['bandstructure'],True,[],True,2021-05-12 10:59:07.834000,NM,4,8,mp-865518,,YSnRh2,"{'functional': 'PBE', 'labels': ['Y_sv', 'Sn_d', 'Rh_pv'], 'pot_type': 'paw'}","{'Y': 1.0, 'Sn': 1.0, 'Rh': 2.0}",GGA,mp-865518,"['mp-865518', 'mp-1052940', 'mp-1052923', 'mp-1407581', 'mp-1767922', 'mp-1801416', 'mp-1617923', 'mp-1052942']",0.3064925,"{'Y': 1.0, 'Sn': 1.0, 'Rh': 2.0}",74.1670907591796,[],NM,False,225,0,"[0, 0, 0, 0]",0.0041324595162452,0.3064925,0,0.3064925,MP,data/source/MP/cleaned/cifs/MP-mp-865518.cif,False,,data/final/MP/graphs/Rh2Sn1Y1-MP-mp-865518.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
B2Er0.45Lu0.55Ru1,2,0.025,4.0,False,B8Er1.8Lu2.2Ru4,B8Er2Lu2Ru4,5.26,Other,True,B50Er11.25Lu13.75Ru25,B-Er-Lu-Ru,4,Supercon,Lu0.55Er0.45Ru1B2,MP-mp-1225723,Er2Lu2B8Ru4,B-Er-Lu-Ru,B50Er12.5Lu12.5Ru25,P m c 21,orthorhombic,5.281004,5.867228,6.310302,data/final/MP/cifs/B2Er0.45Lu0.55Ru1-MP-mp-1225723-synth_doped.cif,data/source/MP/raw/cifs/mp-1225723.cif,mp-1225723,0.0,,2019-01-13 01:47:37.711000,9.980876118968816,,,{'GGA': {'task_id': 'mp-1733567'}},0.0007253706249992,6.01782669,520.0,-119.13701765,-7.446063603125,{'tags': []},-119.13701765,-7.446063603125,-0.651686637708333,[],False,[],True,2021-05-12 11:00:54.298000,NM,16,4,mp-1225723,,ErLu(B2Ru)2,"{'functional': 'PBE', 'labels': ['Er_3', 'Lu_3', 'B', 'Ru_pv'], 'pot_type': 'paw'}","{'Er': 1.0, 'Lu': 1.0, 'B': 4.0, 'Ru': 2.0}",GGA,mp-1225723,"['mp-1225723', 'mp-1402241', 'mp-1733567', 'mp-1786069']",0.000337,"{'Er': 2.0, 'Lu': 2.0, 'B': 8.0, 'Ru': 4.0}",195.52378955398487,[],NM,False,26,0,"[-0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",3.447150863521424e-06,0.000337,0,0.000674,MP,data/source/MP/cleaned/cifs/MP-mp-1225723.cif,True,,data/final/MP/graphs/B2Er0.45Lu0.55Ru1-MP-mp-1225723-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,1,0,0,0,1.0,False
As2Ba0.797Fe2K0.203,3,0.1188000000000001,2.0,False,As4Ba1.594Fe4K0.406,As4Ba1Fe4K1,17.0,Ferrite,True,As40Ba15.94Fe40K4.06,As-Ba-Fe-K,4,Supercon,Ba0.797K0.203Fe2As2,MP-mp-1223517,K1Ba1Fe4As4,As-Ba-Fe-K,As40Ba10Fe40K10,C m m m,orthorhombic,5.479027,5.480024002658328,7.13170472,data/final/MP/cifs/As2Ba0.797Fe2K0.203-MP-mp-1223517-synth_doped.cif,data/source/MP/raw/cifs/mp-1223517.cif,mp-1223517,0.0,,2019-01-12 23:54:03.876000,5.87534599912672,,,{'GGA': {'task_id': 'mp-1743010'}},0.0132513644999994,4.21185628,520.0,-59.66633886,-5.966633886,{'tags': []},-59.66633886,-5.966633886,-0.4120461663000007,[],False,[],True,2021-05-12 11:00:52.054000,FM,10,4,mp-1223517,,KBa(FeAs)4,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",GGA,mp-1223517,"['mp-1223517', 'mp-1396881', 'mp-1743010', 'mp-1827585']",0.9947188,"{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",197.6961518155852,[],FM,True,65,1,"[0.0, 0.0, 0.3, 0.3, 0.3, 0.3, 0.0, 0.0, 0.0, 0.0]",0.0050315536790412,0.9947188,4,0.9947188,MP,data/source/MP/cleaned/cifs/MP-mp-1223517.cif,True,,data/final/MP/graphs/As2Ba0.797Fe2K0.203-MP-mp-1223517-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
B2Er0.35Lu0.65Ru1,3,0.075,4.0,False,B8Er1.4Lu2.6Ru4,B8Er2Lu2Ru4,6.94,Other,True,B50Er8.75Lu16.25Ru25,B-Er-Lu-Ru,4,Supercon,Lu0.65Er0.35Ru1B2,MP-mp-1225723,Er2Lu2B8Ru4,B-Er-Lu-Ru,B50Er12.5Lu12.5Ru25,P m c 21,orthorhombic,5.281004,5.867228,6.310302,data/final/MP/cifs/B2Er0.35Lu0.65Ru1-MP-mp-1225723-synth_doped.cif,data/source/MP/raw/cifs/mp-1225723.cif,mp-1225723,0.0,,2019-01-13 01:47:37.711000,9.980876118968816,,,{'GGA': {'task_id': 'mp-1733567'}},0.0007253706249992,6.01782669,520.0,-119.13701765,-7.446063603125,{'tags': []},-119.13701765,-7.446063603125,-0.651686637708333,[],False,[],True,2021-05-12 11:00:54.298000,NM,16,4,mp-1225723,,ErLu(B2Ru)2,"{'functional': 'PBE', 'labels': ['Er_3', 'Lu_3', 'B', 'Ru_pv'], 'pot_type': 'paw'}","{'Er': 1.0, 'Lu': 1.0, 'B': 4.0, 'Ru': 2.0}",GGA,mp-1225723,"['mp-1225723', 'mp-1402241', 'mp-1733567', 'mp-1786069']",0.000337,"{'Er': 2.0, 'Lu': 2.0, 'B': 8.0, 'Ru': 4.0}",195.52378955398487,[],NM,False,26,0,"[-0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",3.447150863521424e-06,0.000337,0,0.000674,MP,data/source/MP/cleaned/cifs/MP-mp-1225723.cif,True,,data/final/MP/graphs/B2Er0.35Lu0.65Ru1-MP-mp-1225723-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,1,0,0,0,1.0,False
Re24Sc5,1,0.0,1.0,True,Re24Sc5,Re24Sc5,2.2,Other,True,Re82.759Sc17.241,Re-Sc,2,Supercon,Re24Sc5,MP-mp-11558,Sc5Re24,Re-Sc,Re82.759Sc17.241,I -4 3 m,cubic,8.454607651874255,8.45460765,8.45460765,data/final/MP/cifs/Re24Sc5-MP-mp-11558.cif,data/source/MP/raw/cifs/mp-11558.cif,mp-11558,0.0,,2011-08-11 11:59:18,16.753684888078904,10.17188/1188063,"@misc{osti_1188063,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sc5Re24 (SG:217) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188063"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1761760'}},0.0,6.75467172,520.0,-336.84514103,-11.615349690689657,{'tags': ['Rhenium scandium (24/5)']},-336.84514103,-11.615349690689657,-0.2246256229310339,"['xas', 'bandstructure']",True,[105891],True,2021-05-12 10:56:51.169000,NM,29,9,mp-11558,,Sc5Re24,"{'functional': 'PBE', 'labels': ['Sc_sv', 'Re_pv'], 'pot_type': 'paw'}","{'Sc': 5.0, 'Re': 24.0}",GGA,mp-11558,"['mp-991607', 'mp-993544', 'mp-11558', 'mp-1115692', 'mp-1400607', 'mp-1761760', 'mp-1815630', 'mp-995023', 'mp-1618496']",0.0035669,"{'Sc': 5.0, 'Re': 24.0}",465.2201139156175,[],NM,False,217,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",7.667123353671187e-06,0.0035669,0,0.0035669,MP,data/source/MP/cleaned/cifs/MP-mp-11558.cif,False,,data/final/MP/graphs/Re24Sc5-MP-mp-11558.json,0,True,-43m,5,0,0,0,0,0,0,0,0,1,0,1.0,False
Bi4Rh1,1,0.0,12.0,False,Bi48Rh12,Bi48Rh12,2.3333333335,Other,True,Bi80Rh20,Bi-Rh,2,Supercon,Bi4Rh1,MP-mp-30467,Bi48Rh12,Bi-Rh,Bi80Rh20,I a -3 d,cubic,13.157196602916748,13.157196600000002,13.1571966,data/final/MP/cifs/Bi4Rh1-MP-mp-30467.cif,data/source/MP/raw/cifs/mp-30467.cif,mp-30467,0.0,,2014-02-18 02:19:11,10.669590685107751,10.17188/1204874,"@misc{osti_1204874,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Bi4Rh (SG:230) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1204874"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-941121'}},0.0,6.1029162,520.0,-283.61817085,-4.726969514166667,{'tags': ['Bismuth rhodium (4/1)']},-283.61817085,-4.726969514166667,-0.1420804921666672,"['xas', 'bandstructure']",True,[58854],True,2021-05-12 10:57:04.957000,NM,60,5,mp-30467,,Bi4Rh,"{'functional': 'PBE', 'labels': ['Bi', 'Rh_pv'], 'pot_type': 'paw'}","{'Bi': 4.0, 'Rh': 1.0}",GGA,mp-30467,"['mp-934600', 'mp-941121', 'mp-941501', 'mp-30467', 'mp-1325245']",0.0046802166666666,"{'Bi': 48.0, 'Rh': 12.0}",1753.348321234545,[],NM,False,230,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.20316273268825e-05,0.0046802166666666,0,0.0561626,MP,data/source/MP/cleaned/cifs/MP-mp-30467.cif,False,,data/final/MP/graphs/Bi4Rh1-MP-mp-30467.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,1,0,1.0,False
Cu2Ga1Sr2Y1O7,1,0.0,2.0,False,Cu4Ga2Sr4Y2O14,Cu4Ga2Sr4Y2O14,0.0,Cuprate,True,Cu15.385Ga7.692Sr15.385Y7.692O53.84615384615385,Cu-Ga-Sr-Y-O,5,Supercon,Ga1Sr2Y1Cu2O7,MP-mp-556575,Sr4Y2Ga2Cu4O14,Cu-Ga-Sr-Y-O,Cu15.385Ga7.692Sr15.385Y7.692O53.84615384615385,I m a 2,orthorhombic,5.421121999352457,5.529882000637114,12.241417359999998,data/final/MP/cifs/Cu2Ga1Sr2Y1O7-MP-mp-556575.cif,data/source/MP/raw/cifs/mp-556575.cif,mp-556575,0.0,,2013-10-12 13:07:42,5.465801017735483,10.17188/1269426,"@misc{osti_1269426,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr2YGaCu2O7 (SG:46) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1269426"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1767651'}},0.0200609992788507,3.26459112,520.0,-166.51938608,-6.404591772307692,{'tags': ['Yttrium strontium gallium copper oxide (1/2/1/2/7)']},-166.51938608,-6.404591772307692,-2.4893075863461536,"['xas', 'bandstructure']",True,[71263],True,2021-05-12 10:58:03.426000,NM,26,13,mp-556575,oxide,Sr2YGaCu2O7,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Y_sv', 'Ga_d', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Y': 1.0, 'Ga': 1.0, 'Cu': 2.0, 'O': 7.0}",GGA,mp-556575,"['mp-683425', 'mp-713688', 'mp-845775', 'mp-556575', 'mp-1044974', 'mvc-16182', 'mp-1048817', 'mp-1378443', 'mp-1767651', 'mp-1843437', 'mp-1610699', 'mp-846319', 'mp-1044979']",0.02598615,"{'Sr': 4.0, 'Y': 2.0, 'Ga': 2.0, 'Cu': 4.0, 'O': 14.0}",348.13448118806235,[],NM,False,46,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001492879987717,0.02598615,0,0.0519723,MP,data/source/MP/cleaned/cifs/MP-mp-556575.cif,False,,data/final/MP/graphs/Cu2Ga1Sr2Y1O7-MP-mp-556575.json,0,True,mm2,0,0,0,6,0,0,0,0,0,1,0,1.0,False
Hf1Mo2,1,0.0,2.0,False,Hf2Mo4,Hf2Mo4,0.210166667,Other,True,Hf33.333Mo66.667,Hf-Mo,2,Supercon,Hf1Mo2,MP-mp-2363,Hf2Mo4,Hf-Mo,Hf33.333Mo66.667,F d -3 m,cubic,5.363400690000001,5.36340069,5.36340069,data/final/MP/cifs/Hf1Mo2-MP-mp-2363.cif,data/source/MP/raw/cifs/mp-2363.cif,mp-2363,0.0,,2011-05-13 13:35:34,11.274808163534129,10.17188/1199626,"@misc{osti_1199626,
    author = ""Persson, Kristin"",
    title = ""Materials Data on HfMo2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199626"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-930018'}},0.0,6.52746893,520.0,-64.32233909,-10.720389848333332,{'tags': ['Hafnium molybdenum (1/2)']},-64.32233909,-10.720389848333332,-0.1708982116666675,"['xas', 'elasticity', 'bandstructure']",True,"[638612, 104216, 638607, 638619, 104217, 638621]",True,2021-05-12 10:56:16.728000,NM,6,7,mp-2363,,HfMo2,"{'functional': 'PBE', 'labels': ['Hf_pv', 'Mo_pv'], 'pot_type': 'paw'}","{'Hf': 1.0, 'Mo': 2.0}",GGA,mp-2363,"['mp-913706', 'mp-930018', 'mp-930539', 'mp-2363', 'mp-1437600', 'mp-1805163', 'mp-1591067']",2.265e-05,"{'Hf': 2.0, 'Mo': 4.0}",109.0952227614423,[],NM,False,166,0,"[0.0, 0.0, 0.0, 0.0, -0.0, 0.0]",4.152335808420977e-07,2.265e-05,0,4.53e-05,MP,data/source/MP/cleaned/cifs/MP-mp-2363.cif,False,,data/final/MP/graphs/Hf1Mo2-MP-mp-2363.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ba2Ca2Cu3Hg0.8Pb0.2O8,3,0.0249999999999999,1.0,True,Ba2Ca2Cu3Hg0.8Pb0.2O8,Ba2Ca2Cu3Hg1O8,132.0,Cuprate,True,Ba12.5Ca12.5Cu18.75Hg5Pb1.25O50,Ba-Ca-Cu-Hg-Pb-O,6,Supercon,Hg0.8Pb0.2Ba2Ca2Cu3O8,MP-mp-22601,Ba2Ca2Cu3Hg1O8,Ba-Ca-Cu-Hg-O,Ba12.5Ca12.5Cu18.75Hg6.25O50,P 4/m m m,tetragonal,3.892682,3.892682,16.248444,data/final/MP/cifs/Ba2Ca2Cu3Hg0.8Pb0.2O8-MP-mp-22601-synth_doped.cif,data/source/MP/raw/cifs/mp-22601.cif,mp-22601,0.0,,2014-02-22 21:26:14,5.894777202717408,10.17188/1198815,"@misc{osti_1198815,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Ca2Cu3HgO8 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198815"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702575'}},0.017646669895833,3.3485087,520.0,-87.2132649,-5.45082905625,{'tags': ['High pressure experimental phase']},-87.2132649,-5.45082905625,-2.0421959415624995,"['xas', 'bandstructure']",True,"[75735, 75731, 75736, 75733, 75734, 75737, 75730, 75732]",True,2021-05-12 10:58:03.426000,NM,16,11,mp-22601,oxide,Ba2Ca2Cu3HgO8,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ca_sv', 'Cu_pv', 'Hg', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Ca': 2.0, 'Cu': 3.0, 'Hg': 1.0, 'O': 8.0}",GGA,mp-22601,"['mp-1001293', 'mp-1007610', 'mp-22601', 'mp-1045042', 'mp-1045054', 'mvc-16317', 'mp-1433925', 'mp-1702575', 'mp-1776236', 'mp-1597784', 'mp-1045058']",0.0379919,"{'Ba': 2.0, 'Ca': 2.0, 'Cu': 3.0, 'Hg': 1.0, 'O': 8.0}",246.2122357120388,[],NM,False,123,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001543054913177,0.0379919,0,0.0379919,MP,data/source/MP/cleaned/cifs/MP-mp-22601.cif,True,,data/final/MP/graphs/Ba2Ca2Cu3Hg0.8Pb0.2O8-MP-mp-22601-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Bi2Ca1Cu2Sr2O8.234,2,0.0143363528948404,1.9430324993927617,False,Bi3.886Ca1.943Cu3.886Sr3.886O16,Bi4Ca2Cu4Sr4O16,84.0,Cuprate,True,Bi13.129Ca6.564Cu13.129Sr13.129O54.05015097807536,Bi-Ca-Cu-Sr-O,5,Supercon,Bi2Sr2Ca1Cu2O8.234,MP-mp-1218930,Sr4Ca2Cu4Bi4O16,Bi-Ca-Cu-Sr-O,Bi13.333Ca6.667Cu13.333Sr13.333O53.333333333333336,C c c 2,orthorhombic,5.417115,5.472898000129128,16.11398919,data/final/MP/cifs/Bi2Ca1Cu2Sr2O8.234-MP-mp-1218930-synth_doped.cif,data/source/MP/raw/cifs/mp-1218930.cif,mp-1218930,0.0,,2019-01-12 20:01:06.544000,6.266668983881059,,,,0.039252223722225,4.51768334,520.0,-173.15021002,-5.771673667333333,{'tags': []},-173.15021002,-5.771673667333333,-2.074956548222222,[],False,[],True,2021-05-12 11:00:42.526000,NM,30,3,mp-1218930,oxide,Sr2CaCu2(BiO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",GGA,mp-1218930,"['mp-1218930', 'mp-1359698', 'mp-1817714']",0.00011165,"{'Sr': 4.0, 'Ca': 2.0, 'Cu': 4.0, 'Bi': 4.0, 'O': 16.0}",470.7976286073367,[],NM,False,37,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.743014544498498e-07,0.00011165,0,0.0002233,MP,data/source/MP/cleaned/cifs/MP-mp-1218930.cif,True,,data/final/MP/graphs/Bi2Ca1Cu2Sr2O8.234-MP-mp-1218930-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Ba1Bi1O3,1,0.0,4.0,False,Ba4Bi4O12,Ba4Bi4O12,0.0,Oxide,True,Ba20Bi20O60,Ba-Bi-O,3,Supercon,Ba1Bi1O3,MP-mp-559051,Ba4Bi4O12,Ba-Bi-O,Ba20Bi20O60,P 1 21/c 1,monoclinic,6.244045,6.28001,8.808393428799683,data/final/MP/cifs/Ba1Bi1O3-MP-mp-559051.cif,data/source/MP/raw/cifs/mp-559051.cif,mp-559051,0.0769000000000001,,2015-02-15 08:08:39,7.5826930836026865,10.17188/1270621,"@misc{osti_1270621,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BaBiO3 (SG:14) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1270621"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1709167'}},0.0,3.73830111,520.0,-119.03610928,-5.951805464,"{'tags': ['Barium bismuth(III) bismuth(V) oxide', 'Perovskite, double']}",-119.03610928,-5.951805464,-2.2334278330000004,"['xas', 'elasticity', 'bandstructure']",True,[172756],True,2021-05-12 10:56:22.739000,NM,20,8,mp-559051,oxide,BaBiO3,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Bi': 1.0, 'O': 3.0}",GGA,mp-559051,"['mp-944043', 'mp-933995', 'mp-944705', 'mp-559051', 'mp-1422516', 'mp-1709167', 'mp-1843835', 'mp-1607458']",9.0625e-05,"{'Ba': 4.0, 'Bi': 4.0, 'O': 12.0}",345.39699590112576,[],NM,False,14,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.0495169451438142e-06,9.0625e-05,0,0.0003625,MP,data/source/MP/cleaned/cifs/MP-mp-559051.cif,False,,data/final/MP/graphs/Ba1Bi1O3-MP-mp-559051.json,0,True,2/m,0,0,3,0,0,0,0,1,0,0,0,1.0,False
Cu1La1.929Na0.071O4,2,0.0202857142857142,1.0,True,Cu1La1.929Na0.071O4,Cu1La2O4,28.0,Cuprate,True,Cu14.286La27.557Na1.014O57.142857142857146,Cu-La-Na-O,4,Supercon,La1.929Na0.071Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La1.929Na0.071O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La1.929Na0.071O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Co0.5Fe0.5Zr2,1,0.0,2.0,False,Co1Fe1Zr4,Co1Fe1Zr4,1.26,Other,True,Co16.667Fe16.667Zr66.667,Co-Fe-Zr,3,Supercon,Fe0.5Co0.5Zr2,MP-mp-1215368,Zr4Fe1Co1,Co-Fe-Zr,Co16.667Fe16.667Zr66.667,I 4 2 2,tetragonal,5.27101135076883,5.27101135,5.27101135,data/final/MP/cifs/Co0.5Fe0.5Zr2-MP-mp-1215368.cif,data/source/MP/raw/cifs/mp-1215368.cif,mp-1215368,0.0,,2019-01-12 17:04:08.317000,7.116443697866999,,,{'GGA': {'task_id': 'mp-1759643'}},0.0126608070000013,4.55045197,520.0,-50.96012511,-8.493354185,{'tags': []},-50.96012511,-8.493354185,-0.1984993908333336,['bandstructure'],True,[],True,2021-05-12 10:58:39.488000,NM,6,5,mp-1215368,,Zr4FeCo,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Fe_pv', 'Co'], 'pot_type': 'paw'}","{'Zr': 4.0, 'Fe': 1.0, 'Co': 1.0}",GGA,mp-1215368,"['mp-1215368', 'mp-1372540', 'mp-1759643', 'mp-1803986', 'mp-1626922']",0.0022955,"{'Zr': 4.0, 'Fe': 1.0, 'Co': 1.0}",111.926374163003,[],NM,False,97,0,"[0.0, 0.0, 0.0, 0.0, 0.0, -0.0]",2.0509017800013504e-05,0.0022955,0,0.0022955,MP,data/source/MP/cleaned/cifs/MP-mp-1215368.cif,False,,data/final/MP/graphs/Co0.5Fe0.5Zr2-MP-mp-1215368.json,0,True,422,0,0,0,0,4,0,0,0,0,1,0,1.0,False
Pb0.992Te1Tl0.008,2,0.008,1.0,True,Pb0.992Te1Tl0.008,Pb1Te1,0.51,Other,True,Pb49.6Te50Tl0.4,Pb-Te-Tl,3,Supercon,Pb0.9922Tl0.0078Te1,MP-mp-19717,Te1Pb1,Pb-Te,Pb50Te50,F m -3 m,cubic,4.64263261,4.64263261,4.64263261,data/final/MP/cifs/Pb0.992Te1Tl0.008-MP-mp-19717-synth_doped.cif,data/source/MP/raw/cifs/mp-19717.cif,mp-19717,1.0581999999999994,,2013-09-21 09:56:54,7.856997090559908,10.17188/1194927,"@misc{osti_1194927,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TePb (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1194927"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686920'}},0.0,4.9735213,520.0,-7.66743933,-3.833719665,"{'tags': ['Altaite', 'Lead telluride (1/1)', 'High pressure experimental phase', 'Lead telluride']}",-7.66743933,-3.833719665,-0.6167456649999998,"['eos', 'xas', 'bandstructure', 'diel', 'phonons', 'elasticity']",True,"[194220, 648583, 648588, 648607, 63099, 648584, 648590, 604178, 648595, 96500, 648608, 648596, 648597, 182660, 648599, 648593, 648603, 96504, 648591, 648586, 96506, 600843, 600522, 648614, 182662, 648606, 186788, 96505, 153711, 648581, 648605, 648587, 248494, 648585, 190437, 648600, 648617, 602956, 38295, 648589, 648615, 63098, 648592, 290707, 648612, 648594, 182661, 648616, 248495, 648613]",True,2021-05-12 10:56:14.760000,NM,2,34,mp-19717,,TePb,"{'functional': 'PBE', 'labels': ['Te', 'Pb_d'], 'pot_type': 'paw'}","{'Te': 1.0, 'Pb': 1.0}",GGA,mp-19717,"['mp-658057', 'mp-655294', 'mp-656827', 'mp-19717', 'mp-1056883', 'mp-1056867', 'mp-1056875', 'mp-1059285', 'mp-1059296', 'mp-1059300', 'mp-1059866', 'mp-1059872', 'mp-1059851', 'mp-1060231', 'mp-1060244', 'mp-1060254', 'mp-1061267', 'mp-1061381', 'mp-1061396', 'mp-1061412', 'mp-1061239', 'mp-1061250', 'mp-1142129', 'mp-1440755', 'mp-1686920', 'mp-1801248', 'mp-1594316', 'mp-1595339', 'mp-1059310', 'mp-1060260', 'mp-1061273', 'mp-1061416', 'mp-1056891', 'mp-1059878']",0.0014838,"{'Te': 1.0, 'Pb': 1.0}",70.75839192630549,[],NM,False,225,0,"[0, 0]",2.096995083700277e-05,0.0014838,0,0.0014838,MP,data/source/MP/cleaned/cifs/MP-mp-19717.cif,True,,data/final/MP/graphs/Pb0.992Te1Tl0.008-MP-mp-19717-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Cl1Cu2Pb2Ru1Sr2O8,1,0.0,1.0,True,Cl1Cu2Pb2Ru1Sr2O8,Cl1Cu2Pb2Ru1Sr2O8,0.0,Cuprate,True,Cl6.25Cu12.5Pb12.5Ru6.25Sr12.5O50,Cl-Cu-Pb-Ru-Sr-O,6,Supercon,Pb2Ru1Sr2Cu2Cl1O8,MP-mp-1218869,Sr2Cu2Ru1Pb2Cl1O8,Cl-Cu-Pb-Ru-Sr-O,Cl6.25Cu12.5Pb12.5Ru6.25Sr12.5O50,A m m 2,orthorhombic,3.92728957,3.92728957,15.342374,data/final/MP/cifs/Cl1Cu2Pb2Ru1Sr2O8-MP-mp-1218869.cif,data/source/MP/raw/cifs/mp-1218869.cif,mp-1218869,0.0,,2019-01-12 19:58:02.073000,6.88577769975364,,,{'GGA': {'task_id': 'mp-1728871'}},0.0379866208398445,4.54641172,520.0,-92.13763686,-5.75860230375,{'tags': []},-92.13763686,-5.75860230375,-1.7836455073958335,[],False,[],True,2021-05-12 11:00:42.526000,FiM,16,4,mp-1218869,oxide,Sr2Cu2RuPb2ClO8,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Cu_pv', 'Ru_pv', 'Pb_d', 'Cl', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Cu': 2.0, 'Ru': 1.0, 'Pb': 2.0, 'Cl': 1.0, 'O': 8.0}",GGA,mp-1218869,"['mp-1218869', 'mp-1443747', 'mp-1728871', 'mp-1776450']",2.302303,"{'Sr': 2.0, 'Cu': 2.0, 'Ru': 1.0, 'Pb': 2.0, 'Cl': 1.0, 'O': 8.0}",236.63329870021207,[],FiM,True,6,5,"[0.0, 0.0, -0.1, -0.1, 1.6, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.3]",0.0097294126086487,2.302303,4,2.302303,MP,data/source/MP/cleaned/cifs/MP-mp-1218869.cif,False,,data/final/MP/graphs/Cl1Cu2Pb2Ru1Sr2O8-MP-mp-1218869.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Ag1Th2,1,0.0,2.0,False,Ag2Th4,Ag2Th4,2.225,Other,True,Ag33.333Th66.667,Ag-Th,2,Supercon,Ag1Th2,MP-mp-2233,Th4Ag2,Ag-Th,Ag33.333Th66.667,I 4/m c m,tetragonal,5.892804004093235,6.124525300528283,6.1245253,data/final/MP/cifs/Ag1Th2-MP-mp-2233.cif,data/source/MP/raw/cifs/mp-2233.cif,mp-2233,0.0,,2011-05-13 16:48:05,11.181200115973926,10.17188/1197564,"@misc{osti_1197564,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Th2Ag (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197564"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698455'}},0.0187523116666668,6.63171225,520.0,-35.72637366,-5.95439561,{'tags': ['Silver thorium (1/2)']},-35.72637366,-5.95439561,-0.0676381088888895,"['xas', 'elasticity', 'bandstructure']",True,"[150643, 58367, 605927, 605924]",True,2021-05-12 10:56:16.728000,NM,6,10,mp-2233,,Th2Ag,"{'functional': 'PBE', 'labels': ['Th', 'Ag'], 'pot_type': 'paw'}","{'Th': 2.0, 'Ag': 1.0}",GGA,mp-2233,"['mp-905386', 'mp-918566', 'mp-919565', 'mp-2233', 'mp-1077455', 'mp-1077473', 'mp-1421262', 'mp-1698455', 'mp-1785873', 'mp-1591901']",0.0012526,"{'Th': 4.0, 'Ag': 2.0}",169.8808495383496,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0]",1.4746806404652844e-05,0.0012526,0,0.0025052,MP,data/source/MP/cleaned/cifs/MP-mp-2233.cif,False,,data/final/MP/graphs/Ag1Th2-MP-mp-2233.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Cr0.152Ti0.848,3,0.0959999999999999,10.0,False,Cr1.52Ti8.48,Cr2Ti8,4.18,Other,True,Cr15.2Ti84.8,Cr-Ti,2,Supercon,Cr0.152Ti0.848,MP-mp-1208307,Ti8Cr2,Cr-Ti,Cr20Ti80,F d -3 m,cubic,6.31085448,6.310854479999999,6.31085448,data/final/MP/cifs/Cr0.152Ti0.848-MP-mp-1208307-synth_doped.cif,data/source/MP/raw/cifs/mp-1208307.cif,mp-1208307,0.0038999999999997,,2019-01-12 11:14:57.337000,4.549508948926443,,,,0.807792282666667,5.19907617,520.0,-74.70536194,-7.470536194,"{'tags': ['MgCu2', 'TiCr2 rt', 'Friauf-Laves phase, Frank-Kasper phase']}",-74.70536194,-7.470536194,0.7764669133333328,[],False,[],True,2021-05-12 11:00:21.818000,NM,10,2,mp-1208307,,Ti4Cr,"{'functional': 'PBE', 'labels': ['Ti_pv', 'Cr_pv'], 'pot_type': 'paw'}","{'Ti': 4.0, 'Cr': 1.0}",GGA,mp-1208307,"['mp-1208307', 'mp-1833140']",0.0002126,"{'Ti': 8.0, 'Cr': 2.0}",177.72540021489934,[],NM,False,227,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",2.3924548741252685e-06,0.0002126,0,0.0004252,MP,data/source/MP/cleaned/cifs/MP-mp-1208307.cif,True,,data/final/MP/graphs/Cr0.152Ti0.848-MP-mp-1208307-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Al4C3,1,0.0,1.0,True,Al4C3,Al4C3,0.0,Other,True,Al57.143C42.857,Al-C,2,Supercon,Al4C3,MP-mp-1591,Al4C3,Al-C,Al57.143C42.857,R -3 m,trigonal,3.354006419751118,3.3540064197511184,8.59324254,data/final/MP/cifs/Al4C3-MP-mp-1591.cif,data/source/MP/raw/cifs/mp-1591.cif,mp-1591,1.3422,,2011-05-12 19:59:41,2.930804106770353,10.17188/1191455,"@misc{osti_1191455,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Al4C3 (SG:166) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191455"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668032'}},0.0,7.30733722,520.0,-43.30721994,-6.186745705714286,"{'tags': ['Aluminium carbide', 'Aluminium carbide (4/3)']}",-43.30721994,-6.186745705714286,-0.0920820742857141,"['xas', 'bandstructure', 'diel', 'phonons', 'elasticity']",True,"[606174, 14397, 606173, 654940, 52287, 66751]",True,2021-05-12 10:56:12.755000,NM,7,9,mp-1591,,Al4C3,"{'functional': 'PBE', 'labels': ['Al', 'C'], 'pot_type': 'paw'}","{'Al': 4.0, 'C': 3.0}",GGA,mp-1591,"['mp-670107', 'mp-688462', 'mp-1591', 'mp-1142287', 'mp-1438571', 'mp-1668032', 'mp-1801075', 'mp-1588884', 'mp-688560']",0.0004236,"{'Al': 4.0, 'C': 3.0}",81.56406797660878,[],NM,False,166,0,"[0, 0, 0, 0, 0, 0, 0]",5.193463378034081e-06,0.0004236,0,0.0004236,MP,data/source/MP/cleaned/cifs/MP-mp-1591.cif,False,,data/final/MP/graphs/Al4C3-MP-mp-1591.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ru0.4W0.6,1,0.0,30.0,False,Ru12W18,Ru12W18,4.835,Other,True,Ru40W60,Ru-W,2,Supercon,Ru0.4W0.6,MP-mp-1219644,Ru12W18,Ru-W,Ru40W60,C m m 2,orthorhombic,4.981148,9.63760982,9.63760982,data/final/MP/cifs/Ru0.4W0.6-MP-mp-1219644.cif,data/source/MP/raw/cifs/mp-1219644.cif,mp-1219644,0.0,,2019-01-12 20:36:59.718000,16.22987018977951,,,,0.082514724000001,7.5020634,520.0,-343.17553574,-11.439184524666668,{'tags': []},-343.17553574,-11.439184524666668,0.0454472193333344,[],False,[],True,2021-05-12 11:00:44.908000,NM,30,2,mp-1219644,,Ru2W3,"{'functional': 'PBE', 'labels': ['Ru_pv', 'W_pv'], 'pot_type': 'paw'}","{'Ru': 2.0, 'W': 3.0}",GGA,mp-1219644,"['mp-1219644', 'mp-1816430']",0.0001180666666666,"{'Ru': 12.0, 'W': 18.0}",462.6587366257022,[],NM,False,35,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.531150163004716e-06,0.0001180666666666,0,0.0007084,MP,data/source/MP/cleaned/cifs/MP-mp-1219644.cif,False,,data/final/MP/graphs/Ru0.4W0.6-MP-mp-1219644.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Ba0.15Cu1La1.85O4,2,0.0428571428571428,1.0,True,Ba0.15Cu1La1.85O4,Cu1La2O4,28.0,Cuprate,True,Ba2.143Cu14.286La26.429O57.142857142857146,Ba-Cu-La-O,4,Supercon,Ba0.15La1.85Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ba0.15Cu1La1.85O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ba0.15Cu1La1.85O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Nb0.85Rh1.15,3,0.1499999999999999,1.0,True,Nb0.85Rh1.15,Nb1Rh1,3.0,Other,True,Nb42.5Rh57.5,Nb-Rh,2,Supercon,Nb0.85Rh1.15,MP-mp-1963,Nb1Rh1,Nb-Rh,Nb50Rh50,P 4/m m m,tetragonal,2.879837,2.879837,3.877267,data/final/MP/cifs/Nb0.85Rh1.15-MP-mp-1963-synth_doped.cif,data/source/MP/raw/cifs/mp-1963.cif,mp-1963,0.0,,2011-05-13 04:08:05,10.111756697385587,10.17188/1194846,"@misc{osti_1194846,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbRh (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1194846"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687603'}},0.0,6.00208314,520.0,-18.26823899,-9.134119495,{'tags': ['Niobium rhodium (1/1)']},-18.26823899,-9.134119495,-0.4013130399999998,"['xas', 'elasticity', 'bandstructure']",True,"[645280, 105213]",True,2021-05-12 10:56:14.760000,NM,2,8,mp-1963,,NbRh,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Rh_pv'], 'pot_type': 'paw'}","{'Nb': 1.0, 'Rh': 1.0}",GGA,mp-1963,"['mp-929427', 'mp-912669', 'mp-929028', 'mp-1963', 'mp-1439069', 'mp-1687603', 'mp-1790574', 'mp-1591985']",0.0050183,"{'Nb': 1.0, 'Rh': 1.0}",32.15596321937415,[],NM,False,123,0,"[0, 0]",0.0001560612557541,0.0050183,0,0.0050183,MP,data/source/MP/cleaned/cifs/MP-mp-1963.cif,True,,data/final/MP/graphs/Nb0.85Rh1.15-MP-mp-1963-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Br1.75C2I0.25Y2,3,0.0833333333333333,1.0,True,Br1.75C2I0.25Y2,Br2C2Y2,5.5,Other,True,Br29.167C33.333I4.167Y33.333,Br-C-I-Y,4,Supercon,Y2I0.25Br1.75C2,MP-mp-643367,Y2C2Br2,Br-C-Y,Br33.333C33.333Y33.333,C 1 2/m 1,monoclinic,3.846773999724948,4.02928774,10.04420137,data/final/MP/cifs/Br1.75C2I0.25Y2-MP-mp-643367-synth_doped.cif,data/source/MP/raw/cifs/mp-643367.cif,mp-643367,0.0,,2013-06-28 23:28:36,4.453038714645779,10.17188/1280298,"@misc{osti_1280298,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YCBr (SG:12) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1280298"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698781'}},0.0,3.4577348,520.0,-41.14365364,-6.857275606666666,{'tags': ['Yttrium bromide carbide (2/2/2)']},-41.14365364,-6.857275606666666,-1.2585473713888884,"['xas', 'elasticity', 'bandstructure']",True,[78871],True,2021-05-12 10:56:27.046000,NM,6,11,mp-643367,,YCBr,"{'functional': 'PBE', 'labels': ['Y_sv', 'C', 'Br'], 'pot_type': 'paw'}","{'Y': 1.0, 'C': 1.0, 'Br': 1.0}",GGA,mp-643367,"['mp-643367', 'mp-1002327', 'mp-1003939', 'mp-1048935', 'mp-1048950', 'mp-1423619', 'mp-1698781', 'mp-1779867', 'mp-1009265', 'mp-1593059', 'mp-1048942']",0.0169429,"{'Y': 2.0, 'C': 2.0, 'Br': 2.0}",134.8560417099284,[],NM,False,12,0,"[0, 0, 0, 0, 0, 0]",0.000251273873757,0.0169429,0,0.0338858,MP,data/source/MP/cleaned/cifs/MP-mp-643367.cif,True,,data/final/MP/graphs/Br1.75C2I0.25Y2-MP-mp-643367-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
Sr4V3O9.49,3,0.0851425106124925,0.25,False,Sr1V0.75O2.3725,Sr1V1O3,0.0,Oxide,True,Sr24.257V18.193O57.5500303214069,Sr-V-O,3,Supercon,Sr4V3O9.49,MP-mp-18717,Sr1V1O3,Sr-V-O,Sr20V20O60,P m -3 m,cubic,3.900891,3.900891,3.900891,data/final/MP/cifs/Sr4V3O9.49-MP-mp-18717-synth_doped.cif,data/source/MP/raw/cifs/mp-18717.cif,mp-18717,0.0,,2014-02-15 00:19:39,5.21885807260035,10.17188/1193364,"@misc{osti_1193364,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SrVO3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1193364"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",,0.0391016768603389,4.67096136,520.0,-36.25355595,-7.25071119,{'tags': ['Strontium vanadate(IV)']},-36.25355595,-7.25071119,-2.8794546823333342,"['xas', 'elasticity']",False,"[108826, 96291, 88982]",True,2021-05-12 10:56:14.760000,FM,5,2,mp-18717,oxide,SrVO3,"{'functional': 'PBE', 'labels': ['Sr_sv', 'V_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 1.0, 'V': 1.0, 'O': 3.0}",GGA+U,mp-18717,"['mp-18717', 'mp-1794484']",0.999467,"{'Sr': 1.0, 'V': 1.0, 'O': 3.0}",59.35966561911505,[],FM,True,221,1,"[0.0, 1.1, 0.0, 0.0, 0.0]",0.0168374769226825,0.999467,1,0.999467,MP,data/source/MP/cleaned/cifs/MP-mp-18717.cif,True,,data/final/MP/graphs/Sr4V3O9.49-MP-mp-18717-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
La2Rh3Sn5,1,0.0,2.0,False,La4Rh6Sn10,La4Rh6Sn10,1.85,Other,True,La20Rh30Sn50,La-Rh-Sn,3,Supercon,La2Rh3Sn5,MP-mp-30755,La4Sn10Rh6,La-Rh-Sn,La20Rh30Sn50,I b a m,orthorhombic,6.473635999833777,9.12301869,9.12301869008961,data/final/MP/cifs/La2Rh3Sn5-MP-mp-30755.cif,data/source/MP/raw/cifs/mp-30755.cif,mp-30755,0.0,,2014-02-21 03:49:34,8.449289994283216,10.17188/1205115,"@misc{osti_1205115,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La2Sn5Rh3 (SG:72) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1205115"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672795'}},0.0,8.51482394,520.0,-118.69176608,-5.934588304,{'tags': ['Lanthanum rhodium tin (2/3/5)']},-118.69176608,-5.934588304,-0.7333085945000001,"['xas', 'bandstructure']",True,[104709],True,2021-05-12 10:57:04.957000,NM,20,8,mp-30755,,La2Sn5Rh3,"{'functional': 'PBE', 'labels': ['La', 'Sn_d', 'Rh_pv'], 'pot_type': 'paw'}","{'La': 2.0, 'Sn': 5.0, 'Rh': 3.0}",GGA,mp-30755,"['mp-941824', 'mp-942655', 'mp-935099', 'mp-30755', 'mp-1414930', 'mp-1672795', 'mp-1820473', 'mp-1584364']",0.10822895,"{'La': 4.0, 'Sn': 10.0, 'Rh': 6.0}",463.8412676234707,[],NM,False,72,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0004666637384574,0.10822895,0,0.2164579,MP,data/source/MP/cleaned/cifs/MP-mp-30755.cif,False,,data/final/MP/graphs/La2Rh3Sn5-MP-mp-30755.json,0,True,mmm,0,0,0,7,0,0,0,0,0,1,0,1.0,False
Tb1,1,0.0,3.0,False,Tb3,Tb3,0.0,Other,True,Tb100,Tb,1,Supercon,Tb1,MP-mp-11698,Tb3,Tb,Tb100,R -3 m,trigonal,3.583082741244902,3.583082741244902,8.89897106,data/final/MP/cifs/Tb1-MP-mp-11698.cif,data/source/MP/raw/cifs/mp-11698.cif,mp-11698,0.0,,2011-05-27 19:55:58,8.227028549557538,10.17188/1188290,"@misc{osti_1188290,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Tb (SG:166) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188290"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1674374'}},0.0,3.26853617,520.0,-13.9030983,-4.6343661,"{'tags': ['Terbium - HP', 'Terbium', 'High pressure experimental phase']}",-13.9030983,-4.6343661,0.0,"['surfaces', 'eos', 'bandstructure', 'xas', 'elasticity']",True,"[652944, 652942, 52497]",True,2021-05-12 10:56:12.755000,NM,3,13,mp-11698,,Tb,"{'functional': 'PBE', 'labels': ['Tb_3'], 'pot_type': 'paw'}",{'Tb': 1.0},GGA,mp-11698,"['mp-11698', 'mp-1061921', 'mp-1061952', 'mp-1061996', 'mp-1062640', 'mp-1062733', 'mp-1062669', 'mp-1439865', 'mp-1674374', 'mp-1796997', 'mp-1591673', 'mp-1061980', 'mp-1062715']",0.0051832666666666,{'Tb': 3.0},96.23222434141351,[],NM,False,166,0,"[-0.0, 0.0, 0.0]",0.000161586205727,0.0051832666666666,0,0.0155498,MP,data/source/MP/cleaned/cifs/MP-mp-11698.cif,False,,data/final/MP/graphs/Tb1-MP-mp-11698.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Al0.2B5Mo1.8,3,0.0571428571428571,1.0,True,Al0.2B5Mo1.8,B5Mo2,5.7,Other,True,Al2.857B71.429Mo25.714,Al-B-Mo,3,Supercon,Al0.2B5Mo1.8,MP-mp-7229,B5Mo2,B-Mo,B71.429Mo28.571,R -3 m,trigonal,3.086062143206312,3.086062143206312,7.38317517,data/final/MP/cifs/Al0.2B5Mo1.8-MP-mp-7229-synth_doped.cif,data/source/MP/raw/cifs/mp-7229.cif,mp-7229,0.0,,2011-05-27 17:15:57,6.910597742884047,10.17188/1287525,"@misc{osti_1287525,
    author = ""Persson, Kristin"",
    title = ""Materials Data on B5Mo2 (SG:166) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1287525"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678538'}},0.4354736101190504,10.26159619,520.0,-54.63026953,-7.804324218571429,"{'tags': ['Molybdenum boride (2/5)', 'Molybdenum boride (1/2.5) - epsilon']}",-54.63026953,-7.804324218571429,0.0654250548809522,['bandstructure'],True,"[157530, 614795, 614810, 24282]",True,2021-05-12 10:58:55.498000,NM,7,11,mp-7229,,B5Mo2,"{'functional': 'PBE', 'labels': ['B', 'Mo_pv'], 'pot_type': 'paw'}","{'B': 5.0, 'Mo': 2.0}",GGA,mp-7229,"['mp-1001204', 'mp-7229', 'mp-1007569', 'mp-1077992', 'mp-1078025', 'mp-1078031', 'mp-1441558', 'mp-1678538', 'mp-1793658', 'mp-1012321', 'mp-1593525']",0.0189101,"{'B': 5.0, 'Mo': 2.0}",59.09541989544843,[],NM,False,166,0,"[0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0]",0.0003199926497426,0.0189101,0,0.0189101,MP,data/source/MP/cleaned/cifs/MP-mp-7229.cif,True,,data/final/MP/graphs/Al0.2B5Mo1.8-MP-mp-7229-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Te4Ti5,1,0.0,1.0,True,Te4Ti5,Te4Ti5,0.0,Other,True,Te44.444Ti55.556,Te-Ti,2,Supercon,Te4Ti5,MP-mp-7498,Ti5Te4,Te-Ti,Te44.444Ti55.556,I 4/m,tetragonal,3.732481998926301,7.464292399147634,7.464292400000001,data/final/MP/cifs/Te4Ti5-MP-mp-7498.cif,data/source/MP/raw/cifs/mp-7498.cif,mp-7498,0.0,,2011-05-29 05:51:35,6.38580727321029,10.17188/1288498,"@misc{osti_1288498,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ti5Te4 (SG:87) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1288498"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704543'}},0.0,7.56737306,520.0,-58.23958228,-6.471064697777778,{'tags': ['Titanium telluride (5/4)']},-58.23958228,-6.471064697777778,-0.8752131640740741,"['bandstructure', 'elasticity']",True,"[657485, 653086, 15451]",True,2021-05-12 10:56:29.056000,NM,9,10,mp-7498,,Ti5Te4,"{'functional': 'PBE', 'labels': ['Ti_pv', 'Te'], 'pot_type': 'paw'}","{'Ti': 5.0, 'Te': 4.0}",GGA,mp-7498,"['mp-908793', 'mp-923774', 'mp-924355', 'mp-7498', 'mp-1078731', 'mp-1079817', 'mp-1418088', 'mp-1704543', 'mp-1833663', 'mp-1594103']",0.0007376,"{'Ti': 5.0, 'Te': 4.0}",194.9580066909033,[],NM,False,87,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0]",3.783378854346976e-06,0.0007376,0,0.0007376,MP,data/source/MP/cleaned/cifs/MP-mp-7498.cif,False,,data/final/MP/graphs/Te4Ti5-MP-mp-7498.json,0,True,4/m,0,0,0,0,3,0,0,0,0,1,0,1.0,False
Rh4Sc5Si10,3,0.0789473684210526,0.8000000000000002,True,Rh3.2Sc4Si8,Rh4Sc4Si8,8.405,Other,True,Rh21.053Sc26.316Si52.632,Rh-Sc-Si,3,Supercon,Sc5Rh4Si10,MP-mp-22307,Sc4Si8Rh4,Rh-Sc-Si,Rh25Sc25Si50,P n m a,orthorhombic,4.043635,6.346391,9.581783,data/final/MP/cifs/Rh4Sc5Si10-MP-mp-22307-synth_doped.cif,data/source/MP/raw/cifs/mp-22307.cif,mp-22307,0.0,,2014-02-22 15:24:24,5.511415445840606,10.17188/1197541,"@misc{osti_1197541,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ScSi2Rh (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197541"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1705612'}},0.0,8.03492764,520.0,-112.83613488,-7.05225843,{'tags': ['Rhodium scandium silicide (1/1/2)']},-112.83613488,-7.05225843,-0.9154071762499996,"['xas', 'elasticity', 'bandstructure']",True,[15248],True,2021-05-12 10:56:16.728000,NM,16,10,mp-22307,,ScSi2Rh,"{'functional': 'PBE', 'labels': ['Sc_sv', 'Si', 'Rh_pv'], 'pot_type': 'paw'}","{'Sc': 1.0, 'Si': 2.0, 'Rh': 1.0}",GGA,mp-22307,"['mp-923688', 'mp-922924', 'mp-908650', 'mp-22307', 'mp-1125052', 'mp-1133337', 'mp-1434549', 'mp-1705612', 'mp-1775256', 'mp-1599460']",1.8475e-05,"{'Sc': 4.0, 'Si': 8.0, 'Rh': 4.0}",245.89239864638947,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.005379605340033e-07,1.8475e-05,0,7.39e-05,MP,data/source/MP/cleaned/cifs/MP-mp-22307.cif,True,,data/final/MP/graphs/Rh4Sc5Si10-MP-mp-22307-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
B6Nd1,1,0.0,1.0,True,B6Nd1,B6Nd1,3.0,Other,True,B85.714Nd14.286,B-Nd,2,Supercon,B6Nd1,MP-mp-1929,Nd1B6,B-Nd,B85.714Nd14.286,P m -3 m,cubic,4.135696,4.135696,4.135696,data/final/MP/cifs/B6Nd1-MP-mp-1929.cif,data/source/MP/raw/cifs/mp-1929.cif,mp-1929,0.0,,2011-05-12 20:09:33,4.908783997892283,10.17188/1194178,"@misc{osti_1194178,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NdB6 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1194178"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668320'}},0.0,6.62552026,520.0,-48.17173791,-6.881676844285714,"{'tags': ['Neodymium boride (1/6)', 'Neodymium octahedro-hexaboride']}",-48.17173791,-6.881676844285714,-0.4753205821428565,"['xas', 'elasticity', 'bandstructure']",True,"[602771, 614939, 614929, 659495, 614931, 614933, 108069, 150585, 614937]",True,2021-05-12 10:56:14.760000,NM,7,8,mp-1929,,NdB6,"{'functional': 'PBE', 'labels': ['Nd_3', 'B'], 'pot_type': 'paw'}","{'Nd': 1.0, 'B': 6.0}",GGA,mp-1929,"['mp-1001341', 'mp-1000428', 'mp-1929', 'mp-1440239', 'mp-1668320', 'mp-1799561', 'mp-1007706', 'mp-1596615']",0.0004359,"{'Nd': 1.0, 'B': 6.0}",70.73686747831765,[],NM,False,221,0,"[0, 0, 0, 0, 0, 0, 0]",6.162274575328242e-06,0.0004359,0,0.0004359,MP,data/source/MP/cleaned/cifs/MP-mp-1929.cif,False,,data/final/MP/graphs/B6Nd1-MP-mp-1929.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Cu1Tl2O6.23,2,0.0186189589573383,1.926040930979133,False,Ba3.852Cu1.926Tl3.852O12,Ba4Cu2Tl4O12,0.0,Cuprate,True,Ba17.809Cu8.905Tl17.809O55.47640249332146,Ba-Cu-Tl-O,4,Supercon,Tl2Ba2Cu1O6.23,MP-mp-6027,Ba4Tl4Cu2O12,Ba-Cu-Tl-O,Ba18.182Cu9.091Tl18.182O54.54545454545455,C m c a,orthorhombic,5.504110002693673,5.585743,12.28312762,data/final/MP/cifs/Ba2Cu1Tl2O6.23-MP-mp-6027-synth_doped.cif,data/source/MP/raw/cifs/mp-6027.cif,mp-6027,0.0,,2011-05-19 00:05:23,7.606665315628389,10.17188/1277350,"@misc{osti_1277350,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Tl2CuO6 (SG:64) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277350"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1673478'}},0.0059215576010052,4.10961464,520.0,-115.75418737,-5.261553971363636,"{'tags': ['Dithallium dibarium cuprate', 'Dithallium(III) dibarium copper oxide']}",-115.75418737,-5.261553971363636,-1.7862630028787878,"['xas', 'bandstructure']",True,"[202723, 202724, 202722]",True,2021-05-12 10:57:28.836000,NM,22,8,mp-6027,oxide,Ba2Tl2CuO6,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Tl_d', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Tl': 2.0, 'Cu': 1.0, 'O': 6.0}",GGA,mp-6027,"['mp-925246', 'mp-909581', 'mp-924678', 'mp-6027', 'mp-1504634', 'mp-1673478', 'mp-1837163', 'mp-1605186']",2.9e-05,"{'Ba': 4.0, 'Tl': 4.0, 'Cu': 2.0, 'O': 12.0}",368.0385386017736,[],NM,False,64,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.5759219189476614e-07,2.9e-05,0,5.8e-05,MP,data/source/MP/cleaned/cifs/MP-mp-6027.cif,True,,data/final/MP/graphs/Ba2Cu1Tl2O6.23-MP-mp-6027-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Bi1La0.8S2Sr0.2O1,3,0.0799999999999999,2.0,False,Bi2La1.6S4Sr0.4O2,Bi2La2S4O2,0.0,Oxide,True,Bi20La16S40Sr4O20,Bi-La-S-Sr-O,5,Supercon,La0.8Sr0.2Bi1S2O1,MP-mp-1078397,La2Bi2S4O2,Bi-La-S-O,Bi20La20S40O20,P 4/n m m,tetragonal,4.055497,4.055497,14.173265,data/final/MP/cifs/Bi1La0.8S2Sr0.2O1-MP-mp-1078397-synth_doped.cif,data/source/MP/raw/cifs/mp-1078397.cif,mp-1078397,1.0743999999999998,,2018-04-11 10:57:38,6.097899749460756,,,{'GGA': {'task_id': 'mp-1676377'}},0.0053330699999989,4.69184382,520.0,-61.66700475,-6.166700475,{'tags': ['Lanthanum bismuth oxodisulphate']},-61.66700475,-6.166700475,-2.09592004425,['bandstructure'],True,[196231],True,2021-05-12 10:58:14.654000,NM,10,5,mp-1078397,oxide,LaBiS2O,"{'functional': 'PBE', 'labels': ['La', 'Bi', 'S', 'O'], 'pot_type': 'paw'}","{'La': 1.0, 'Bi': 1.0, 'S': 2.0, 'O': 1.0}",GGA,mp-1078397,"['mp-1078397', 'mp-1380859', 'mp-1676377', 'mp-1776923', 'mp-1600973']",6.57e-05,"{'La': 2.0, 'Bi': 2.0, 'S': 4.0, 'O': 2.0}",233.1084819815865,[],NM,False,129,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.636860524465146e-07,6.57e-05,0,0.0001314,MP,data/source/MP/cleaned/cifs/MP-mp-1078397.cif,True,,data/final/MP/graphs/Bi1La0.8S2Sr0.2O1-MP-mp-1078397-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Bi0.3Zr0.7,3,0.1,8.0,False,Bi2.4Zr5.6,Bi2Zr6,1.51,Other,True,Bi30Zr70,Bi-Zr,2,Supercon,Bi0.3Zr0.7,MP-mp-1188051,Zr6Bi2,Bi-Zr,Bi25Zr75,P 63/m m c,hexagonal,5.313165,6.3650920035366205,6.36509255,data/final/MP/cifs/Bi0.3Zr0.7-MP-mp-1188051-synth_doped.cif,data/source/MP/raw/cifs/mp-1188051.cif,mp-1188051,0.0,,2019-01-11 15:33:09.060000,8.598450752744528,,,{'GGA': {'task_id': 'mp-1754423'}},0.0584372956249996,5.90865358,520.0,-60.55913083,-7.56989135375,{'tags': []},-60.55913083,-7.56989135375,-0.1866073037500006,[],False,[],True,2021-05-12 10:59:52.436000,NM,8,4,mp-1188051,,Zr3Bi,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Bi'], 'pot_type': 'paw'}","{'Zr': 3.0, 'Bi': 1.0}",GGA,mp-1188051,"['mp-1188051', 'mp-1411336', 'mp-1754423', 'mp-1789703']",0.17186745,"{'Zr': 6.0, 'Bi': 2.0}",186.4203654437241,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0018438698968421,0.17186745,0,0.3437349,MP,data/source/MP/cleaned/cifs/MP-mp-1188051.cif,True,,data/final/MP/graphs/Bi0.3Zr0.7-MP-mp-1188051-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Al20Pr1V2,1,0.0,2.0,False,Al40Pr2V4,Al40Pr2V4,0.029666667,Heavy_fermion,True,Al86.957Pr4.348V8.696,Al-Pr-V,3,Supercon,Pr1V2Al20,MP-mp-1204963,Pr2Al40V4,Al-Pr-V,Al86.957Pr4.348V8.696,F d -3 m,cubic,10.28826224,10.288262239999998,10.288262239999998,data/final/MP/cifs/Al20Pr1V2-MP-mp-1204963.cif,data/source/MP/raw/cifs/mp-1204963.cif,mp-1204963,0.0,,2019-01-12 08:33:07.603000,3.3744946675967395,,,{'GGA': {'task_id': 'mp-1684612'}},0.0,7.78474301,520.0,-204.78122195,-4.451765694565218,{'tags': ['Praseodymium vanadium aluminide (1/2/20)']},-204.78122195,-4.451765694565218,-0.196973177826087,[],False,[236263],True,2021-05-12 11:00:14.977000,NM,46,4,mp-1204963,,Pr(Al10V)2,"{'functional': 'PBE', 'labels': ['Pr_3', 'Al', 'V_pv'], 'pot_type': 'paw'}","{'Pr': 1.0, 'Al': 20.0, 'V': 2.0}",GGA,mp-1204963,"['mp-1204963', 'mp-1344942', 'mp-1684612', 'mp-1887847']",0.23025715,"{'Pr': 2.0, 'Al': 40.0, 'V': 4.0}",770.036088811498,[],NM,False,227,0,"[-0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0, -0.0, -0.0]",0.0005980424900744,0.23025715,0,0.4605143,MP,data/source/MP/cleaned/cifs/MP-mp-1204963.cif,False,,data/final/MP/graphs/Al20Pr1V2-MP-mp-1204963.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Sn0.98Te1,2,0.0101010101010101,1.0,True,Sn0.98Te1,Sn1Te1,0.092,Other,True,Sn49.495Te50.505,Sn-Te,2,Supercon,Sn0.98Te1,MP-mp-1883,Sn1Te1,Sn-Te,Sn50Te50,F m -3 m,cubic,4.53766968,4.53766968,4.53766968,data/final/MP/cifs/Sn0.98Te1-MP-mp-1883-synth_doped.cif,data/source/MP/raw/cifs/mp-1883.cif,mp-1883,0.6623999999999999,,2011-05-12 18:43:07,6.19081042904143,10.17188/1193534,"@misc{osti_1193534,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SnTe (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1193534"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686906'}},0.0,6.06645058,520.0,-7.72519638,-3.86259819,"{'tags': ['Tin telluride (1/1)', 'Tin telluride']}",-7.72519638,-3.86259819,-0.4971617975000004,"['eos', 'elasticity', 'bandstructure', 'xas']",True,"[52489, 652760, 652744, 652756, 652761, 600865, 652763, 652745, 652742, 604177, 600813, 652741, 601065, 652750, 652755, 652753, 652751, 652749, 652752, 600136, 652754, 652746, 652759]",True,2021-05-12 10:56:14.760000,NM,2,9,mp-1883,,SnTe,"{'functional': 'PBE', 'labels': ['Sn_d', 'Te'], 'pot_type': 'paw'}","{'Sn': 1.0, 'Te': 1.0}",GGA,mp-1883,"['mp-663289', 'mp-655511', 'mp-657302', 'mp-1883', 'mp-1440781', 'mp-1686906', 'mp-1784332', 'mp-1596407', 'mp-1596974']",0.0,"{'Sn': 1.0, 'Te': 1.0}",66.06685541129963,[],NM,False,225,0,"[0, 0]",0.0,0.0,0,0.0,MP,data/source/MP/cleaned/cifs/MP-mp-1883.cif,True,,data/final/MP/graphs/Sn0.98Te1-MP-mp-1883-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
B2Ta3,1,0.0,2.0,False,B4Ta6,B4Ta6,0.0,Other,True,B40Ta60,B-Ta,2,Supercon,B2Ta3,MP-mp-13415,Ta6B4,B-Ta,B40Ta60,P 4/m b m,tetragonal,3.301425,6.214345,6.214345,data/final/MP/cifs/B2Ta3-MP-mp-13415.cif,data/source/MP/raw/cifs/mp-13415.cif,mp-13415,0.0,,2011-05-29 09:51:47,14.70362601339527,10.17188/1189574,"@misc{osti_1189574,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ta3B2 (SG:127) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189574"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700384'}},0.0,6.54255549,520.0,-104.58887113,-10.458887113,{'tags': ['Tantalum boride (3/2)']},-104.58887113,-10.458887113,-0.6724638266666674,"['xas', 'bandstructure']",True,"[615504, 107320, 615517]",True,2021-05-12 10:56:53.126000,NM,10,8,mp-13415,,Ta3B2,"{'functional': 'PBE', 'labels': ['Ta_pv', 'B'], 'pot_type': 'paw'}","{'Ta': 3.0, 'B': 2.0}",GGA,mp-13415,"['mp-920406', 'mp-921424', 'mp-906787', 'mp-13415', 'mp-1420211', 'mp-1700384', 'mp-1802628', 'mp-1593305']",0.0005042,"{'Ta': 6.0, 'B': 4.0}",127.4947072401676,[],NM,False,127,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",7.90934793944372e-06,0.0005042,0,0.0010084,MP,data/source/MP/cleaned/cifs/MP-mp-13415.cif,False,,data/final/MP/graphs/B2Ta3-MP-mp-13415.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Re3Si5Y2,1,0.0,4.0,False,Re12Si20Y8,Re12Si20Y8,1.76,Other,True,Re30Si50Y20,Re-Si-Y,3,Supercon,Y2Re3Si5,MP-mp-1195855,Y8Re12Si20,Re-Si-Y,Re30Si50Y20,P 4/m n c,tetragonal,5.569181,10.986211,10.986211,data/final/MP/cifs/Re3Si5Y2-MP-mp-1195855.cif,data/source/MP/raw/cifs/mp-1195855.cif,mp-1195855,0.0,,2019-01-12 01:08:29.050000,8.664674303441146,,,{'GGA': {'task_id': 'mp-1683176'}},0.0,7.42852393,520.0,-333.32310734,-8.333077683499999,"{'tags': ['Yttrium rhenium silicide (2/3/5)', 'Y2Re3Si5', 'U2Mn3Si5']}",-333.32310734,-8.333077683499999,-0.5582682953333318,[],False,[650136],True,2021-05-12 10:59:59.077000,NM,40,4,mp-1195855,,Y2Re3Si5,"{'functional': 'PBE', 'labels': ['Y_sv', 'Re_pv', 'Si'], 'pot_type': 'paw'}","{'Y': 2.0, 'Re': 3.0, 'Si': 5.0}",GGA,mp-1195855,"['mp-1195855', 'mp-1365334', 'mp-1683176', 'mp-1873707']",0.0008915,"{'Y': 8.0, 'Re': 12.0, 'Si': 20.0}",672.1825042949023,[],NM,False,128,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.305106838120726e-06,0.0008915,0,0.003566,MP,data/source/MP/cleaned/cifs/MP-mp-1195855.cif,False,,data/final/MP/graphs/Re3Si5Y2-MP-mp-1195855.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ge10Ir4Lu5,1,0.0,2.0,False,Ge20Ir8Lu10,Ge20Ir8Lu10,2.55,Other,True,Ge52.632Ir21.053Lu26.316,Ge-Ir-Lu,3,Supercon,Lu5Ir4Ge10,MP-mp-1196530,Lu10Ge20Ir8,Ge-Ir-Lu,Ge52.632Ir21.053Lu26.316,P 4/m b m,tetragonal,4.294708,12.978069,12.978069,data/final/MP/cifs/Ge10Ir4Lu5-MP-mp-1196530.cif,data/source/MP/raw/cifs/mp-1196530.cif,mp-1196530,0.0,,2019-01-12 01:41:00.606000,10.88159390570656,,,,0.0,5.03778318,520.0,-236.22076595,-6.216335946052631,"{'tags': ['Lu5Ir4Ge10', 'Lutetium iridium germanide (5/4/10)', 'Sc5Co4Si10']}",-236.22076595,-6.216335946052631,-0.7327173760526313,[],False,[636714],True,2021-05-12 11:00:01.375000,NM,38,2,mp-1196530,,Lu5(Ge5Ir2)2,"{'functional': 'PBE', 'labels': ['Lu_3', 'Ge_d', 'Ir'], 'pot_type': 'paw'}","{'Lu': 5.0, 'Ge': 10.0, 'Ir': 4.0}",GGA,mp-1196530,"['mp-1196530', 'mp-1369759']",0.0024767,"{'Lu': 10.0, 'Ge': 20.0, 'Ir': 8.0}",723.3588493505375,[],NM,False,127,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.847776873743059e-06,0.0024767,0,0.0049534,MP,data/source/MP/cleaned/cifs/MP-mp-1196530.cif,False,,data/final/MP/graphs/Ge10Ir4Lu5-MP-mp-1196530.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Au0.146B2Mg0.854,3,0.0973333333333333,1.0,True,Au0.146B2Mg0.854,B2Mg1,25.6,Other,True,Au4.867B66.667Mg28.467,Au-B-Mg,3,Supercon,Mg0.854Au0.146B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/Au0.146B2Mg0.854-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/Au0.146B2Mg0.854-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Cu1F2Sr2O2,1,0.0,1.0,True,Cu1F2Sr2O2,Cu1F2Sr2O2,44.33333333,Cuprate,True,Cu14.286F28.571Sr28.571O28.571428571428573,Cu-F-Sr-O,4,Supercon,Sr2Cu1F2O2,MP-mp-1025280,Sr2Cu1O2F2,Cu-F-Sr-O,Cu14.286F28.571Sr28.571O28.571428571428573,I 4/m m m,tetragonal,4.005971999505202,4.005971999505202,7.0713802,data/final/MP/cifs/Cu1F2Sr2O2-MP-mp-1025280.cif,data/source/MP/raw/cifs/mp-1025280.cif,mp-1025280,0.0,,2016-10-02 06:58:47,4.931293309587092,10.17188/1355558,"@article{osti_1355558,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr2Cu(OF)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1355558"",
    place = ""United States"",
    year = ""2017"",
    month = ""5""
}
",{'GGA': {'task_id': 'mp-1761325'}},0.0271226678571521,2.51271532,520.0,-39.71814041,-5.674020058571428,"{'tags': ['Sr2CuO2F2', '*']}",-39.71814041,-5.674020058571428,-2.9741524126190475,"['bandstructure', 'elasticity']",True,[],True,2021-05-12 10:56:10.715000,NM,7,5,mp-1025280,oxide,Sr2Cu(OF)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Cu_pv', 'O', 'F'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Cu': 1.0, 'O': 2.0, 'F': 2.0}",GGA,mp-1025280,"['mp-1025280', 'mp-1386311', 'mp-1761325', 'mp-1795757', 'mp-1624883']",0.0007221,"{'Sr': 2.0, 'Cu': 1.0, 'O': 2.0, 'F': 2.0}",103.97757510750009,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",6.9447666889080365e-06,0.0007221,0,0.0007221,MP,data/source/MP/cleaned/cifs/MP-mp-1025280.cif,False,,data/final/MP/graphs/Cu1F2Sr2O2-MP-mp-1025280.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B2C1Lu0.1Ni2Y0.9,2,0.0333333333333333,1.0,True,B2C1Lu0.1Ni2Y0.9,B2C1Ni2Y1,15.56,Other,True,B33.333C16.667Lu1.667Ni33.333Y15,B-C-Lu-Ni-Y,5,Supercon,Y0.9Lu0.1Ni2B2C1,MP-mp-6576,Y1Ni2B2C1,B-C-Ni-Y,B33.333C16.667Ni33.333Y16.667,I 4/m m m,tetragonal,3.548790000501972,3.548790000501972,5.76144136,data/final/MP/cifs/B2C1Lu0.1Ni2Y0.9-MP-mp-6576-synth_doped.cif,data/source/MP/raw/cifs/mp-6576.cif,mp-6576,0.0,,2011-05-13 05:21:43,6.099730998852292,10.17188/1281366,"@misc{osti_1281366,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281366"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688230'}},0.0,6.81083016,520.0,-43.677878,-7.279646333333333,{'tags': []},-43.677878,-7.279646333333333,-0.5109282141666659,"['xas', 'bandstructure']",True,"[75816, 89142, 83231, 79574, 41549]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6576,,YNi2B2C,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6576,"['mp-6576', 'mp-1007054', 'mp-1000583', 'mp-1439516', 'mp-1688230', 'mp-1794280', 'mp-1011792', 'mp-1597064']",0.0006603,"{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.3152437079014,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",1.010943177297096e-05,0.0006603,0,0.0006603,MP,data/source/MP/cleaned/cifs/MP-mp-6576.cif,True,,data/final/MP/graphs/B2C1Lu0.1Ni2Y0.9-MP-mp-6576-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B1Ba1Cu1Sm1O5,1,0.0,2.0,False,B2Ba2Cu2Sm2O10,B2Ba2Cu2Sm2O10,0.0,Cuprate,True,B11.111Ba11.111Cu11.111Sm11.111O55.55555555555556,B-Ba-Cu-Sm-O,5,Supercon,Sm1Ba1Cu1B1O5,MP-mp-1214336,Ba2Sm2Cu2B2O10,B-Ba-Cu-Sm-O,B11.111Ba11.111Cu11.111Sm11.111O55.55555555555556,P 4 b m,tetragonal,5.527259,5.527259,7.589667,data/final/MP/cifs/B1Ba1Cu1Sm1O5-MP-mp-1214336.cif,data/source/MP/raw/cifs/mp-1214336.cif,mp-1214336,0.0,,2019-01-12 16:11:52.695000,6.331393315203895,,,,0.0016954971666747,3.51767748,520.0,-128.81337717,-7.156298731666666,{'tags': []},-128.81337717,-7.156298731666666,-2.853969794907408,[],False,[],True,2021-05-12 11:00:35.508000,NM,18,3,mp-1214336,oxide,BaSmCuBO5,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Sm_3', 'Cu_pv', 'B', 'O'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Sm': 1.0, 'Cu': 1.0, 'B': 1.0, 'O': 5.0}",GGA,mp-1214336,"['mp-1214336', 'mp-1339655', 'mp-1922458']",0.00056285,"{'Ba': 2.0, 'Sm': 2.0, 'Cu': 2.0, 'B': 2.0, 'O': 10.0}",231.8688203357312,[],NM,False,100,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.854900276673936e-06,0.00056285,0,0.0011257,MP,data/source/MP/cleaned/cifs/MP-mp-1214336.cif,False,,data/final/MP/graphs/B1Ba1Cu1Sm1O5-MP-mp-1214336.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
Fe1S0.25Te0.75,1,0.0,4.0,False,Fe4S1Te3,Fe4S1Te3,7.28,Ferrite,True,Fe50S12.5Te37.5,Fe-S-Te,3,Supercon,Fe1Te0.75S0.25,MP-mp-1225166,Fe4Te3S1,Fe-S-Te,Fe50S12.5Te37.5,P 4 m m,tetragonal,3.681551,3.681551,12.828124,data/final/MP/cifs/Fe1S0.25Te0.75-MP-mp-1225166.cif,data/source/MP/raw/cifs/mp-1225166.cif,mp-1225166,0.0,,2019-01-13 01:18:58.425000,6.095533568110601,,,{'GGA': {'task_id': 'mp-1734731'}},0.0699775034375003,5.35323303,520.0,-48.71242097,-6.08905262125,{'tags': []},-48.71242097,-6.08905262125,-0.3793793141406247,['bandstructure'],True,[],True,2021-05-12 10:58:45.495000,FM,8,5,mp-1225166,,Fe4Te3S,"{'functional': 'PBE', 'labels': ['Fe_pv', 'Te', 'S'], 'pot_type': 'paw'}","{'Fe': 4.0, 'Te': 3.0, 'S': 1.0}",GGA,mp-1225166,"['mp-1225166', 'mp-1396686', 'mp-1734731', 'mp-1832314', 'mp-1618667']",4.248469,"{'Fe': 4.0, 'Te': 3.0, 'S': 1.0}",173.87005497053255,[],FM,True,99,2,"[2.0, 0.2, 2.0, 0.2, 0.0, 0.0, 0.0, 0.0]",0.0244347366239691,4.248469,4,4.248469,MP,data/source/MP/cleaned/cifs/MP-mp-1225166.cif,False,,data/final/MP/graphs/Fe1S0.25Te0.75-MP-mp-1225166.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
Ir1Mo3,1,0.0,2.0,False,Ir2Mo6,Ir2Mo6,8.031,Other,True,Ir25Mo75,Ir-Mo,2,Supercon,Ir1Mo3,MP-mp-1120,Mo6Ir2,Ir-Mo,Ir25Mo75,P m -3 n,cubic,5.002782,5.002782,5.002782,data/final/MP/cifs/Ir1Mo3-MP-mp-1120.cif,data/source/MP/raw/cifs/mp-1120.cif,mp-1120,0.0,,2011-05-14 06:35:22,12.732657890506024,10.17188/1187628,"@misc{osti_1187628,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Mo3Ir (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187628"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696532'}},0.0650161950000001,8.5849993,520.0,-83.54743211,-10.44342901375,"{'tags': ['Iridium molydenum (1/3)', 'Iridium molybdenum (1/3)']}",-83.54743211,-10.44342901375,-0.0995891362499996,"['xas', 'elasticity', 'bandstructure']",True,"[640816, 600761, 640819, 640823]",True,2021-05-12 10:56:10.715000,NM,8,8,mp-1120,,Mo3Ir,"{'functional': 'PBE', 'labels': ['Mo_pv', 'Ir'], 'pot_type': 'paw'}","{'Mo': 3.0, 'Ir': 1.0}",GGA,mp-1120,"['mp-913557', 'mp-929931', 'mp-930423', 'mp-1120', 'mp-1414666', 'mp-1696532', 'mp-1803707', 'mp-1588387']",0.0177488,"{'Mo': 6.0, 'Ir': 2.0}",125.20876611439137,[],NM,False,131,0,"[-0.0, -0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0]",0.0002835073062501,0.0177488,0,0.0354976,MP,data/source/MP/cleaned/cifs/MP-mp-1120.cif,False,,data/final/MP/graphs/Ir1Mo3-MP-mp-1120.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
La0.9Ni1Sr0.1O3,2,0.0399999999999999,2.0,False,La1.8Ni2Sr0.2O6,La2Ni2O6,0.0,Oxide,True,La18Ni20Sr2O60,La-Ni-Sr-O,4,Supercon,La0.9Sr0.1Ni1O3,MP-mp-19339,La2Ni2O6,La-Ni-O,La20Ni20O60,R -3 c,trigonal,5.44052788,5.44033618,5.4404415,data/final/MP/cifs/La0.9Ni1Sr0.1O3-MP-mp-19339-synth_doped.cif,data/source/MP/raw/cifs/mp-19339.cif,mp-19339,0.0,,2013-06-07 05:29:36,6.934778690951409,10.17188/1194344,"@misc{osti_1194344,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaNiO3 (SG:167) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1194344"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-922720'}},0.0,6.77725286,520.0,-66.6331008,-6.66331008,"{'tags': ['Lanthanum nickel(III) oxide', 'Perovskite', 'Lanthanum niccolate(III)']}",-66.6331008,-6.66331008,-2.4717047200000004,"['xas', 'bandstructure']",True,"[173477, 93919, 67714, 91042, 67717, 187088, 67715, 187087, 84933, 67716]",True,2021-05-12 10:56:57.051000,FM,10,20,mp-19339,oxide,LaNiO3,"{'functional': 'PBE', 'labels': ['La', 'Ni_pv', 'O'], 'pot_type': 'paw'}","{'La': 1.0, 'Ni': 1.0, 'O': 3.0}",GGA+U,mp-19339,"['mp-923508', 'mp-908376', 'mp-922720', 'mp-611435', 'mp-19339', 'mp-1080688', 'mp-1092303', 'mp-1298178', 'mp-1298459', 'mp-1277409', 'mp-1284150', 'mp-1294225', 'mp-1283222', 'mp-1281199', 'mp-1279122', 'mp-1438619', 'mp-1668024', 'mp-1804253', 'mp-1876577', 'mp-1593937']",1.00042415,"{'La': 2.0, 'Ni': 2.0, 'O': 6.0}",117.6168836965564,[],FM,True,167,1,"[0.0, 0.0, 1.4, 1.4, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0170115738244013,1.00042415,2,2.0008483,MP,data/source/MP/cleaned/cifs/MP-mp-19339.cif,True,,data/final/MP/graphs/La0.9Ni1Sr0.1O3-MP-mp-19339-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Al3Th1,1,0.0,2.0,False,Al6Th2,Al6Th2,0.75,Other,True,Al75Th25,Al-Th,2,Supercon,Al3Th1,MP-mp-1306,Th2Al6,Al-Th,Al75Th25,P 63/m m c,hexagonal,4.638841,6.518257999814139,6.51825712,data/final/MP/cifs/Al3Th1-MP-mp-1306.cif,data/source/MP/raw/cifs/mp-1306.cif,mp-1306,0.0,,2011-05-12 23:30:53,6.089705059976287,10.17188/1189355,"@misc{osti_1189355,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ThAl3 (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189355"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697030'}},0.0,7.37771866,520.0,-40.51648695,-5.06456086875,{'tags': ['Aluminium thorium (3/1)']},-40.51648695,-5.06456086875,-0.40191443375,"['xas', 'elasticity', 'bandstructure']",True,"[609497, 58184, 609500, 58185]",True,2021-05-12 10:56:12.755000,NM,8,9,mp-1306,,ThAl3,"{'functional': 'PBE', 'labels': ['Th', 'Al'], 'pot_type': 'paw'}","{'Th': 1.0, 'Al': 3.0}",GGA,mp-1306,"['mp-928082', 'mp-928612', 'mp-911982', 'mp-1306', 'mp-1258304', 'mp-1425451', 'mp-1697030', 'mp-1882770', 'mp-1587305']",2.665e-05,"{'Th': 2.0, 'Al': 6.0}",170.6880563890318,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",3.122655511321704e-07,2.665e-05,0,5.33e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1306.cif,False,,data/final/MP/graphs/Al3Th1-MP-mp-1306.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ca3Rh4Sn13,1,0.0,2.0,False,Ca6Rh8Sn26,Ca6Rh8Sn26,7.4775,Other,True,Ca15Rh20Sn65,Ca-Rh-Sn,3,Supercon,Ca3Rh4Sn13,MP-mp-4363,Ca6Sn26Rh8,Ca-Rh-Sn,Ca15Rh20Sn65,P m -3 n,cubic,9.84313,9.84313,9.84313,data/final/MP/cifs/Ca3Rh4Sn13-MP-mp-4363.cif,data/source/MP/raw/cifs/mp-4363.cif,mp-4363,0.0,,2014-02-15 18:49:13,7.226292400553128,10.17188/1208100,"@misc{osti_1208100,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ca3Sn13Rh4 (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208100"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-941135'}},0.0,7.48134851,520.0,-195.3182753,-4.8829568825,"{'tags': ['Calcium rhodium stannide (3/4/13)', 'Calcium rhodium tin (3/4/13)']}",-195.3182753,-4.8829568825,-0.5030336207499999,"['xas', 'bandstructure']",True,"[619526, 58930, 58931, 58932]",True,2021-05-12 10:57:08.928000,NM,40,5,mp-4363,,Ca3Sn13Rh4,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Sn_d', 'Rh_pv'], 'pot_type': 'paw'}","{'Ca': 3.0, 'Sn': 13.0, 'Rh': 4.0}",GGA,mp-4363,"['mp-934615', 'mp-941514', 'mp-941135', 'mp-4363', 'mp-1345428']",0.0015042,"{'Ca': 6.0, 'Sn': 26.0, 'Rh': 8.0}",953.6733856191524,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.15453911723337e-06,0.0015042,0,0.0030084,MP,data/source/MP/cleaned/cifs/MP-mp-4363.cif,False,,data/final/MP/graphs/Ca3Rh4Sn13-MP-mp-4363.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Rh0.88Ru0.12Se2,3,0.08,4.0,False,Rh3.52Ru0.48Se8,Rh4Se8,2.28,Other,True,Rh29.333Ru4Se66.667,Rh-Ru-Se,3,Supercon,Rh0.88Ru0.12Se2,MP-mp-983,Rh4Se8,Rh-Se,Rh33.333Se66.667,P a -3,cubic,6.099805,6.099805,6.099805,data/final/MP/cifs/Rh0.88Ru0.12Se2-MP-mp-983-synth_doped.cif,data/source/MP/raw/cifs/mp-983.cif,mp-983,0.0,,2011-05-14 19:13:30,7.6332815701689585,10.17188/1316470,"@misc{osti_1316470,
    author = ""Persson, Kristin"",
    title = ""Materials Data on RhSe2 (SG:205) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1316470"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700335'}},0.033700524583339,6.11932593,520.0,-62.153365,-5.179447083333334,"{'tags': ['Rhenium selenide (1/2)', 'Rhodium selenide (1/2)', 'Rhodium perselenide (1/1)']}",-62.153365,-5.179447083333334,-0.7087368082291666,['bandstructure'],True,"[650276, 44868, 650283]",True,2021-05-12 10:59:09.988000,NM,12,8,mp-983,,RhSe2,"{'functional': 'PBE', 'labels': ['Rh_pv', 'Se'], 'pot_type': 'paw'}","{'Rh': 1.0, 'Se': 2.0}",GGA,mp-983,"['mp-942577', 'mp-921168', 'mp-983', 'mp-942969', 'mp-1417796', 'mp-1700335', 'mp-1871355', 'mp-1600224']",8.3475e-05,"{'Rh': 4.0, 'Se': 8.0}",226.95923284585007,[],NM,False,205,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.4711893224752998e-06,8.3475e-05,0,0.0003339,MP,data/source/MP/cleaned/cifs/MP-mp-983.cif,True,,data/final/MP/graphs/Rh0.88Ru0.12Se2-MP-mp-983-synth_doped.json,0,True,m-3,2,0,0,0,0,0,0,1,0,0,0,1.0,False
In3Lu1,1,0.0,1.0,True,In3Lu1,In3Lu1,0.24,Other,True,In75Lu25,In-Lu,2,Supercon,In3Lu1,MP-mp-977,Lu1In3,In-Lu,In75Lu25,P m -3 m,cubic,4.61052,4.61052,4.61052,data/final/MP/cifs/In3Lu1-MP-mp-977.cif,data/source/MP/raw/cifs/mp-977.cif,mp-977,0.0,,2011-05-13 01:53:14,8.800733510797421,10.17188/1315480,"@misc{osti_1315480,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LuIn3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1315480"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1674399'}},0.0,7.16571697,520.0,-14.07712157,-3.5192803925,{'tags': ['Indium lutetium (3/1)']},-14.07712157,-3.5192803925,-0.325279965,"['xas', 'elasticity', 'bandstructure']",True,"[639910, 51969, 51970]",True,2021-05-12 10:56:35.166000,NM,4,8,mp-977,,LuIn3,"{'functional': 'PBE', 'labels': ['Lu_3', 'In_d'], 'pot_type': 'paw'}","{'Lu': 1.0, 'In': 3.0}",GGA,mp-977,"['mp-913718', 'mp-930007', 'mp-977', 'mp-1437993', 'mp-1674399', 'mp-1797082', 'mp-930548', 'mp-1590841']",0.0071493,"{'Lu': 1.0, 'In': 3.0}",98.00533801577262,[],NM,False,221,0,"[0, 0, 0, 0]",7.294806736801844e-05,0.0071493,0,0.0071493,MP,data/source/MP/cleaned/cifs/MP-mp-977.cif,False,,data/final/MP/graphs/In3Lu1-MP-mp-977.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Cu1La1.5Sr0.5O4,1,0.0,2.0,False,Cu2La3Sr1O8,Cu2La3Sr1O8,0.0,Cuprate,True,Cu14.286La21.429Sr7.143O57.142857142857146,Cu-La-Sr-O,4,Supercon,La1.5Sr0.5Cu1O4,MP-mp-1218244,Sr1La3Cu2O8,Cu-La-Sr-O,Cu14.286La21.429Sr7.143O57.142857142857146,A m m 2,orthorhombic,5.374970003962781,5.37512,7.08660882,data/final/MP/cifs/Cu1La1.5Sr0.5O4-MP-mp-1218244.cif,data/source/MP/raw/cifs/mp-1218244.cif,mp-1218244,0.0,,2019-01-12 19:26:41.054000,6.656526097853591,,,{'GGA': {'task_id': 'mp-1733104'}},0.0396955084040211,6.42511046,520.0,-98.21447408,-7.015319577142857,{'tags': []},-98.21447408,-7.015319577142857,-2.816489852261905,[],False,[],True,2021-05-12 11:00:42.526000,NM,14,4,mp-1218244,oxide,SrLa3(CuO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 1.0, 'La': 3.0, 'Cu': 2.0, 'O': 8.0}",GGA,mp-1218244,"['mp-1218244', 'mp-1386236', 'mp-1733104', 'mp-1786154']",0.0303057,"{'Sr': 1.0, 'La': 3.0, 'Cu': 2.0, 'O': 8.0}",189.4460494806789,[],NM,False,38,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001599700816305,0.0303057,0,0.0303057,MP,data/source/MP/cleaned/cifs/MP-mp-1218244.cif,False,,data/final/MP/graphs/Cu1La1.5Sr0.5O4-MP-mp-1218244.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Ca0.125Cu1La1.875O4,2,0.0357142857142857,1.0,True,Ca0.125Cu1La1.875O4,Cu1La2O4,23.85,Cuprate,True,Ca1.786Cu14.286La26.786O57.142857142857146,Ca-Cu-La-O,4,Supercon,La1.875Ca0.125Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ca0.125Cu1La1.875O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ca0.125Cu1La1.875O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Rh0.53Se0.47,3,0.06,4.0,False,Rh2.12Se1.88,Rh2Se2,6.0,Other,True,Rh53Se47,Rh-Se,2,Supercon,Rh0.53Se0.47,MP-mp-900,Rh2Se2,Rh-Se,Rh50Se50,P 63/m m c,hexagonal,3.76919400460065,3.76919335,5.669942,data/final/MP/cifs/Rh0.53Se0.47-MP-mp-900-synth_doped.cif,data/source/MP/raw/cifs/mp-900.cif,mp-900,0.0,,2011-05-12 23:27:48,8.658113691953394,10.17188/1312915,"@misc{osti_1312915,
    author = ""Persson, Kristin"",
    title = ""Materials Data on RhSe (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1312915"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1667955'}},0.1129441116666676,6.28277323,520.0,-22.62245877,-5.6556146925,{'tags': ['Rhodium selenide (1/1)']},-22.62245877,-5.6556146925,-0.4615050186718745,"['xas', 'elasticity', 'bandstructure']",True,"[52069, 650284]",True,2021-05-12 10:56:33.121000,NM,4,8,mp-900,,RhSe,"{'functional': 'PBE', 'labels': ['Rh_pv', 'Se'], 'pot_type': 'paw'}","{'Rh': 1.0, 'Se': 1.0}",GGA,mp-900,"['mp-927133', 'mp-911007', 'mp-926596', 'mp-900', 'mp-1438936', 'mp-1667955', 'mp-1799054', 'mp-1591248']",1.255e-05,"{'Rh': 2.0, 'Se': 2.0}",69.75994503223205,[],NM,False,194,0,"[0, 0, 0, 0]",3.59805329382108e-07,1.255e-05,0,2.51e-05,MP,data/source/MP/cleaned/cifs/MP-mp-900.cif,True,,data/final/MP/graphs/Rh0.53Se0.47-MP-mp-900-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Bi4Ca2Cu4Sr4O16.25,2,0.0077134986225895,0.9845230769230772,True,Bi3.938Ca1.969Cu3.938Sr3.938O16,Bi4Ca2Cu4Sr4O16,82.4,Cuprate,True,Bi13.223Ca6.612Cu13.223Sr13.223O53.719008264462815,Bi-Ca-Cu-Sr-O,5,Supercon,Bi4Sr4Ca2Cu4O16.25,MP-mp-1218930,Sr4Ca2Cu4Bi4O16,Bi-Ca-Cu-Sr-O,Bi13.333Ca6.667Cu13.333Sr13.333O53.333333333333336,C c c 2,orthorhombic,5.417115,5.472898000129128,16.11398919,data/final/MP/cifs/Bi4Ca2Cu4Sr4O16.25-MP-mp-1218930-synth_doped.cif,data/source/MP/raw/cifs/mp-1218930.cif,mp-1218930,0.0,,2019-01-12 20:01:06.544000,6.266668983881059,,,,0.039252223722225,4.51768334,520.0,-173.15021002,-5.771673667333333,{'tags': []},-173.15021002,-5.771673667333333,-2.074956548222222,[],False,[],True,2021-05-12 11:00:42.526000,NM,30,3,mp-1218930,oxide,Sr2CaCu2(BiO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",GGA,mp-1218930,"['mp-1218930', 'mp-1359698', 'mp-1817714']",0.00011165,"{'Sr': 4.0, 'Ca': 2.0, 'Cu': 4.0, 'Bi': 4.0, 'O': 16.0}",470.7976286073367,[],NM,False,37,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.743014544498498e-07,0.00011165,0,0.0002233,MP,data/source/MP/cleaned/cifs/MP-mp-1218930.cif,True,,data/final/MP/graphs/Bi4Ca2Cu4Sr4O16.25-MP-mp-1218930-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Pb1.9Rh1,2,0.0229885057471264,2.0,False,Pb3.8Rh2,Pb4Rh2,1.32,Other,True,Pb65.517Rh34.483,Pb-Rh,2,Supercon,Pb1.9Rh1,MP-mp-321,Rh2Pb4,Pb-Rh,Pb66.667Rh33.333,I 4/m c m,tetragonal,5.661480260328252,5.66148026,5.66148026,data/final/MP/cifs/Pb1.9Rh1-MP-mp-321-synth_doped.cif,data/source/MP/raw/cifs/mp-321.cif,mp-321,0.0,,2011-05-14 03:01:40,12.445655994001733,10.17188/1206104,"@misc{osti_1206104,
    author = ""Persson, Kristin"",
    title = ""Materials Data on RhPb2 (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1206104"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698331'}},0.0,7.88880446,520.0,-30.0014006,-5.000233433333333,"{'tags': ['Rhodium lead (1/2)', 'Lead rhodium (2/1)', 'Rhodium plumbide (1/2)']}",-30.0014006,-5.000233433333333,-0.0703660966666668,"['xas', 'elasticity', 'bandstructure']",True,"[105608, 648423, 648419, 102802]",True,2021-05-12 10:56:20.740000,NM,6,9,mp-321,,RhPb2,"{'functional': 'PBE', 'labels': ['Rh_pv', 'Pb_d'], 'pot_type': 'paw'}","{'Rh': 1.0, 'Pb': 2.0}",GGA,mp-321,"['mp-934782', 'mp-941254', 'mp-321', 'mp-941562', 'mp-1077010', 'mp-1441918', 'mp-1698331', 'mp-1933275', 'mp-1587870']",0.0001739,"{'Rh': 2.0, 'Pb': 4.0}",138.04109522729053,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0]",2.519539557602992e-06,0.0001739,0,0.0003478,MP,data/source/MP/cleaned/cifs/MP-mp-321.cif,True,,data/final/MP/graphs/Pb1.9Rh1-MP-mp-321-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
In1.015Te1,2,0.0074441687344912,3.940943349753695,False,In4Te3.941,In4Te4,3.51,Other,True,In50.372Te49.628,In-Te,2,Supercon,In1.015Te1,MP-mp-20320,In4Te4,In-Te,In50Te50,I 4/m c m,tetragonal,7.09032241992039,7.09032242,7.090322419999999,data/final/MP/cifs/In1.015Te1-MP-mp-20320-synth_doped.cif,data/source/MP/raw/cifs/mp-20320.cif,mp-20320,0.0137999999999998,,2014-02-21 15:12:57,5.986866155889604,10.17188/1195443,"@misc{osti_1195443,
    author = ""Persson, Kristin"",
    title = ""Materials Data on InTe (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195443"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701451'}},0.0119628062500001,5.53454906,520.0,-25.79504471,-3.22438058875,"{'tags': ['Indium telluride (1/1)', 'Indium telluride  - I']}",-25.79504471,-3.22438058875,-0.4878882587499995,"['xas', 'elasticity', 'bandstructure']",True,"[169418, 169424, 169421, 73389, 169430, 606, 640624, 169427, 60526]",True,2021-05-12 10:56:14.760000,NM,8,9,mp-20320,,InTe,"{'functional': 'PBE', 'labels': ['In_d', 'Te'], 'pot_type': 'paw'}","{'In': 1.0, 'Te': 1.0}",GGA,mp-20320,"['mp-922033', 'mp-922262', 'mp-907670', 'mp-20320', 'mp-1079589', 'mp-1238945', 'mp-1432943', 'mp-1701451', 'mp-1588026']",2.02e-05,"{'In': 4.0, 'Te': 4.0}",268.95176806385354,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0, 0, 0]",3.004256137881821e-07,2.02e-05,0,8.08e-05,MP,data/source/MP/cleaned/cifs/MP-mp-20320.cif,True,,data/final/MP/graphs/In1.015Te1-MP-mp-20320-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B2Ir1Mo2,1,0.0,4.0,False,B8Ir4Mo8,B8Ir4Mo8,3.6,Other,True,B40Ir20Mo40,B-Ir-Mo,3,Supercon,Mo2Ir1B2,MP-mp-20391,B8Mo8Ir4,B-Ir-Mo,B40Ir20Mo40,P n n m,orthorhombic,3.257415,7.412161,9.455723,data/final/MP/cifs/B2Ir1Mo2-MP-mp-20391.cif,data/source/MP/raw/cifs/mp-20391.cif,mp-20391,0.0,,2014-02-22 22:20:22,11.803797703921417,10.17188/1195521,"@misc{osti_1195521,
    author = ""Persson, Kristin"",
    title = ""Materials Data on B2Mo2Ir (SG:58) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195521"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1673708'}},0.0366465100000006,9.36482904,520.0,-183.72511174,-9.186255587,{'tags': ['Molybdenum iridium boride (2/1/2)']},-183.72511174,-9.186255587,-0.4085555826666663,"['xas', 'bandstructure']",True,"[23786, 614545]",True,2021-05-12 10:56:57.051000,NM,20,8,mp-20391,,B2Mo2Ir,"{'functional': 'PBE', 'labels': ['B', 'Mo_pv', 'Ir'], 'pot_type': 'paw'}","{'B': 2.0, 'Mo': 2.0, 'Ir': 1.0}",GGA,mp-20391,"['mp-913019', 'mp-929626', 'mp-930120', 'mp-20391', 'mp-1435338', 'mp-1673708', 'mp-1786746', 'mp-1604230']",1.8225e-05,"{'B': 8.0, 'Mo': 8.0, 'Ir': 4.0}",228.30355668940928,[],NM,False,58,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.193117140052937e-07,1.8225e-05,0,7.29e-05,MP,data/source/MP/cleaned/cifs/MP-mp-20391.cif,False,,data/final/MP/graphs/B2Ir1Mo2-MP-mp-20391.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Bi3Ni1,1,0.0,4.0,False,Bi12Ni4,Bi12Ni4,3.935,Ferrite,True,Bi75Ni25,Bi-Ni,2,Supercon,Bi3Ni1,MP-mp-23179,Ni4Bi12,Bi-Ni,Bi75Ni25,P n m a,orthorhombic,4.158823,8.90949,11.546925,data/final/MP/cifs/Bi3Ni1-MP-mp-23179.cif,data/source/MP/raw/cifs/mp-23179.cif,mp-23179,0.0,,2014-02-22 14:41:23,10.644179451228444,10.17188/1199299,"@misc{osti_1199299,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NiBi3 (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199299"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1708341'}},0.0,6.61871576,520.0,-70.18994443,-4.386871526875,"{'tags': ['Bismuth nickel (3/1)', 'Nickel bismuthide (1/3)', 'Tribismuth nickel']}",-70.18994443,-4.386871526875,-0.0243116243750005,"['xas', 'elasticity', 'bandstructure']",True,"[180771, 58821, 391336]",True,2021-05-12 10:56:16.728000,NM,16,8,mp-23179,,NiBi3,"{'functional': 'PBE', 'labels': ['Ni_pv', 'Bi'], 'pot_type': 'paw'}","{'Ni': 1.0, 'Bi': 3.0}",GGA,mp-23179,"['mp-904851', 'mp-918297', 'mp-919312', 'mp-23179', 'mp-1432205', 'mp-1708341', 'mp-1815572', 'mp-1608049']",0.0002736,"{'Ni': 4.0, 'Bi': 12.0}",427.84811884443286,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.557917054668476e-06,0.0002736,0,0.0010944,MP,data/source/MP/cleaned/cifs/MP-mp-23179.cif,False,,data/final/MP/graphs/Bi3Ni1-MP-mp-23179.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ti0.65Zr0.35,2,0.0333333333333332,3.0,False,Ti1.95Zr1.05,Ti2Zr1,1.37,Other,True,Ti65Zr35,Ti-Zr,2,Supercon,Ti0.65Zr0.35,MP-mp-1008568,Zr1Ti2,Ti-Zr,Ti66.667Zr33.333,P 6/m m m,hexagonal,3.004109,4.731527996907044,4.731527609999999,data/final/MP/cifs/Ti0.65Zr0.35-MP-mp-1008568-synth_doped.cif,data/source/MP/raw/cifs/mp-1008568.cif,mp-1008568,0.0,,2016-09-18 00:34:34,5.330206704969721,10.17188/1325079,"@misc{osti_1325079,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrTi2 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1325079"",
    place = ""United States"",
    year = ""2016"",
    month = ""9"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1764265'}},0.0325921277777769,5.19791961,520.0,-24.24090828,-8.08030276,{'tags': ['Titanium zirconium (2/1)']},-24.24090828,-8.08030276,0.0325921277777775,"['xas', 'elasticity', 'bandstructure']",True,[247962],True,2021-05-12 10:56:08.727000,NM,3,12,mp-1008568,,ZrTi2,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Ti_pv'], 'pot_type': 'paw'}","{'Zr': 1.0, 'Ti': 2.0}",GGA,mp-1008568,"['mp-1008568', 'mp-1008612', 'mp-1008596', 'mp-1062308', 'mp-1062344', 'mp-1062253', 'mp-1431100', 'mp-1764265', 'mp-1790630', 'mp-1008619', 'mp-1611871', 'mp-1062333']",0.0006816,"{'Zr': 1.0, 'Ti': 2.0}",58.24371923962119,[],NM,False,191,0,"[0, 0, 0]",1.1702549371818466e-05,0.0006816,0,0.0006816,MP,data/source/MP/cleaned/cifs/MP-mp-1008568.cif,True,,data/final/MP/graphs/Ti0.65Zr0.35-MP-mp-1008568-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Co1.8Cu1.2S4,3,0.0571428571428571,2.0,False,Co3.6Cu2.4S8,Co4Cu2S8,2.0,Other,True,Co25.714Cu17.143S57.143,Co-Cu-S,3,Supercon,Cu1.2Co1.8S4,MP-mp-3925,Co4Cu2S8,Co-Cu-S,Co28.571Cu14.286S57.143,F d -3 m,cubic,6.69987918,6.699879179999999,6.699879179999999,data/final/MP/cifs/Co1.8Cu1.2S4-MP-mp-3925-synth_doped.cif,data/source/MP/raw/cifs/mp-3925.cif,mp-3925,0.0,,2011-05-15 03:07:38,4.836104359598833,10.17188/1207634,"@misc{osti_1207634,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Co2CuS4 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207634"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698326'}},0.0,5.68331854,520.0,-75.59837827,-5.399884162142857,"{'tags': ['Cobalt copper sulfide (2/1/4)', 'Carrollite', 'Dicobalt(III) copper sulfide']}",-75.59837827,-5.399884162142857,-0.7070782010714284,"['xas', 'bandstructure']",True,"[622571, 31107, 52943]",True,2021-05-12 10:57:08.928000,NM,14,8,mp-3925,,Co2CuS4,"{'functional': 'PBE', 'labels': ['Co', 'Cu_pv', 'S'], 'pot_type': 'paw'}","{'Co': 2.0, 'Cu': 1.0, 'S': 4.0}",GGA,mp-3925,"['mp-931396', 'mp-915858', 'mp-932359', 'mp-3925', 'mp-1425952', 'mp-1698326', 'mp-1833413', 'mp-1599756']",0.00593025,"{'Co': 4.0, 'Cu': 2.0, 'S': 8.0}",212.6600516474575,[],NM,False,227,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",5.5772110972972206e-05,0.00593025,0,0.0118605,MP,data/source/MP/cleaned/cifs/MP-mp-3925.cif,True,,data/final/MP/graphs/Co1.8Cu1.2S4-MP-mp-3925-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Au2In1Y1,1,0.0,1.0,True,Au2In1Y1,Au2In1Y1,1.82,Other,True,Au50In25Y25,Au-In-Y,3,Supercon,Au2In1Y1,MP-mp-22493,Y1In1Au2,Au-In-Y,Au50In25Y25,F m -3 m,cubic,4.9690133,4.969013299999999,4.969013299999999,data/final/MP/cifs/Au2In1Y1-MP-mp-22493.cif,data/source/MP/raw/cifs/mp-22493.cif,mp-22493,0.0,,2014-02-21 08:24:11,11.439462517738349,10.17188/1198738,"@misc{osti_1198738,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YInAu2 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198738"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671105'}},0.0,5.88176581,520.0,-18.58501454,-4.646253635,"{'tags': ['Gold indium yttrium (2/1/1)', 'Yttrium gold indide (1/2/1)']}",-18.58501454,-4.646253635,-0.7047741541666666,"['xas', 'elasticity', 'bandstructure']",True,"[612079, 612077, 58514, 612080]",True,2021-05-12 10:56:16.728000,NM,4,12,mp-22493,,YInAu2,"{'functional': 'PBE', 'labels': ['Y_sv', 'In_d', 'Au'], 'pot_type': 'paw'}","{'Y': 1.0, 'In': 1.0, 'Au': 2.0}",GGA,mp-22493,"['mp-932757', 'mp-940869', 'mp-941015', 'mp-22493', 'mp-1065715', 'mp-1065780', 'mp-1065734', 'mp-1439688', 'mp-1671105', 'mp-1800377', 'mp-1589761', 'mp-1065794']",0.0003788,"{'Y': 1.0, 'In': 1.0, 'Au': 2.0}",86.75519286518868,[],NM,False,225,0,"[0, 0, 0, 0]",4.366309237403552e-06,0.0003788,0,0.0003788,MP,data/source/MP/cleaned/cifs/MP-mp-22493.cif,False,,data/final/MP/graphs/Au2In1Y1-MP-mp-22493.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Cu1Sr0.75Y0.25O2,3,0.125,2.0,False,Cu2Sr1.5Y0.5O4,Cu2Sr2O4,38.6,Cuprate,True,Cu25Sr18.75Y6.25O50,Cu-Sr-Y-O,4,Supercon,Sr0.75Y0.25Cu1O2,MP-mp-5787,Sr2Cu2O4,Cu-Sr-O,Cu25Sr25O50,C m c m,orthorhombic,3.644437999912225,3.974263,8.32909336,data/final/MP/cifs/Cu1Sr0.75Y0.25O2-MP-mp-5787-synth_doped.cif,data/source/MP/raw/cifs/mp-5787.cif,mp-5787,0.0,,2011-05-13 22:43:08,5.167573150857569,10.17188/1276630,"@misc{osti_1276630,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SrCuO2 (SG:63) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1276630"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703560'}},0.0,3.45760864,520.0,-45.24374469,-5.65546808625,"{'tags': ['Strontium cuprate', 'Strontium copper oxide']}",-45.24374469,-5.65546808625,-2.0778125529166664,"['xas', 'elasticity', 'bandstructure']",True,"[77291, 93653, 202992, 16217, 83051, 77293]",True,2021-05-12 10:56:27.046000,NM,8,8,mp-5787,oxide,SrCuO2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Cu': 1.0, 'O': 2.0}",GGA,mp-5787,"['mp-924142', 'mp-909103', 'mp-5787', 'mp-924940', 'mp-1475985', 'mp-1703560', 'mp-1802910', 'mp-1593696']",4e-07,"{'Sr': 2.0, 'Cu': 2.0, 'O': 4.0}",117.71572347282628,[],NM,False,63,0,"[0, 0, 0, 0, 0, 0, 0, 0]",6.796033498317439e-09,4e-07,0,8e-07,MP,data/source/MP/cleaned/cifs/MP-mp-5787.cif,True,,data/final/MP/graphs/Cu1Sr0.75Y0.25O2-MP-mp-5787-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Au1Sb2,1,0.0,4.0,False,Au4Sb8,Au4Sb8,0.29,Other,True,Au33.333Sb66.667,Au-Sb,2,Supercon,Au1Sb2,MP-mp-738,Sb8Au4,Au-Sb,Au33.333Sb66.667,P a -3,cubic,6.790975,6.790975,6.790975,data/final/MP/cifs/Au1Sb2-MP-mp-738.cif,data/source/MP/raw/cifs/mp-738.cif,mp-738,0.0,,2011-05-14 01:01:32,9.342118343538662,10.17188/1287877,"@misc{osti_1287877,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sb2Au (SG:205) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1287877"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700620'}},0.0105493227777775,6.72008741,520.0,-46.99491994,-3.9162433283333336,"{'tags': ['Aurostibite', 'Gold antimony (1/2)', 'Gold antimonide (1/2)']}",-46.99491994,-3.9162433283333336,-0.0722819883333336,"['bandstructure', 'elasticity']",True,"[612288, 43107, 40350, 612284]",True,2021-05-12 10:56:29.056000,NM,12,8,mp-738,,Sb2Au,"{'functional': 'PBE', 'labels': ['Sb', 'Au'], 'pot_type': 'paw'}","{'Sb': 2.0, 'Au': 1.0}",GGA,mp-738,"['mp-923340', 'mp-922553', 'mp-908090', 'mp-738', 'mp-1425898', 'mp-1700620', 'mp-1806748', 'mp-1597600']",0.00108075,"{'Sb': 8.0, 'Au': 4.0}",313.18171285765817,[],NM,False,205,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.3803487951305809e-05,0.00108075,0,0.004323,MP,data/source/MP/cleaned/cifs/MP-mp-738.cif,False,,data/final/MP/graphs/Au1Sb2-MP-mp-738.json,0,True,m-3,2,0,0,0,0,0,0,1,0,0,0,1.0,False
Co0.75Cu0.25Zr2,1,0.0,4.0,False,Co3Cu1Zr8,Co3Cu1Zr8,4.89,Other,True,Co25Cu8.333Zr66.667,Co-Cu-Zr,3,Supercon,Zr2Co0.75Cu0.25,MP-mp-1215345,Zr8Co3Cu1,Co-Cu-Zr,Co25Cu8.333Zr66.667,C 2 2 2,orthorhombic,5.30356208,5.30356208,9.114024,data/final/MP/cifs/Co0.75Cu0.25Zr2-MP-mp-1215345.cif,data/source/MP/raw/cifs/mp-1215345.cif,mp-1215345,0.0,,2019-01-12 17:03:00.204000,7.138870336708552,,,{'GGA': {'task_id': 'mp-1733362'}},0.0118577508333306,4.54440767,520.0,-96.37627903,-8.031356585833334,{'tags': []},-96.37627903,-8.031356585833334,-0.214209494583334,[],False,[],True,2021-05-12 11:00:37.845000,NM,12,4,mp-1215345,,Zr8Co3Cu,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Co', 'Cu_pv'], 'pot_type': 'paw'}","{'Zr': 8.0, 'Co': 3.0, 'Cu': 1.0}",GGA,mp-1215345,"['mp-1215345', 'mp-1404390', 'mp-1733362', 'mp-1860892']",0.003717,"{'Zr': 8.0, 'Co': 3.0, 'Cu': 1.0}",225.6591426777788,[],NM,False,21,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.647174564208792e-05,0.003717,0,0.003717,MP,data/source/MP/cleaned/cifs/MP-mp-1215345.cif,False,,data/final/MP/graphs/Co0.75Cu0.25Zr2-MP-mp-1215345.json,0,True,222,0,0,0,4,0,0,0,0,1,0,0,1.0,False
Al0.935Nb3Si0.065,2,0.0324999999999999,2.0,False,Al1.87Nb6Si0.13,Al2Nb6,18.4,Other,True,Al23.375Nb75Si1.625,Al-Nb-Si,3,Supercon,Nb3Al0.935Si0.065,MP-mp-796,Nb6Al2,Al-Nb,Al25Nb75,P m -3 n,cubic,5.215254,5.215254,5.215254,data/final/MP/cifs/Al0.935Nb3Si0.065-MP-mp-796-synth_doped.cif,data/source/MP/raw/cifs/mp-796.cif,mp-796,0.0,,2011-05-13 16:07:37,7.157298025966356,,,{'GGA': {'task_id': 'mp-1686893'}},0.0460773865000003,5.52947534,520.0,-69.48918494,-8.6861481175,"{'tags': ['Aluminium niobium (1/3)', 'Niobium aluminide (3/1)', 'Aluminum niobium (1/3)']}",-69.48918494,-8.6861481175,-0.1737753800000003,"['bandstructure', 'elasticity']",True,"[608675, 608654, 608688, 608668, 608669, 608685, 608676, 608683, 58014, 608657, 107856, 608655, 608666, 608691, 608656, 608665, 608673, 608653, 608661]",True,2021-05-12 10:56:31.128000,NM,8,10,mp-796,,Nb3Al,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Al': 1.0}",GGA,mp-796,"['mp-911586', 'mp-927906', 'mp-796', 'mp-927472', 'mp-1260512', 'mp-1440919', 'mp-1686893', 'mp-1927652', 'mp-1591599', 'mp-1587739']",0.16323955,"{'Nb': 6.0, 'Al': 2.0}",141.8490379078192,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0023015954483396,0.16323955,0,0.3264791,MP,data/source/MP/cleaned/cifs/MP-mp-796.cif,True,,data/final/MP/graphs/Al0.935Nb3Si0.065-MP-mp-796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Cr0.72Os0.28,3,0.06,8.0,False,Cr5.76Os2.24,Cr6Os2,3.906,Other,True,Cr72Os28,Cr-Os,2,Supercon,Cr0.72Os0.28,MP-mp-416,Cr6Os2,Cr-Os,Cr75Os25,P m -3 n,cubic,4.64823,4.64823,4.64823,data/final/MP/cifs/Cr0.72Os0.28-MP-mp-416-synth_doped.cif,data/source/MP/raw/cifs/mp-416.cif,mp-416,0.0,,2011-05-14 14:17:35,11.448966502877054,10.17188/1207906,"@misc{osti_1207906,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Cr3Os (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207906"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696824'}},0.025919120000001,7.36022876,520.0,-80.16566437,-10.02070804625,{'tags': ['Chromium osmium (3/1)']},-80.16566437,-10.02070804625,0.025919120000001,"['xas', 'elasticity', 'bandstructure']",True,"[102829, 626494, 102828]",True,2021-05-12 10:56:20.740000,NM,8,8,mp-416,,Cr3Os,"{'functional': 'PBE', 'labels': ['Cr_pv', 'Os_pv'], 'pot_type': 'paw'}","{'Cr': 3.0, 'Os': 1.0}",GGA,mp-416,"['mp-912340', 'mp-928362', 'mp-928855', 'mp-416', 'mp-1426830', 'mp-1696824', 'mp-1796269', 'mp-1593089']",0.1637436,"{'Cr': 6.0, 'Os': 2.0}",100.42985322340976,[],NM,False,223,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0032608551092023,0.1637436,0,0.3274872,MP,data/source/MP/cleaned/cifs/MP-mp-416.cif,True,,data/final/MP/graphs/Cr0.72Os0.28-MP-mp-416-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
La0.99Nd0.01Pt1Si1,2,0.0066666666666666,2.0,False,La1.98Nd0.02Pt2Si2,La2Pt2Si2,3.71,Other,True,La33Nd0.333Pt33.333Si33.333,La-Nd-Pt-Si,4,Supercon,La0.99Nd0.01Pt1Si1,MP-mp-1206485,La2Si2Pt2,La-Pt-Si,La33.333Pt33.333Si33.333,I 41 m d,tetragonal,4.277808001286174,4.277808001286175,7.94541446,data/final/MP/cifs/La0.99Nd0.01Pt1Si1-MP-mp-1206485-synth_doped.cif,data/source/MP/raw/cifs/mp-1206485.cif,mp-1206485,0.0,,2019-01-12 09:47:13.211000,8.943745313538361,,,{'GGA': {'task_id': 'mp-1734531'}},0.0,7.90579938,520.0,-39.77896993,-6.629828321666667,{'tags': ['LaPtSi']},-39.77896993,-6.629828321666667,-1.1287520433333331,['bandstructure'],True,[],True,2021-05-12 10:58:37.524000,NM,6,5,mp-1206485,,LaSiPt,"{'functional': 'PBE', 'labels': ['La', 'Si', 'Pt'], 'pot_type': 'paw'}","{'La': 1.0, 'Si': 1.0, 'Pt': 1.0}",GGA,mp-1206485,"['mp-1206485', 'mp-1387492', 'mp-1734531', 'mp-1788111', 'mp-1628393']",1.825e-05,"{'La': 2.0, 'Si': 2.0, 'Pt': 2.0}",134.4491846861766,[],NM,False,109,0,"[0, 0, 0, 0, 0, 0]",2.714780315343388e-07,1.825e-05,0,3.65e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1206485.cif,True,,data/final/MP/graphs/La0.99Nd0.01Pt1Si1-MP-mp-1206485-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,0,0,1,0,1.0,False
Mg7Zn3,3,0.1,0.6666904761904762,False,Mg4.667Zn2,Mg6Zn2,0.28,Other,True,Mg70Zn30,Mg-Zn,2,Supercon,Mg7Zn3,MP-mp-1094451,Mg6Zn2,Mg-Zn,Mg75Zn25,P 63/m m c,hexagonal,4.979149,6.126222003005869,6.12622124,data/final/MP/cifs/Mg7Zn3-MP-mp-1094451-synth_doped.cif,data/source/MP/raw/cifs/mp-1094451.cif,mp-1094451,0.0,,2018-05-03 04:53:46,2.8386084352074827,,,,0.0183654089761791,3.44311386,520.0,-12.51297519,-1.56412189875,{'tags': []},-12.51297519,-1.56412189875,-0.04897595875,[],False,[],True,2021-05-12 10:59:22.504000,NM,8,3,mp-1094451,,Mg3Zn,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Zn'], 'pot_type': 'paw'}","{'Mg': 3.0, 'Zn': 1.0}",GGA,mp-1094451,"['mp-1094451', 'mp-1394864', 'mp-1926962']",0.0001735,"{'Mg': 6.0, 'Zn': 2.0}",161.83451229094194,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",2.1441656361664822e-06,0.0001735,0,0.000347,MP,data/source/MP/cleaned/cifs/MP-mp-1094451.cif,True,,data/final/MP/graphs/Mg7Zn3-MP-mp-1094451-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ce2In8Ir1,1,0.0,1.0,True,Ce2In8Ir1,Ce2In8Ir1,0.0,Heavy_fermion,True,Ce18.182In72.727Ir9.091,Ce-In-Ir,3,Supercon,Ce2Ir1In8,MP-mp-1207157,Ce2In8Ir1,Ce-In-Ir,Ce18.182In72.727Ir9.091,P 4/m m m,tetragonal,4.75737,4.75737,12.440277,data/final/MP/cifs/Ce2In8Ir1-MP-mp-1207157.cif,data/source/MP/raw/cifs/mp-1207157.cif,mp-1207157,0.0,,2019-01-12 10:19:23.361000,8.203706834441812,,,{'GGA': {'task_id': 'mp-1738144'}},0.0075443927272713,7.63012408,520.0,-46.92637538,-4.266034125454546,{'tags': []},-46.92637538,-4.266034125454546,-0.3825724372727273,[],False,[],True,2021-05-12 11:00:19.396000,FM,11,4,mp-1207157,,Ce2In8Ir,"{'functional': 'PBE', 'labels': ['Ce', 'In_d', 'Ir'], 'pot_type': 'paw'}","{'Ce': 2.0, 'In': 8.0, 'Ir': 1.0}",GGA,mp-1207157,"['mp-1207157', 'mp-1406101', 'mp-1738144', 'mp-1935564']",1.537761,"{'Ce': 2.0, 'In': 8.0, 'Ir': 1.0}",281.5554315239368,[],FM,True,123,1,"[0.7, 0.7, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0054616634162472,1.537761,2,1.537761,MP,data/source/MP/cleaned/cifs/MP-mp-1207157.cif,False,,data/final/MP/graphs/Ce2In8Ir1-MP-mp-1207157.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ag0.81In0.19,3,0.12,4.0,False,Ag3.24In0.76,Ag3In1,0.0074,Other,True,Ag81In19,Ag-In,2,Supercon,Ag0.81In0.19,MP-mp-30343,In1Ag3,Ag-In,Ag75In25,P m -3 m,cubic,4.24711,4.24711,4.24711,data/final/MP/cifs/Ag0.81In0.19-MP-mp-30343-synth_doped.cif,data/source/MP/raw/cifs/mp-30343.cif,mp-30343,0.0,,2014-02-19 17:29:33,9.50301692337814,10.17188/1204760,"@misc{osti_1204760,
    author = ""Persson, Kristin"",
    title = ""Materials Data on InAg3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1204760"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703883'}},0.0,5.0771726,520.0,-11.38286783,-2.8457169575,{'tags': ['Silver indium (3/1)']},-11.38286783,-2.8457169575,-0.0333790225000001,"['xas', 'elasticity', 'bandstructure']",True,[58283],True,2021-05-12 10:56:18.721000,NM,4,8,mp-30343,,InAg3,"{'functional': 'PBE', 'labels': ['In_d', 'Ag'], 'pot_type': 'paw'}","{'In': 1.0, 'Ag': 3.0}",GGA,mp-30343,"['mp-928641', 'mp-911999', 'mp-928119', 'mp-30343', 'mp-1476153', 'mp-1703883', 'mp-1781863', 'mp-1592671']",0.0001596,"{'In': 1.0, 'Ag': 3.0}",76.60912959013744,[],NM,False,221,0,"[0, 0, 0, 0]",2.08330261489548e-06,0.0001596,0,0.0001596,MP,data/source/MP/cleaned/cifs/MP-mp-30343.cif,True,,data/final/MP/graphs/Ag0.81In0.19-MP-mp-30343-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Al0.2B2Mg0.8,1,0.0,5.0,False,Al1B10Mg4,Al1B10Mg4,28.71,Other,True,Al6.667B66.667Mg26.667,Al-B-Mg,3,Supercon,Mg0.8Al0.2B2,MP-mp-1222150,Mg4Al1B10,Al-B-Mg,Al6.667B66.667Mg26.667,P 6/m m m,hexagonal,3.06981400111962,3.06981408,17.259121,data/final/MP/cifs/Al0.2B2Mg0.8-MP-mp-1222150.cif,data/source/MP/raw/cifs/mp-1222150.cif,mp-1222150,0.0,,2019-01-12 22:43:50.111000,2.7387124355785897,,,,0.0,6.86437409,520.0,-79.0318243,-5.268788286666666,{'tags': []},-79.0318243,-5.268788286666666,-0.1394140374444437,[],False,[],True,2021-05-12 11:00:49.659000,NM,15,3,mp-1222150,,Mg4AlB10,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Al', 'B'], 'pot_type': 'paw'}","{'Mg': 4.0, 'Al': 1.0, 'B': 10.0}",GGA,mp-1222150,"['mp-1222150', 'mp-1391010', 'mp-1779950']",0.0370608,"{'Mg': 4.0, 'Al': 1.0, 'B': 10.0}",140.85538169536093,[],NM,False,191,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0002631124175301,0.0370608,0,0.0370608,MP,data/source/MP/cleaned/cifs/MP-mp-1222150.cif,False,,data/final/MP/graphs/Al0.2B2Mg0.8-MP-mp-1222150.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
C0.69Mg1Ni3,3,0.1057569296375266,1.0,True,C0.69Mg1Ni3,C1Mg1Ni3,1.8,Other,True,C14.712Mg21.322Ni63.966,C-Mg-Ni,3,Supercon,Mg1C0.69Ni3,MP-mp-10700,Mg1Ni3C1,C-Mg-Ni,C20Mg20Ni60,P m -3 m,cubic,3.810209,3.810209,3.810209,data/final/MP/cifs/C0.69Mg1Ni3-MP-mp-10700-synth_doped.cif,data/source/MP/raw/cifs/mp-10700.cif,mp-10700,0.0,,2011-05-28 10:04:44,6.376007671789427,10.17188/1187303,"@misc{osti_1187303,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MgNi3C (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187303"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678621'}},0.0,6.64260176,520.0,-28.85099542,-5.770199084,{'tags': ['Magnesium nickel carbide (1/3/1)']},-28.85099542,-5.770199084,-0.1367049259999994,"['xas', 'elasticity', 'bandstructure']",True,[77152],True,2021-05-12 10:56:10.715000,NM,5,8,mp-10700,,MgNi3C,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Ni_pv', 'C'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",GGA,mp-10700,"['mp-927245', 'mp-927653', 'mp-911184', 'mp-10700', 'mp-1438083', 'mp-1678621', 'mp-1791467', 'mp-1591421']",0.0387875,"{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",55.31544309398296,[],NM,False,221,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",0.0007012056277683,0.0387875,0,0.0387875,MP,data/source/MP/cleaned/cifs/MP-mp-10700.cif,True,,data/final/MP/graphs/C0.69Mg1Ni3-MP-mp-10700-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
B1Li2Ni0.3Pd2.7,3,0.0999999999999999,4.0,False,B4Li8Ni1.2Pd10.8,B4Li8Pd12,7.233333333,Other,True,B16.667Li33.333Ni5Pd45,B-Li-Ni-Pd,4,Supercon,Li2Pd2.7Ni0.3B1,MP-mp-20657,Li8B4Pd12,B-Li-Pd,B16.667Li33.333Pd50,P 43 3 2,cubic,6.834153,6.834153,6.834153,data/final/MP/cifs/B1Li2Ni0.3Pd2.7-MP-mp-20657-synth_doped.cif,data/source/MP/raw/cifs/mp-20657.cif,mp-20657,0.0,,2014-02-22 22:20:25,7.157380380013985,10.17188/1195787,"@misc{osti_1195787,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Li2BPd3 (SG:212) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195787"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672514'}},0.0,3.54739631,520.0,-115.20693246,-4.8002888525000005,{'tags': ['Lithium palladium boride (2/3/1)']},-115.20693246,-4.8002888525000005,-0.4608083634722219,"['xas', 'bandstructure']",True,"[156465, 246447, 84931]",True,2021-05-12 10:56:57.051000,NM,24,9,mp-20657,,Li2BPd3,"{'functional': 'PBE', 'labels': ['Li_sv', 'B', 'Pd'], 'pot_type': 'paw'}","{'Li': 2.0, 'B': 1.0, 'Pd': 3.0}",GGA,mp-20657,"['mp-921382', 'mp-906713', 'mp-920352', 'mp-20657', 'mp-1116014', 'mp-1415525', 'mp-1672514', 'mp-1806936', 'mp-1654311']",4.895e-05,"{'Li': 8.0, 'B': 4.0, 'Pd': 12.0}",319.1935391161389,[],NM,False,212,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.134209374731673e-07,4.895e-05,0,0.0001958,MP,data/source/MP/cleaned/cifs/MP-mp-20657.cif,True,,data/final/MP/graphs/B1Li2Ni0.3Pd2.7-MP-mp-20657-synth_doped.json,0,True,432,4,0,0,0,0,0,0,1,0,0,0,1.0,False
Al0.05Nb3Sn0.95,2,0.025,2.0,False,Al0.1Nb6Sn1.9,Nb6Sn2,18.1,Other,True,Al1.25Nb75Sn23.75,Al-Nb-Sn,3,Supercon,Nb3Al0.05Sn0.95,MP-mp-1326,Nb6Sn2,Nb-Sn,Nb75Sn25,P m -3 n,cubic,5.334611,5.334611,5.334611,data/final/MP/cifs/Al0.05Nb3Sn0.95-MP-mp-1326-synth_doped.cif,data/source/MP/raw/cifs/mp-1326.cif,mp-1326,0.0,,2011-05-14 09:51:48,8.694218121896231,10.17188/1189484,"@misc{osti_1189484,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Sn (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189484"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668415'}},0.0,6.59372491,520.0,-69.93787048,-8.74223381,{'tags': ['Niobium tin (3/1)']},-69.93787048,-8.74223381,-0.163862066250001,"['xas', 'elasticity', 'bandstructure']",True,"[105230, 645503, 645489, 105231, 645498, 645485, 645474, 645496, 645480, 645488, 645482, 645487, 645500, 645493, 645477, 645484, 645502, 645483, 150878, 645479, 645481, 645486, 645473]",True,2021-05-12 10:56:12.755000,NM,8,9,mp-1326,,Nb3Sn,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Sn_d'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Sn': 1.0}",GGA,mp-1326,"['mp-930046', 'mp-913770', 'mp-930577', 'mp-1326', 'mp-1440651', 'mp-1668415', 'mp-1880085', 'mp-1594093', 'mp-1594507']",0.62023085,"{'Nb': 6.0, 'Sn': 2.0}",151.81275738025872,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0081709977567491,0.62023085,0,1.2404617,MP,data/source/MP/cleaned/cifs/MP-mp-1326.cif,True,,data/final/MP/graphs/Al0.05Nb3Sn0.95-MP-mp-1326-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
K1Sb1,1,0.0,8.0,False,K8Sb8,K8Sb8,0.0,Other,True,K50Sb50,K-Sb,2,Supercon,K1Sb1,MP-mp-1536,K8Sb8,K-Sb,K50Sb50,P 1 21/c 1,monoclinic,7.084541,7.306127,12.415433585889415,data/final/MP/cifs/K1Sb1-MP-mp-1536.cif,data/source/MP/raw/cifs/mp-1536.cif,mp-1536,0.8799999999999999,,2011-05-15 02:55:41,3.3514624913940607,10.17188/1191142,"@misc{osti_1191142,
    author = ""Persson, Kristin"",
    title = ""Materials Data on KSb (SG:14) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191142"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1670510'}},0.0,2.26547598,520.0,-48.81175633,-3.050734770625,"{'tags': ['Potassium antimony (1/1)', 'Potassium antimonide (1/1)']}",-48.81175633,-3.050734770625,-0.5270346771250001,"['diel', 'xas', 'bandstructure']",True,"[100466, 43505, 56529]",True,2021-05-12 10:56:45.290000,NM,16,9,mp-1536,,KSb,"{'functional': 'PBE', 'labels': ['K_sv', 'Sb'], 'pot_type': 'paw'}","{'K': 1.0, 'Sb': 1.0}",GGA,mp-1536,"['mp-666523', 'mp-681937', 'mp-1536', 'mp-1141432', 'mp-1428370', 'mp-1670510', 'mp-1884855', 'mp-990288', 'mp-1629938']",0.0003892125,"{'K': 8.0, 'Sb': 8.0}",637.5998347533495,[],NM,False,14,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.883470525371938e-06,0.0003892125,0,0.0031137,MP,data/source/MP/cleaned/cifs/MP-mp-1536.cif,False,,data/final/MP/graphs/K1Sb1-MP-mp-1536.json,0,True,2/m,0,0,3,0,0,0,0,1,0,0,0,1.0,False
As2Ba0.5Fe2K0.5,3,0.0666666666666666,3.0,False,As6Ba1.5Fe6K1.5,As6Ba1Fe6K2,35.28,Ferrite,True,As40Ba10Fe40K10,As-Ba-Fe-K,4,Supercon,Ba0.5K0.5Fe2As2,MP-mp-1223766,K2Ba1Fe6As6,As-Ba-Fe-K,As40Ba6.667Fe40K13.333,C 1 2/m 1,monoclinic,5.437740001361472,7.18634711,8.612102760000003,data/final/MP/cifs/As2Ba0.5Fe2K0.5-MP-mp-1223766-synth_doped.cif,data/source/MP/raw/cifs/mp-1223766.cif,mp-1223766,0.0,,2019-01-13 00:06:57.709000,5.619425416151954,,,,0.0077898596666665,3.9822019,520.0,-88.48429402,-5.898952934666666,{'tags': []},-88.48429402,-5.898952934666666,-0.3713176110666666,[],False,[],True,2021-05-12 11:00:52.054000,FM,15,3,mp-1223766,,K2Ba(FeAs)6,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'K': 2.0, 'Ba': 1.0, 'Fe': 6.0, 'As': 6.0}",GGA,mp-1223766,"['mp-1223766', 'mp-1375545', 'mp-1808794']",0.1908756,"{'K': 2.0, 'Ba': 1.0, 'Fe': 6.0, 'As': 6.0}",295.5362020180066,[],FM,True,12,2,"[-0.0, -0.0, -0.0, -0.0, 0.1, 0.1, 0.1, 0.1, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0006458619915145,0.1908756,4,0.1908756,MP,data/source/MP/cleaned/cifs/MP-mp-1223766.cif,True,,data/final/MP/graphs/As2Ba0.5Fe2K0.5-MP-mp-1223766-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
Co0.05Fe0.95Se1,2,0.05,2.0,False,Co0.1Fe1.9Se2,Fe2Se2,10.0,Ferrite,True,Co2.5Fe47.5Se50,Co-Fe-Se,3,Supercon,Fe0.95Co0.05Se1,MP-mp-20311,Fe2Se2,Fe-Se,Fe50Se50,P 4/n m m,tetragonal,3.688905,3.688905,5.854194,data/final/MP/cifs/Co0.05Fe0.95Se1-MP-mp-20311-synth_doped.cif,data/source/MP/raw/cifs/mp-20311.cif,mp-20311,0.0,,2013-10-20 07:09:24,5.619828229873189,10.17188/1195438,"@misc{osti_1195438,
    author = ""Persson, Kristin"",
    title = ""Materials Data on FeSe (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195438"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668877'}},0.0,3.48880228,520.0,-25.01949237,-6.2548730925,"{'tags': ['Iron selenide - NN AFM', 'Iron selenide - orthorhombic, LT', 'Iron selenide', 'Iron sulfide', 'Iron selenide (1/1) - nonmagnetic', 'Iron selenide - tetragonal', 'Iron selenide - alpha LT', 'Iron selenide - LT', 'High pressure experimental phase', 'Iron selenide - alpha']}",-25.01949237,-6.2548730925,-0.5079131286718743,"['xas', 'elasticity', 'bandstructure']",True,"[196301, 196298, 196299, 196297, 290701, 165958, 185464, 163561, 169257, 163560, 977900, 169311, 169303, 26889, 166440, 162901, 169283, 165957, 169271, 977903, 169259, 977901, 185465, 165959, 169306, 169267, 163557, 169287, 169297, 169289, 163556, 169299, 163562, 166441, 182544, 163559, 169269, 169263, 169265, 169315, 169255, 166439, 169293, 169313, 163555, 169291, 169301, 165960, 169253, 169295, 169970, 163558, 169285, 169261, 169309]",True,2021-05-12 10:56:14.760000,NM,4,55,mp-20311,,FeSe,"{'functional': 'PBE', 'labels': ['Fe_pv', 'Se'], 'pot_type': 'paw'}","{'Fe': 1.0, 'Se': 1.0}",GGA,mp-20311,"['mp-684656', 'mp-20311', 'mp-1063646', 'mp-1063662', 'mp-1063681', 'mp-1063669', 'mp-1063680', 'mp-1063695', 'mp-1063686', 'mp-1063699', 'mp-1063715', 'mp-1063717', 'mp-1063876', 'mp-1063734', 'mp-1063891', 'mp-1063735', 'mp-1063910', 'mp-1063918', 'mp-1063922', 'mp-1063931', 'mp-1063774', 'mp-1063781', 'mp-1064091', 'mp-1064111', 'mp-1063801', 'mp-1064112', 'mp-1064180', 'mp-1064138', 'mp-1064153', 'mp-1065102', 'mp-1065123', 'mp-1065075', 'mp-1065161', 'mp-1065131', 'mp-1065030', 'mp-1065055', 'mp-1065085', 'mp-1065094', 'mp-1440814', 'mp-1668877', 'mp-1799618', 'mp-1593782', 'mp-1592730', 'mp-1065081', 'mp-1065148', 'mp-1063928', 'mp-1063726', 'mp-1063683', 'mp-1063709', 'mp-1063911', 'mp-1063795', 'mp-1065121', 'mp-1063725', 'mp-1064139', 'mp-1064165']",3.455e-05,"{'Fe': 2.0, 'Se': 2.0}",79.66398961559156,[],NM,False,129,0,"[0, 0, 0, 0]",8.673931638803586e-07,3.455e-05,0,6.91e-05,MP,data/source/MP/cleaned/cifs/MP-mp-20311.cif,True,,data/final/MP/graphs/Co0.05Fe0.95Se1-MP-mp-20311-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
W1O2,1,0.0,4.0,False,W4O8,W4O8,0.0,Oxide,True,W33.333O66.66666666666667,W-O,2,Supercon,O2W1,MP-mvc-2118,W4O8,W-O,W33.333O66.66666666666667,I 4/m,tetragonal,3.3022119977290205,7.708528119657739,7.70852812,data/final/MP/cifs/W1O2-MP-mvc-2118.cif,data/source/MP/raw/cifs/mvc-2118.cif,mvc-2118,2.3837,,2014-02-04 22:02:21,7.657498909970382,10.17188/1320078,"@misc{osti_1320078,
    author = ""Persson, Kristin"",
    title = ""Materials Data on WO2 (SG:87) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1320078"",
    place = ""United States"",
    year = ""2014"",
    month = ""9"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-1741532'}},0.1056428066666672,1.48705191,520.0,-91.3377883,-7.611482358333333,{'tags': []},-91.3377883,-7.611482358333333,-1.930799531666666,[],False,[],True,2021-05-12 11:01:50.514000,FM,12,4,mvc-2118,oxide,WO2,"{'functional': 'PBE', 'labels': ['W_pv', 'O'], 'pot_type': 'paw'}","{'W': 1.0, 'O': 2.0}",GGA+U,mvc-2118,"['mvc-2118', 'mp-1445593', 'mp-1741532', 'mp-1833698']",2.000012325,"{'W': 4.0, 'O': 8.0}",187.2197508360861,[],FM,True,87,1,"[2.0, 2.0, 2.0, 2.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0427307977084328,2.000012325,4,8.0000493,MP,data/source/MP/cleaned/cifs/MP-mvc-2118.cif,False,,data/final/MP/graphs/W1O2-MP-mvc-2118.json,0,True,4/m,0,0,0,0,3,0,0,0,0,1,0,1.0,False
Fe0.98Se0.15Te0.9,3,0.1366995073891625,3.333446712018141,False,Fe3.267Se0.5Te3,Fe4Se1Te3,8.8,Ferrite,True,Fe48.276Se7.389Te44.335,Fe-Se-Te,3,Supercon,Fe0.98Se0.15Te0.9,MP-mp-1224987,Fe4Te3Se1,Fe-Se-Te,Fe50Se12.5Te37.5,I 4 m m,tetragonal,5.13773746,5.13773746,7.4290486185030735,data/final/MP/cifs/Fe0.98Se0.15Te0.9-MP-mp-1224987-synth_doped.cif,data/source/MP/raw/cifs/mp-1224987.cif,mp-1224987,0.0,,2019-01-13 01:09:44.863000,6.651173429977408,,,,0.0666660184375,5.58340921,520.0,-47.62935805,-5.95366975625,{'tags': []},-47.62935805,-5.95366975625,-0.3201887477929688,[],False,[],True,2021-05-12 11:00:54.298000,FM,8,2,mp-1224987,,Fe4Te3Se,"{'functional': 'PBE', 'labels': ['Fe_pv', 'Te', 'Se'], 'pot_type': 'paw'}","{'Fe': 4.0, 'Te': 3.0, 'Se': 1.0}",GGA,mp-1224987,"['mp-1224987', 'mp-1829800']",7.861253,"{'Fe': 4.0, 'Te': 3.0, 'Se': 1.0}",171.05278460528558,[],FM,True,107,1,"[2.0, 2.0, 2.0, 2.0, 0.0, 0.0, 0.0, 0.0]",0.0459580533467508,7.861253,4,7.861253,MP,data/source/MP/cleaned/cifs/MP-mp-1224987.cif,True,,data/final/MP/graphs/Fe0.98Se0.15Te0.9-MP-mp-1224987-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,0,0,1,0,1.0,False
B2C1La1Ni2,1,0.0,1.0,True,B2C1La1Ni2,B2C1La1Ni2,0.0,Other,True,B33.333C16.667La16.667Ni33.333,B-C-La-Ni,4,Supercon,La1Ni2B2C1,MP-mp-568083,La1Ni2B2C1,B-C-La-Ni,B33.333C16.667La16.667Ni33.333,I 4/m m m,tetragonal,3.778408000864025,3.778408000864025,5.58913044,data/final/MP/cifs/B2C1La1Ni2-MP-mp-568083.cif,data/source/MP/raw/cifs/mp-568083.cif,mp-568083,0.0,,2015-11-24 04:25:29,6.86920901082653,10.17188/1274239,"@misc{osti_1274239,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1274239"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671217'}},0.0,8.77527543,520.0,-41.7334724,-6.955578733333333,{'tags': []},-41.7334724,-6.955578733333333,-0.4419379488888886,"['xas', 'elasticity', 'bandstructure']",True,[79562],True,2021-05-12 10:56:22.739000,NM,6,8,mp-568083,,LaNi2B2C,"{'functional': 'PBE', 'labels': ['La', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'La': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-568083,"['mp-988028', 'mp-987114', 'mp-568083', 'mp-1300171', 'mp-1671217', 'mp-1929736', 'mp-988265', 'mp-1590195']",2.6e-06,"{'La': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",70.08546956557161,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",3.709756125080183e-08,2.6e-06,0,2.6e-06,MP,data/source/MP/cleaned/cifs/MP-mp-568083.cif,False,,data/final/MP/graphs/B2C1La1Ni2-MP-mp-568083.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Al0.907Ga0.093Nb3,2,0.0464999999999999,2.0,False,Al1.814Ga0.186Nb6,Al2Nb6,19.1,Other,True,Al22.675Ga2.325Nb75,Al-Ga-Nb,3,Supercon,Nb3Al0.907Ga0.093,MP-mp-796,Nb6Al2,Al-Nb,Al25Nb75,P m -3 n,cubic,5.215254,5.215254,5.215254,data/final/MP/cifs/Al0.907Ga0.093Nb3-MP-mp-796-synth_doped.cif,data/source/MP/raw/cifs/mp-796.cif,mp-796,0.0,,2011-05-13 16:07:37,7.157298025966356,,,{'GGA': {'task_id': 'mp-1686893'}},0.0460773865000003,5.52947534,520.0,-69.48918494,-8.6861481175,"{'tags': ['Aluminium niobium (1/3)', 'Niobium aluminide (3/1)', 'Aluminum niobium (1/3)']}",-69.48918494,-8.6861481175,-0.1737753800000003,"['bandstructure', 'elasticity']",True,"[608675, 608654, 608688, 608668, 608669, 608685, 608676, 608683, 58014, 608657, 107856, 608655, 608666, 608691, 608656, 608665, 608673, 608653, 608661]",True,2021-05-12 10:56:31.128000,NM,8,10,mp-796,,Nb3Al,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Al': 1.0}",GGA,mp-796,"['mp-911586', 'mp-927906', 'mp-796', 'mp-927472', 'mp-1260512', 'mp-1440919', 'mp-1686893', 'mp-1927652', 'mp-1591599', 'mp-1587739']",0.16323955,"{'Nb': 6.0, 'Al': 2.0}",141.8490379078192,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0023015954483396,0.16323955,0,0.3264791,MP,data/source/MP/cleaned/cifs/MP-mp-796.cif,True,,data/final/MP/graphs/Al0.907Ga0.093Nb3-MP-mp-796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Cu1Zn1,1,0.0,1.0,True,Cu1Zn1,Cu1Zn1,0.0,Other,True,Cu50Zn50,Cu-Zn,2,Supercon,Cu1Zn1,MP-mp-987,Zn1Cu1,Cu-Zn,Cu50Zn50,P m -3 m,cubic,2.960572,2.960572,2.960572,data/final/MP/cifs/Cu1Zn1-MP-mp-987.cif,data/source/MP/raw/cifs/mp-987.cif,mp-987,0.0,,2011-05-12 20:07:35,8.252022453086578,10.17188/1316761,"@misc{osti_1316761,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZnCu (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1316761"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688211'}},0.0,5.08827892,520.0,-5.54038593,-2.770192965,"{'tags': ['Copper zinc (1/1)- beta', 'Zhanghengite', 'Copper zinc (1/1) - HT', 'Copper zinc (1/1)']}",-5.54038593,-2.770192965,-0.090717825,"['xas', 'elasticity', 'bandstructure']",True,"[629462, 56276, 103152]",True,2021-05-12 10:56:37.246000,NM,2,9,mp-987,,ZnCu,"{'functional': 'PBE', 'labels': ['Zn', 'Cu_pv'], 'pot_type': 'paw'}","{'Zn': 1.0, 'Cu': 1.0}",GGA,mp-987,"['mp-990110', 'mp-990131', 'mp-987', 'mp-1142171', 'mp-1440229', 'mp-1688211', 'mp-1791355', 'mp-990147', 'mp-1591932']",0.0001363,"{'Zn': 1.0, 'Cu': 1.0}",25.94937381118107,[],NM,False,221,0,"[0, 0]",5.252535224617677e-06,0.0001363,0,0.0001363,MP,data/source/MP/cleaned/cifs/MP-mp-987.cif,False,,data/final/MP/graphs/Cu1Zn1-MP-mp-987.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Mo15Pb2Se19,1,0.0,2.0,False,Mo30Pb4Se38,Mo30Pb4Se38,0.0,Chevrel,True,Mo41.667Pb5.556Se52.778,Mo-Pb-Se,3,Supercon,Pb2Mo15Se19,MP-mp-1200386,Mo30Pb4Se38,Mo-Pb-Se,Mo41.667Pb5.556Se52.778,R -3 c,trigonal,9.843145640165218,9.843145640165218,20.03204233,data/final/MP/cifs/Mo15Pb2Se19-MP-mp-1200386.cif,data/source/MP/raw/cifs/mp-1200386.cif,mp-1200386,0.0187999999999997,,2019-01-12 04:48:16.790000,6.910421675610933,,,,0.0512615422222202,4.69684139,520.0,-508.18465388,-7.0581201927777775,{'tags': ['Lead molybdenum selenide (2/15/19)']},-508.18465388,-7.0581201927777775,-0.7368908131814228,[],False,[644127],True,2021-05-12 11:00:08.243000,NM,72,2,mp-1200386,,Mo15Pb2Se19,"{'functional': 'PBE', 'labels': ['Mo_pv', 'Pb_d', 'Se'], 'pot_type': 'paw'}","{'Mo': 15.0, 'Pb': 2.0, 'Se': 19.0}",GGA,mp-1200386,"['mp-1200386', 'mp-1325162']",0.01398695,"{'Mo': 30.0, 'Pb': 4.0, 'Se': 38.0}",1611.7732175082472,[],NM,False,167,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.7355977687262237e-05,0.01398695,0,0.0279739,MP,data/source/MP/cleaned/cifs/MP-mp-1200386.cif,False,,data/final/MP/graphs/Mo15Pb2Se19-MP-mp-1200386.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ca0.13Cu1La1.87O4,2,0.0371428571428571,1.0,True,Ca0.13Cu1La1.87O4,Cu1La2O4,28.0,Cuprate,True,Ca1.857Cu14.286La26.714O57.142857142857146,Ca-Cu-La-O,4,Supercon,La1.87Ca0.13Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ca0.13Cu1La1.87O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ca0.13Cu1La1.87O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
P2Ru2Sr1,1,0.0,1.0,True,P2Ru2Sr1,P2Ru2Sr1,0.0,Other,True,P40Ru40Sr20,P-Ru-Sr,3,Supercon,Sr1Ru2P2,MP-mp-3804,Sr1P2Ru2,P-Ru-Sr,P40Ru40Sr20,I 4/m m m,tetragonal,4.06655199848499,4.06655199848499,6.32987955,data/final/MP/cifs/P2Ru2Sr1-MP-mp-3804.cif,data/source/MP/raw/cifs/mp-3804.cif,mp-3804,0.0,,2011-05-13 03:37:27,6.262845368373162,10.17188/1207459,"@misc{osti_1207459,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr(PRu)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207459"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700121'}},0.0,6.39658956,520.0,-35.70288315,-7.14057663,"{'tags': ['Ruthenium strontium phosphide (2/1/2)', 'Strontium ruthenium phosphide (1/2/2)']}",-35.70288315,-7.14057663,-0.9276010746666664,"['xas', 'elasticity', 'bandstructure']",True,"[648030, 42966]",True,2021-05-12 10:56:20.740000,NM,5,8,mp-3804,,Sr(PRu)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'P', 'Ru_pv'], 'pot_type': 'paw'}","{'Sr': 1.0, 'P': 2.0, 'Ru': 2.0}",GGA,mp-3804,"['mp-909895', 'mp-925865', 'mp-3804', 'mp-925462', 'mp-1438087', 'mp-1700121', 'mp-1798105', 'mp-1588619']",1.57e-05,"{'Sr': 1.0, 'P': 2.0, 'Ru': 2.0}",93.25219596965128,[],NM,False,139,0,"[0, 0, 0, 0, 0]",1.6836064648932804e-07,1.57e-05,0,1.57e-05,MP,data/source/MP/cleaned/cifs/MP-mp-3804.cif,False,,data/final/MP/graphs/P2Ru2Sr1-MP-mp-3804.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Co1Zr3,1,0.0,2.0,False,Co2Zr6,Co2Zr6,3.6125,Other,True,Co25Zr75,Co-Zr,2,Supercon,Co1Zr3,MP-mp-30619,Zr6Co2,Co-Zr,Co25Zr75,C m c m,orthorhombic,3.2678779986361945,5.64053185,9.054345,data/final/MP/cifs/Co1Zr3-MP-mp-30619.cif,data/source/MP/raw/cifs/mp-30619.cif,mp-30619,0.0,,2014-02-24 05:11:15,6.915075692701918,10.17188/1205004,"@misc{osti_1205004,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Zr3Co (SG:63) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1205004"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671884'}},0.0,4.34528317,520.0,-67.1885383,-8.3985672875,"{'tags': ['Zirconium cobalt (3/1)', 'Cobalt zirconium (1/3)']}",-67.1885383,-8.3985672875,-0.2107123662500019,"['xas', 'elasticity', 'bandstructure']",True,"[625702, 625685, 102741]",True,2021-05-12 10:56:18.721000,NM,8,8,mp-30619,,Zr3Co,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Co'], 'pot_type': 'paw'}","{'Zr': 3.0, 'Co': 1.0}",GGA,mp-30619,"['mp-941299', 'mp-941614', 'mp-934852', 'mp-30619', 'mp-1300083', 'mp-1671884', 'mp-1787222', 'mp-1592089']",8.395e-05,"{'Zr': 6.0, 'Co': 2.0}",159.73908156479197,[],NM,False,63,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.0510890531938977e-06,8.395e-05,0,0.0001679,MP,data/source/MP/cleaned/cifs/MP-mp-30619.cif,False,,data/final/MP/graphs/Co1Zr3-MP-mp-30619.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Hf2Si1,1,0.0,2.0,False,Hf4Si2,Hf4Si2,0.0,Other,True,Hf66.667Si33.333,Hf-Si,2,Supercon,Hf2Si1,MP-mp-9938,Hf4Si2,Hf-Si,Hf66.667Si33.333,I 4/m c m,tetragonal,5.200229995684839,5.32811529025531,5.32811529,data/final/MP/cifs/Hf2Si1-MP-mp-9938.cif,data/source/MP/raw/cifs/mp-9938.cif,mp-9938,0.0,,2011-05-28 03:39:32,11.37026222989851,10.17188/1316999,"@misc{osti_1316999,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Hf2Si (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1316999"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698079'}},0.0,6.00829057,520.0,-55.14174066,-9.19029011,{'tags': ['Hafnium silicide (2/1)']},-55.14174066,-9.19029011,-0.7200595366666676,"['xas', 'elasticity', 'bandstructure']",True,"[638912, 42523]",True,2021-05-12 10:56:37.246000,NM,6,11,mp-9938,,Hf2Si,"{'functional': 'PBE', 'labels': ['Hf_pv', 'Si'], 'pot_type': 'paw'}","{'Hf': 2.0, 'Si': 1.0}",GGA,mp-9938,"['mp-9938', 'mp-924843', 'mp-925449', 'mp-909829', 'mp-1077444', 'mp-1124882', 'mp-1146417', 'mp-1430155', 'mp-1698079', 'mp-1804865', 'mp-1587638']",3.875e-05,"{'Hf': 4.0, 'Si': 2.0}",112.4716902779066,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0]",6.890622858828301e-07,3.875e-05,0,7.75e-05,MP,data/source/MP/cleaned/cifs/MP-mp-9938.cif,False,,data/final/MP/graphs/Hf2Si1-MP-mp-9938.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As1Fe1Tb1O1,1,0.0,2.0,False,As2Fe2Tb2O2,As2Fe2Tb2O2,0.0,Ferrite,True,As25Fe25Tb25O25,As-Fe-Tb-O,4,Supercon,Tb1Fe1As1O1,MP-mp-1079887,Tb2Fe2As2O2,As-Fe-Tb-O,As25Fe25Tb25O25,P 4/n m m,tetragonal,3.971557,3.971557,9.096524,data/final/MP/cifs/As1Fe1Tb1O1-MP-mp-1079887.cif,data/source/MP/raw/cifs/mp-1079887.cif,mp-1079887,0.0,,2018-04-16 16:53:03,7.075630957925009,,,{'GGA+U': {'task_id': 'mp-1697746'}},0.2848640540625,4.29262424,520.0,-53.1200584,-6.6400073,{'tags': []},-53.1200584,-6.6400073,-1.69789381,['bandstructure'],True,[422004],True,2021-05-12 10:58:16.596000,FM,8,5,mp-1079887,oxide,TbFeAsO,"{'functional': 'PBE', 'labels': ['Tb_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Tb': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-1079887,"['mp-1079887', 'mp-1418181', 'mp-1697746', 'mp-1779163', 'mp-1589035']",3.7855201,"{'Tb': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",143.48188366951112,[],FM,True,129,1,"[0.0, 0.0, 3.6, 3.6, 0.0, 0.0, 0.0, 0.0]",0.0527665235942869,3.7855201,2,7.5710402,MP,data/source/MP/cleaned/cifs/MP-mp-1079887.cif,False,,data/final/MP/graphs/As1Fe1Tb1O1-MP-mp-1079887.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
La0.02Os4Pr0.98Sb12,2,0.0023529411764705,1.0,True,La0.02Os4Pr0.98Sb12,Os4Pr1Sb12,1.8,Heavy_fermion,True,La0.118Os23.529Pr5.765Sb70.588,La-Os-Pr-Sb,4,Supercon,Pr0.98La0.02Os4Sb12,MP-mp-4251,Pr1Sb12Os4,Os-Pr-Sb,Os23.529Pr5.882Sb70.588,I m -3,cubic,8.16020751180899,8.16020751,8.16020751,data/final/MP/cifs/La0.02Os4Pr0.98Sb12-MP-mp-4251-synth_doped.cif,data/source/MP/raw/cifs/mp-4251.cif,mp-4251,0.0,,2011-05-15 09:44:04,9.380402650313032,10.17188/1208003,"@misc{osti_1208003,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Pr(Sb3Os)4 (SG:204) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208003"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700242'}},0.0086126564705901,7.28147826,520.0,-102.089288,-6.005252235294117,{'tags': ['Praseodymium osmium antimonide (1/4/12)']},-102.089288,-6.005252235294117,-0.1677005267647063,"['xas', 'elasticity', 'bandstructure']",True,"[155178, 155187, 165911, 155182, 155185, 155181, 647731, 155183, 155188, 155180, 155179, 165910, 155184, 155186, 183087]",True,2021-05-12 10:56:20.740000,NM,17,9,mp-4251,,Pr(Sb3Os)4,"{'functional': 'PBE', 'labels': ['Pr_3', 'Sb', 'Os_pv'], 'pot_type': 'paw'}","{'Pr': 1.0, 'Sb': 12.0, 'Os': 4.0}",GGA,mp-4251,"['mp-1000443', 'mp-1006919', 'mp-4251', 'mp-1188290', 'mp-1430112', 'mp-1700242', 'mp-1817791', 'mp-1011635', 'mp-1609307']",0.0526026,"{'Pr': 1.0, 'Sb': 12.0, 'Os': 4.0}",418.2940787754696,[],NM,False,204,0,"[-0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.000125755067234,0.0526026,0,0.0526026,MP,data/source/MP/cleaned/cifs/MP-mp-4251.cif,True,,data/final/MP/graphs/La0.02Os4Pr0.98Sb12-MP-mp-4251-synth_doped.json,0,True,m-3,2,0,0,0,0,0,0,0,0,1,0,1.0,False
Ce0.93Gd0.07Ru2,2,0.0466666666666666,2.0,False,Ce1.86Gd0.14Ru4,Ce2Ru4,3.38,Heavy_fermion,True,Ce31Gd2.333Ru66.667,Ce-Gd-Ru,3,Supercon,Ce0.93Gd0.07Ru2,MP-mp-607,Ce2Ru4,Ce-Ru,Ce33.333Ru66.667,F d -3 m,cubic,5.35903077,5.35903077,5.35903077,data/final/MP/cifs/Ce0.93Gd0.07Ru2-MP-mp-607-synth_doped.cif,data/source/MP/raw/cifs/mp-607.cif,mp-607,0.0,,2011-05-13 22:34:26,10.444470046690055,10.17188/1277529,"@misc{osti_1277529,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeRu2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277529"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686879'}},0.0,8.61419203,520.0,-50.66413619,-8.444022698333333,"{'tags': ['Cerium ruthenium (1/2)', 'Cerium ruthenium hydride (1/2/4)']}",-50.66413619,-8.444022698333333,-0.2833998766666663,"['xas', 'elasticity', 'bandstructure']",True,"[621326, 656077, 621978, 621973, 621980, 621984, 102277, 621972, 621976, 621979, 604113, 621977, 621982, 621983, 102276, 656078]",True,2021-05-12 10:56:27.046000,NM,6,14,mp-607,,CeRu2,"{'functional': 'PBE', 'labels': ['Ce', 'Ru_pv'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Ru': 2.0}",GGA,mp-607,"['mp-928203', 'mp-912221', 'mp-928809', 'mp-607', 'mp-1071462', 'mp-1071593', 'mp-1071613', 'mp-1077792', 'mp-1440763', 'mp-1686879', 'mp-1803198', 'mp-1591928', 'mp-1591642', 'mp-1071635']",1.005e-05,"{'Ce': 2.0, 'Ru': 4.0}",108.82877852828122,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",1.846937939745105e-07,1.005e-05,0,2.01e-05,MP,data/source/MP/cleaned/cifs/MP-mp-607.cif,True,,data/final/MP/graphs/Ce0.93Gd0.07Ru2-MP-mp-607-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ag0.76Se2Sn1.24,3,0.12,1.0,True,Ag0.76Se2Sn1.24,Ag1Se2Sn1,6.72,Other,True,Ag19Se50Sn31,Ag-Se-Sn,3,Supercon,Ag0.76Sn1.24Se2,MP-mp-1229011,Ag1Sn1Se2,Ag-Se-Sn,Ag25Se50Sn25,R -3 m,trigonal,4.0598026973764,4.0598026973764,7.0325229,data/final/MP/cifs/Ag0.76Se2Sn1.24-MP-mp-1229011-synth_doped.cif,data/source/MP/raw/cifs/mp-1229011.cif,mp-1229011,0.0,,2019-01-13 04:39:21.201000,6.746249424080593,,,{'GGA': {'task_id': 'mp-1766738'}},0.0,4.6965768,520.0,-14.98910359,-3.7472758975,{'tags': []},-14.98910359,-3.7472758975,-0.5247881940885413,['bandstructure'],True,[],True,2021-05-12 10:58:49.477000,NM,4,5,mp-1229011,,AgSnSe2,"{'functional': 'PBE', 'labels': ['Ag', 'Sn_d', 'Se'], 'pot_type': 'paw'}","{'Ag': 1.0, 'Sn': 1.0, 'Se': 2.0}",GGA,mp-1229011,"['mp-1229011', 'mp-1422543', 'mp-1766738', 'mp-1796245', 'mp-1612963']",0.0080447,"{'Ag': 1.0, 'Sn': 1.0, 'Se': 2.0}",94.64136915222257,[],NM,False,166,0,"[0, 0, 0, 0]",8.50019401881305e-05,0.0080447,0,0.0080447,MP,data/source/MP/cleaned/cifs/MP-mp-1229011.cif,True,,data/final/MP/graphs/Ag0.76Se2Sn1.24-MP-mp-1229011-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
In1Sb1,1,0.0,1.0,True,In1Sb1,In1Sb1,3.32,Other,True,In50Sb50,In-Sb,2,Supercon,In1Sb1,MP-mp-20012,In1Sb1,In-Sb,In50Sb50,F -4 3 m,cubic,4.69039626,4.69039626,4.69039626,data/final/MP/cifs/In1Sb1-MP-mp-20012.cif,data/source/MP/raw/cifs/mp-20012.cif,mp-20012,0.0,,2014-02-15 05:32:11,5.38405945918659,10.17188/1195188,"@misc{osti_1195188,
    author = ""Persson, Kristin"",
    title = ""Materials Data on InSb (SG:216) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195188"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686444'}},0.0,4.40912368,520.0,-7.10679177,-3.553395885,"{'tags': ['Indium antimonide - nanocrystalline', 'Indium antimonide', 'Indium antimonide (1/1)']}",-7.10679177,-3.553395885,-0.2090534000000001,"['eos', 'elasticity', 'bandstructure', 'xas']",True,"[640415, 44980, 162197, 162198, 640411, 181198, 640439, 53966, 640442, 162196, 640413, 24519, 640414, 640431, 44331, 640440, 640429, 640412, 640421, 190418, 640427, 640443, 640428, 41445, 640424, 640441]",True,2021-05-12 10:56:14.760000,NM,2,15,mp-20012,,InSb,"{'functional': 'PBE', 'labels': ['In_d', 'Sb'], 'pot_type': 'paw'}","{'In': 1.0, 'Sb': 1.0}",GGA,mp-20012,"['mp-920042', 'mp-919050', 'mp-906276', 'mp-20012', 'mp-1060934', 'mp-1060955', 'mp-1060990', 'mp-1141619', 'mp-1114742', 'mp-1440624', 'mp-1686444', 'mp-1800800', 'mp-1594006', 'mp-1593319', 'mp-1061000']",0.0020371,"{'In': 1.0, 'Sb': 1.0}",72.96483522814681,[],NM,False,216,0,"[0, 0]",2.791892825674704e-05,0.0020371,0,0.0020371,MP,data/source/MP/cleaned/cifs/MP-mp-20012.cif,False,,data/final/MP/graphs/In1Sb1-MP-mp-20012.json,0,True,-43m,5,0,0,0,0,0,0,0,0,0,1,1.0,False
Ba0.174Cu1La1.826O4,3,0.0497142857142857,1.0,True,Ba0.174Cu1La1.826O4,Cu1La2O4,0.0,Cuprate,True,Ba2.486Cu14.286La26.086O57.142857142857146,Ba-Cu-La-O,4,Supercon,La1.826Ba0.174Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ba0.174Cu1La1.826O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ba0.174Cu1La1.826O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ba2Cu2La2Ti1.85Zn0.15O10.86,3,0.0521739130434782,0.5,False,Ba1Cu1La1Ti0.925Zn0.075O5.43,Ba1Cu1La1Ti1O6,0.0,Cuprate,True,Ba10.604Cu10.604La10.604Ti9.809Zn0.795O57.582184517497346,Ba-Cu-La-Ti-Zn-O,6,Supercon,La2Ba2Cu2Ti1.85Zn0.15O10.86,MP-mp-1227852,Ba1La1Ti1Cu1O6,Ba-Cu-La-Ti-O,Ba10Cu10La10Ti10O60,F -4 3 m,cubic,5.61997722,5.619977219999999,5.619977219999999,data/final/MP/cifs/Ba2Cu2La2Ti1.85Zn0.15O10.86-MP-mp-1227852-synth_doped.cif,data/source/MP/raw/cifs/mp-1227852.cif,mp-1227852,0.0,,2019-01-13 03:38:10.917000,6.398590577851808,,,{'GGA': {'task_id': 'mp-1734188'}},0.1228187138579528,4.96777084,520.0,-72.7941219,-7.279412189999999,{'tags': []},-72.7941219,-7.279412189999999,-2.8378679248333327,['bandstructure'],True,[],True,2021-05-12 10:58:49.477000,FM,10,5,mp-1227852,oxide,BaLaTiCuO6,"{'functional': 'PBE', 'labels': ['Ba_sv', 'La', 'Ti_pv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 1.0, 'La': 1.0, 'Ti': 1.0, 'Cu': 1.0, 'O': 6.0}",GGA,mp-1227852,"['mp-1227852', 'mp-1389128', 'mp-1734188', 'mp-1805149', 'mp-1621737']",1.9113509,"{'Ba': 1.0, 'La': 1.0, 'Ti': 1.0, 'Cu': 1.0, 'O': 6.0}",125.51298752546604,[],FM,True,216,1,"[0.0, 0.0, 0.0, 0.9, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0152283117283954,1.9113509,1,1.9113509,MP,data/source/MP/cleaned/cifs/MP-mp-1227852.cif,True,,data/final/MP/graphs/Ba2Cu2La2Ti1.85Zn0.15O10.86-MP-mp-1227852-synth_doped.json,0,True,-43m,5,0,0,0,0,0,0,0,0,0,1,1.0,False
Ce1Co0.25In5Ir0.75,3,0.0714285714285714,1.0,True,Ce1Co0.25In5Ir0.75,Ce1In5Ir1,1.52,Heavy_fermion,True,Ce14.286Co3.571In71.429Ir10.714,Ce-Co-In-Ir,4,Supercon,Ce1Ir0.75Co0.25In5,MP-mp-20975,Ce1In5Ir1,Ce-In-Ir,Ce14.286In71.429Ir14.286,P 4/m m m,tetragonal,4.724199,4.724199,7.575801,data/final/MP/cifs/Ce1Co0.25In5Ir0.75-MP-mp-20975-synth_doped.cif,data/source/MP/raw/cifs/mp-20975.cif,mp-20975,0.0,,2014-02-21 16:15:16,8.902153726103897,10.17188/1196209,"@misc{osti_1196209,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeIn5Ir (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196209"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688300'}},0.0,8.1498488,520.0,-31.20695684,-4.458136691428572,{'tags': ['Cerium iridium indide (1/1/5)']},-31.20695684,-4.458136691428572,-0.3824312307142854,"['xas', 'bandstructure']",True,[150225],True,2021-05-12 10:56:57.051000,FM,7,8,mp-20975,,CeIn5Ir,"{'functional': 'PBE', 'labels': ['Ce', 'In_d', 'Ir'], 'pot_type': 'paw'}","{'Ce': 1.0, 'In': 5.0, 'Ir': 1.0}",GGA,mp-20975,"['mp-919528', 'mp-918523', 'mp-905302', 'mp-20975', 'mp-1300982', 'mp-1688300', 'mp-1832383', 'mp-1591628']",0.1040192,"{'Ce': 1.0, 'In': 5.0, 'Ir': 1.0}",169.077152414387,[],FM,True,123,1,"[0.1, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0006152173638757,0.1040192,1,0.1040192,MP,data/source/MP/cleaned/cifs/MP-mp-20975.cif,True,,data/final/MP/graphs/Ce1Co0.25In5Ir0.75-MP-mp-20975-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
As1Fe0.725Ir0.275Sm1O1,3,0.1375,2.0,False,As2Fe1.45Ir0.55Sm2O2,As2Fe2Sm2O2,0.0,Ferrite,True,As25Fe18.125Ir6.875Sm25O25,As-Fe-Ir-Sm-O,5,Supercon,Sm1Fe0.725Ir0.275As1O1,MP-mp-20349,Sm2Fe2As2O2,As-Fe-Sm-O,As25Fe25Sm25O25,P 4/n m m,tetragonal,4.026492,4.026492,9.046755,data/final/MP/cifs/As1Fe0.725Ir0.275Sm1O1-MP-mp-20349-synth_doped.cif,data/source/MP/raw/cifs/mp-20349.cif,mp-20349,0.0,,2014-02-19 11:24:42,6.727802583283198,,,{'GGA+U': {'task_id': 'mp-1695938'}},0.3015723809374986,3.77685593,520.0,-52.73407138,-6.5917589225,{'tags': ['Samarium iron arsenic oxide (1/1/1/1)']},-52.73407138,-6.5917589225,-1.6285904237499995,"['xas', 'elasticity', 'bandstructure']",True,"[236652, 236653, 422002, 163457, 163458]",True,2021-05-12 10:56:16.728000,FM,8,10,mp-20349,oxide,SmFeAsO,"{'functional': 'PBE', 'labels': ['Sm_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Sm': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-20349,"['mp-24944', 'mp-1078897', 'mp-1079866', 'mp-1173321', 'mp-20349', 'mp-1425472', 'mp-1695938', 'mp-1772503', 'mp-1789694', 'mp-1588381']",3.75729895,"{'Sm': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",146.67176231613362,[],FM,True,129,1,"[0.0, 0.0, 3.5, 3.5, -0.0, -0.0, -0.0, -0.0]",0.0512341147425717,3.75729895,2,7.5145979,MP,data/source/MP/cleaned/cifs/MP-mp-20349.cif,True,,data/final/MP/graphs/As1Fe0.725Ir0.275Sm1O1-MP-mp-20349-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Bi2Ca1Cu2Sr2O8.197,2,0.0120988791647473,1.9519867268512872,False,Bi3.904Ca1.952Cu3.904Sr3.904O16,Bi4Ca2Cu4Sr4O16,74.0,Cuprate,True,Bi13.16Ca6.58Cu13.16Sr13.16O53.9382772915707,Bi-Ca-Cu-Sr-O,5,Supercon,Bi2Sr2Ca1Cu2O8.197,MP-mp-1218930,Sr4Ca2Cu4Bi4O16,Bi-Ca-Cu-Sr-O,Bi13.333Ca6.667Cu13.333Sr13.333O53.333333333333336,C c c 2,orthorhombic,5.417115,5.472898000129128,16.11398919,data/final/MP/cifs/Bi2Ca1Cu2Sr2O8.197-MP-mp-1218930-synth_doped.cif,data/source/MP/raw/cifs/mp-1218930.cif,mp-1218930,0.0,,2019-01-12 20:01:06.544000,6.266668983881059,,,,0.039252223722225,4.51768334,520.0,-173.15021002,-5.771673667333333,{'tags': []},-173.15021002,-5.771673667333333,-2.074956548222222,[],False,[],True,2021-05-12 11:00:42.526000,NM,30,3,mp-1218930,oxide,Sr2CaCu2(BiO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",GGA,mp-1218930,"['mp-1218930', 'mp-1359698', 'mp-1817714']",0.00011165,"{'Sr': 4.0, 'Ca': 2.0, 'Cu': 4.0, 'Bi': 4.0, 'O': 16.0}",470.7976286073367,[],NM,False,37,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.743014544498498e-07,0.00011165,0,0.0002233,MP,data/source/MP/cleaned/cifs/MP-mp-1218930.cif,True,,data/final/MP/graphs/Bi2Ca1Cu2Sr2O8.197-MP-mp-1218930-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
N1U1,1,0.0,1.0,True,N1U1,N1U1,0.0,Heavy_fermion,True,N50U50,N-U,2,Supercon,N1U1,MP-mp-1865,U1N1,N-U,N50U50,F m -3 m,cubic,3.44553194,3.4455319399999995,3.4455319399999995,data/final/MP/cifs/N1U1-MP-mp-1865.cif,data/source/MP/raw/cifs/mp-1865.cif,mp-1865,0.0,,2011-05-12 18:31:14,14.469621169098868,10.17188/1193312,"@misc{osti_1193312,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UN (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1193312"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672619'}},0.0,12.17606097,520.0,-22.24701748,-11.12350874,"{'tags': ['Uranium nitride', 'Uranium nitride (1/1)', 'Uranium(III) nitride']}",-22.24701748,-11.12350874,-1.4900562725000004,"['xas', 'elasticity', 'bandstructure']",True,"[600794, 644837, 644829, 644823, 644808, 644830, 644819, 76476, 644827, 644834, 644816, 44358, 644807, 644825, 644803, 644813, 603010, 644822, 644841, 644833, 644826, 644835, 24220, 644839]",True,2021-05-12 10:56:14.760000,FM,2,10,mp-1865,,UN,"{'functional': 'PBE', 'labels': ['U', 'N'], 'pot_type': 'paw'}","{'U': 1.0, 'N': 1.0}",GGA,mp-1865,"['mp-992937', 'mp-990935', 'mp-1865', 'mp-541144', 'mp-1440720', 'mp-1672619', 'mp-1792102', 'mp-994252', 'mp-1593637', 'mp-1596907']",1.1262682,"{'U': 1.0, 'N': 1.0}",28.92369963860123,[],FM,True,225,1,"[1.1, 0.0]",0.0389392855710925,1.1262682,1,1.1262682,MP,data/source/MP/cleaned/cifs/MP-mp-1865.cif,False,,data/final/MP/graphs/N1U1-MP-mp-1865.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ba0.078Cu1La1.922O4,2,0.0222857142857142,1.0,True,Ba0.078Cu1La1.922O4,Cu1La2O4,24.95,Cuprate,True,Ba1.114Cu14.286La27.457O57.142857142857146,Ba-Cu-La-O,4,Supercon,La1.922Ba0.078Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ba0.078Cu1La1.922O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ba0.078Cu1La1.922O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Pd2Sn1Tm1,1,0.0,1.0,True,Pd2Sn1Tm1,Pd2Sn1Tm1,2.37,Other,True,Pd50Sn25Tm25,Pd-Sn-Tm,3,Supercon,Pd2Tm1Sn1,MP-mp-3942,Tm1Sn1Pd2,Pd-Sn-Tm,Pd50Sn25Tm25,F m -3 m,cubic,4.77064298,4.770642979999999,4.770642979999999,data/final/MP/cifs/Pd2Sn1Tm1-MP-mp-3942.cif,data/source/MP/raw/cifs/mp-3942.cif,mp-3942,0.0,,2011-05-13 00:00:19,10.8248958527586,10.17188/1207657,"@misc{osti_1207657,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TmSnPd2 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207657"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672030'}},0.0,6.40535208,520.0,-22.43391885,-5.6084797125,{'tags': ['Palladium tin thulium (2/1/1)']},-22.43391885,-5.6084797125,-0.8971869879166663,"['xas', 'bandstructure']",True,"[105696, 105695, 648940, 648942]",True,2021-05-12 10:57:08.928000,NM,4,8,mp-3942,,TmSnPd2,"{'functional': 'PBE', 'labels': ['Tm_3', 'Sn_d', 'Pd'], 'pot_type': 'paw'}","{'Tm': 1.0, 'Sn': 1.0, 'Pd': 2.0}",GGA,mp-3942,"['mp-993716', 'mp-991983', 'mp-3942', 'mp-1439481', 'mp-1672030', 'mp-1930727', 'mp-995008', 'mp-1589135']",0.000151,"{'Tm': 1.0, 'Sn': 1.0, 'Pd': 2.0}",76.77427979222992,[],NM,False,225,0,"[0, 0, 0, 0]",1.96680451329069e-06,0.000151,0,0.000151,MP,data/source/MP/cleaned/cifs/MP-mp-3942.cif,False,,data/final/MP/graphs/Pd2Sn1Tm1-MP-mp-3942.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ce0.11Cu1Sm1.89O4,2,0.0314285714285714,1.0,True,Ce0.11Cu1Sm1.89O4,Cu1Sm2O4,0.0,Cuprate,True,Ce1.571Cu14.286Sm27O57.142857142857146,Ce-Cu-Sm-O,4,Supercon,Sm1.89Ce0.11Cu1O4,MP-mp-4210,Sm2Cu1O4,Cu-Sm-O,Cu14.286Sm28.571O57.142857142857146,I 4/m m m,tetragonal,3.936481999770292,3.936481999770292,6.66682973,data/final/MP/cifs/Ce0.11Cu1Sm1.89O4-MP-mp-4210-synth_doped.cif,data/source/MP/raw/cifs/mp-4210.cif,mp-4210,0.0,,2011-05-13 10:20:22,7.575626216473968,10.17188/1207966,"@misc{osti_1207966,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sm2CuO4 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207966"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-670158'}},0.0084157301785579,3.24265454,520.0,-51.71666507,-7.38809501,"{'tags': ['Samarium cuprate', 'Disamarium copper oxide', 'Disamarium copper tetraoxide']}",-51.71666507,-7.38809501,-3.0194917299999995,"['xas', 'elasticity', 'bandstructure']",True,"[261378, 72243, 71182, 95371, 261377]",True,2021-05-12 10:56:20.740000,NM,7,8,mp-4210,oxide,Sm2CuO4,"{'functional': 'PBE', 'labels': ['Sm_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sm': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-4210,"['mp-660482', 'mp-670158', 'mp-4210', 'mp-1412888', 'mp-1702500', 'mp-1798108', 'mp-1589420', 'mp-688388']",0.0004776,"{'Sm': 2.0, 'Cu': 1.0, 'O': 4.0}",93.8732216032902,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",5.087712894507291e-06,0.0004776,0,0.0004776,MP,data/source/MP/cleaned/cifs/MP-mp-4210.cif,True,,data/final/MP/graphs/Ce0.11Cu1Sm1.89O4-MP-mp-4210-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ge1.92La1Pd2Sn0.08,2,0.032,1.0,True,Ge1.92La1Pd2Sn0.08,Ge2La1Pd2,1.44,Other,True,Ge38.4La20Pd40Sn1.6,Ge-La-Pd-Sn,4,Supercon,La1Pd2Ge1.92Sn0.08,MP-mp-21033,La1Ge2Pd2,Ge-La-Pd,Ge40La20Pd40,I 4/m m m,tetragonal,4.421290001597606,4.421290001597606,5.97061441,data/final/MP/cifs/Ge1.92La1Pd2Sn0.08-MP-mp-21033-synth_doped.cif,data/source/MP/raw/cifs/mp-21033.cif,mp-21033,0.0,,2014-02-21 11:30:39,8.300326005582953,10.17188/1196295,"@misc{osti_1196295,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La(GePd)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196295"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701817'}},0.0,6.14890347,520.0,-28.82817588,-5.765635176,{'tags': ['Lanthanum palladium germanide (1/2/2)']},-28.82817588,-5.765635176,-0.8572698889999998,"['xas', 'bandstructure']",True,"[81760, 53662]",True,2021-05-12 10:56:57.051000,NM,5,8,mp-21033,,La(GePd)2,"{'functional': 'PBE', 'labels': ['La', 'Ge_d', 'Pd'], 'pot_type': 'paw'}","{'La': 1.0, 'Ge': 2.0, 'Pd': 2.0}",GGA,mp-21033,"['mp-990571', 'mp-992631', 'mp-21033', 'mp-1438097', 'mp-1701817', 'mp-1796178', 'mp-994077', 'mp-1596763']",0.0004025,"{'La': 1.0, 'Ge': 2.0, 'Pd': 2.0}",99.4334691764027,[],NM,False,139,0,"[0, 0, 0, 0, 0]",4.047932786956611e-06,0.0004025,0,0.0004025,MP,data/source/MP/cleaned/cifs/MP-mp-21033.cif,True,,data/final/MP/graphs/Ge1.92La1Pd2Sn0.08-MP-mp-21033-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B2Cu0.03Mg0.97,2,0.02,1.0,True,B2Cu0.03Mg0.97,B2Mg1,37.58,Other,True,B66.667Cu1Mg32.333,B-Cu-Mg,3,Supercon,Mg0.97Cu0.03B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B2Cu0.03Mg0.97-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B2Cu0.03Mg0.97-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ba6.63Si46,3,0.0337667272875328,0.2609023542527379,False,Ba1.73Si12,Ba2Si12,6.0,Other,True,Ba12.597Si87.403,Ba-Si,2,Supercon,Ba6.63Si46,MP-mp-1480,Ba2Si12,Ba-Si,Ba14.286Si85.714,C m c m,orthorhombic,4.504218002155348,5.70181207,12.007895,data/final/MP/cifs/Ba6.63Si46-MP-mp-1480-synth_doped.cif,data/source/MP/raw/cifs/mp-1480.cif,mp-1480,0.0,,2011-05-13 14:58:38,3.5851357009979075,10.17188/1190902,"@misc{osti_1190902,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BaSi6 (SG:63) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1190902"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1676787'}},0.1132404973214287,6.94706542,520.0,-70.08572671,-5.006123336428572,{'tags': ['Barium hexasilicide']},-70.08572671,-5.006123336428572,-0.020858343571429,"['xas', 'bandstructure']",True,"[245296, 245295, 710014]",True,2021-05-12 10:56:53.126000,NM,14,11,mp-1480,,BaSi6,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Si'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Si': 6.0}",GGA,mp-1480,"['mp-915185', 'mp-1001475', 'mp-1001236', 'mp-1480', 'mp-1143447', 'mp-1264071', 'mp-1381521', 'mp-1676787', 'mp-1925742', 'mp-1007985', 'mp-1604242']",0.0011983,"{'Ba': 2.0, 'Si': 12.0}",283.3138327163368,[],NM,False,63,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",8.459170443680933e-06,0.0011983,0,0.0023966,MP,data/source/MP/cleaned/cifs/MP-mp-1480.cif,True,,data/final/MP/graphs/Ba6.63Si46-MP-mp-1480-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Pd34Zr66,2,0.0133333333333333,0.0294104278074866,False,Pd1Zr1.941,Pd1Zr2,2.1,Other,True,Pd34Zr66,Pd-Zr,2,Supercon,Pd34Zr66,MP-mp-266,Zr2Pd1,Pd-Zr,Pd33.333Zr66.667,I 4/m m m,tetragonal,3.3580019980484703,3.3580019980484703,5.91909309,data/final/MP/cifs/Pd34Zr66-MP-mp-266-synth_doped.cif,data/source/MP/raw/cifs/mp-266.cif,mp-266,0.0,,2011-05-12 21:30:36,7.845685271874635,10.17188/1201202,"@misc{osti_1201202,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Zr2Pd (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201202"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688097'}},0.0,4.68790204,520.0,-23.73938079,-7.91312693,"{'tags': ['Palladium zirconium (1/2)', 'Palladium zironium hydride (1/2/2)']}",-23.73938079,-7.91312693,-0.4880325733333326,"['xas', 'elasticity', 'bandstructure']",True,"[601954, 649146, 105758, 186412, 649158, 109133]",True,2021-05-12 10:56:18.721000,NM,3,12,mp-266,,Zr2Pd,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Pd'], 'pot_type': 'paw'}","{'Zr': 2.0, 'Pd': 1.0}",GGA,mp-266,"['mp-914366', 'mp-977842', 'mp-266', 'mp-1062819', 'mp-1062894', 'mp-1062980', 'mp-1442272', 'mp-1688097', 'mp-1784401', 'mp-992491', 'mp-1591765', 'mp-1062949']",0.0017364,"{'Zr': 2.0, 'Pd': 1.0}",61.13890405598638,[],NM,False,139,0,"[0, 0, 0]",2.8400901632288605e-05,0.0017364,0,0.0017364,MP,data/source/MP/cleaned/cifs/MP-mp-266.cif,True,,data/final/MP/graphs/Pd34Zr66-MP-mp-266-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Nb2Pd1S5,1,0.0,2.0,False,Nb4Pd2S10,Nb4Pd2S10,6.125,Other,True,Nb25Pd12.5S62.5,Nb-Pd-S,3,Supercon,Nb2Pd1S5,MP-mp-1106085,Nb4Pd2S10,Nb-Pd-S,Nb25Pd12.5S62.5,C 1 2/m 1,monoclinic,3.3088259986599216,6.49739753,15.351821188786069,data/final/MP/cifs/Nb2Pd1S5-MP-mp-1106085.cif,data/source/MP/raw/cifs/mp-1106085.cif,mp-1106085,0.0,,2018-07-19 07:44:07,4.819550246699422,,,{'GGA': {'task_id': 'mp-1672432'}},0.0,4.44791447,520.0,-105.94045772,-6.6212786075,{'tags': ['Niobium palladium sulfide (2/1/5)']},-105.94045772,-6.6212786075,-1.1775609544531251,['bandstructure'],True,[192215],True,2021-05-12 10:58:22.271000,NM,16,5,mp-1106085,,Nb2PdS5,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Pd', 'S'], 'pot_type': 'paw'}","{'Nb': 2.0, 'Pd': 1.0, 'S': 5.0}",GGA,mp-1106085,"['mp-1106085', 'mp-1418134', 'mp-1672432', 'mp-1809763', 'mp-1603059']",0.0001527,"{'Nb': 4.0, 'Pd': 2.0, 'S': 10.0}",311.8506092503674,[],NM,False,12,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",9.79315066063608e-07,0.0001527,0,0.0003054,MP,data/source/MP/cleaned/cifs/MP-mp-1106085.cif,False,,data/final/MP/graphs/Nb2Pd1S5-MP-mp-1106085.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
Ca1Pd2,1,0.0,2.0,False,Ca2Pd4,Ca2Pd4,0.0,Other,True,Ca33.333Pd66.667,Ca-Pd,2,Supercon,Ca1Pd2,MP-mp-833,Ca2Pd4,Ca-Pd,Ca33.333Pd66.667,F d -3 m,cubic,5.48323549,5.48323549,5.48323549,data/final/MP/cifs/Ca1Pd2-MP-mp-833.cif,data/source/MP/raw/cifs/mp-833.cif,mp-833,0.0,,2011-05-13 08:13:51,7.205483615440915,10.17188/1308039,"@misc{osti_1308039,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CaPd2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1308039"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1694991'}},0.0,4.21952839,520.0,-28.89545698,-4.8159094966666665,{'tags': ['Calcium palladium (1/2)']},-28.89545698,-4.8159094966666665,-0.6941216633333328,"['bandstructure', 'elasticity']",True,"[619495, 58927]",True,2021-05-12 10:56:31.128000,NM,6,8,mp-833,,CaPd2,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Pd'], 'pot_type': 'paw'}","{'Ca': 1.0, 'Pd': 2.0}",GGA,mp-833,"['mp-912150', 'mp-928755', 'mp-928231', 'mp-833', 'mp-1432690', 'mp-1694991', 'mp-1805427', 'mp-1592763']",0.0016006,"{'Ca': 2.0, 'Pd': 4.0}",116.57238904723802,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",2.7461048247907097e-05,0.0016006,0,0.0032012,MP,data/source/MP/cleaned/cifs/MP-mp-833.cif,False,,data/final/MP/graphs/Ca1Pd2-MP-mp-833.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Te1Th1,1,0.0,1.0,True,Te1Th1,Te1Th1,0.0,Other,True,Te50Th50,Te-Th,2,Supercon,Te1Th1,MP-mp-1921,Th1Te1,Te-Th,Te50Th50,P m -3 m,cubic,3.851567,3.851567,3.851567,data/final/MP/cifs/Te1Th1-MP-mp-1921.cif,data/source/MP/raw/cifs/mp-1921.cif,mp-1921,0.0,,2011-05-12 18:19:30,10.452071515861466,10.17188/1194059,"@misc{osti_1194059,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ThTe (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1194059"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686441'}},0.0,9.24346348,520.0,-12.75786071,-6.378930355,"{'tags': ['Thorium(II) telluride', 'Thorium telluride (1/1)']}",-12.75786071,-6.378930355,-1.3113507650000005,"['xas', 'elasticity', 'bandstructure']",True,"[653061, 653065, 106140, 33586]",True,2021-05-12 10:56:14.760000,NM,2,8,mp-1921,,ThTe,"{'functional': 'PBE', 'labels': ['Th', 'Te'], 'pot_type': 'paw'}","{'Th': 1.0, 'Te': 1.0}",GGA,mp-1921,"['mp-921956', 'mp-907572', 'mp-922199', 'mp-1921', 'mp-1440209', 'mp-1686441', 'mp-1794717', 'mp-1589215']",0.0001492,"{'Th': 1.0, 'Te': 1.0}",57.13633393724571,[],NM,False,221,0,"[0, 0]",2.611298095601831e-06,0.0001492,0,0.0001492,MP,data/source/MP/cleaned/cifs/MP-mp-1921.cif,False,,data/final/MP/graphs/Te1Th1-MP-mp-1921.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ir0.5Os0.5,1,0.0,2.0,False,Ir1Os1,Ir1Os1,1.69,Other,True,Ir50Os50,Ir-Os,2,Supercon,Ir0.5Os0.5,MP-mp-1223655,Ir1Os1,Ir-Os,Ir50Os50,P -6 m 2,hexagonal,2.757122004537326,2.7571222700000004,4.390348,data/final/MP/cifs/Ir0.5Os0.5-MP-mp-1223655.cif,data/source/MP/raw/cifs/mp-1223655.cif,mp-1223655,0.0,,2019-01-13 00:01:13.493000,21.97246368698792,,,{'GGA': {'task_id': 'mp-1674572'}},0.0160748925000007,9.55234517,520.0,-20.03364689,-10.016823445,{'tags': []},-20.03364689,-10.016823445,0.0160748925000007,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,2,5,mp-1223655,,IrOs,"{'functional': 'PBE', 'labels': ['Ir', 'Os_pv'], 'pot_type': 'paw'}","{'Ir': 1.0, 'Os': 1.0}",GGA,mp-1223655,"['mp-1223655', 'mp-1382096', 'mp-1674572', 'mp-1790799', 'mp-1610980']",0.0005855,"{'Ir': 1.0, 'Os': 1.0}",28.902912001627616,[],NM,False,187,0,"[0, 0]",2.0257474401438464e-05,0.0005855,0,0.0005855,MP,data/source/MP/cleaned/cifs/MP-mp-1223655.cif,False,,data/final/MP/graphs/Ir0.5Os0.5-MP-mp-1223655.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Ni16Si7Ti6,1,0.0,1.0,True,Ni16Si7Ti6,Ni16Si7Ti6,0.0,Other,True,Ni55.172Si24.138Ti20.69,Ni-Si-Ti,3,Supercon,Ti6Ni16Si7,MP-mp-3337,Ti6Si7Ni16,Ni-Si-Ti,Ni55.172Si24.138Ti20.69,F m -3 m,cubic,7.89981817,7.899818169999999,7.89981817,data/final/MP/cifs/Ni16Si7Ti6-MP-mp-3337.cif,data/source/MP/raw/cifs/mp-3337.cif,mp-3337,0.0,,2011-05-24 12:50:58,6.777751345001477,10.17188/1206569,"@misc{osti_1206569,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ti6Si7Ni16 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1206569"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1674757'}},0.0,8.76566553,520.0,-198.22781524,-6.8354419048275865,"{'tags': ['Nickel titanium silicide (16/6/7)', 'Titanium nickel silicide (6/16/7)']}",-198.22781524,-6.8354419048275865,-0.6861544179310343,"['xas', 'bandstructure']",True,"[646625, 109221, 159263, 646628]",True,2021-05-12 10:57:06.958000,NM,29,11,mp-3337,,Ti6Si7Ni16,"{'functional': 'PBE', 'labels': ['Ti_pv', 'Si', 'Ni_pv'], 'pot_type': 'paw'}","{'Ti': 6.0, 'Si': 7.0, 'Ni': 16.0}",GGA,mp-3337,"['mp-929682', 'mp-913150', 'mp-930190', 'mp-3337', 'mp-1125155', 'mp-1136292', 'mp-1249631', 'mp-1417501', 'mp-1674757', 'mp-1840581', 'mp-1611695']",0.0001364,"{'Ti': 6.0, 'Si': 7.0, 'Ni': 16.0}",348.60714842518104,[],NM,False,225,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.912713798789887e-07,0.0001364,0,0.0001364,MP,data/source/MP/cleaned/cifs/MP-mp-3337.cif,False,,data/final/MP/graphs/Ni16Si7Ti6-MP-mp-3337.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Mg6Ni16Si7,1,0.0,1.0,True,Mg6Ni16Si7,Mg6Ni16Si7,0.0,Other,True,Mg20.69Ni55.172Si24.138,Mg-Ni-Si,3,Supercon,Mg6Ni16Si7,MP-mp-570457,Mg6Si7Ni16,Mg-Ni-Si,Mg20.69Ni55.172Si24.138,F m -3 m,cubic,7.98776246,7.987762459999999,7.987762459999999,data/final/MP/cifs/Mg6Ni16Si7-MP-mp-570457.cif,data/source/MP/raw/cifs/mp-570457.cif,mp-570457,0.0,,2014-03-04 09:07:07,5.904933932618309,10.17188/1275717,"@misc{osti_1275717,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Mg6Si7Ni16 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1275717"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",,0.0,8.0803868,520.0,-155.91309225,-5.376313525862069,{'tags': ['Magnesium nickel silicide (6/16/7)']},-155.91309225,-5.376313525862069,-0.5294836872413786,['xas'],False,"[239184, 159261]",True,2021-05-12 10:57:24.969000,NM,29,6,mp-570457,,Mg6Si7Ni16,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Si', 'Ni_pv'], 'pot_type': 'paw'}","{'Mg': 6.0, 'Si': 7.0, 'Ni': 16.0}",GGA,mp-570457,"['mp-914952', 'mp-570457', 'mp-1156841', 'mp-1192777', 'mp-1430013', 'mp-1844137']",0.003751,"{'Mg': 6.0, 'Si': 7.0, 'Ni': 16.0}",360.3797882373494,[],NM,False,225,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.0408463855163702e-05,0.003751,0,0.003751,MP,data/source/MP/cleaned/cifs/MP-mp-570457.cif,False,,data/final/MP/graphs/Mg6Ni16Si7-MP-mp-570457.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Gd0.04In1La2.96,2,0.02,1.0,True,Gd0.04In1La2.96,In1La3,6.04,Other,True,Gd1In25La74,Gd-In-La,3,Supercon,La2.9602Gd0.0398In1,MP-mp-20909,La3In1,In-La,In25La75,P m -3 m,cubic,5.076766,5.076766,5.076766,data/final/MP/cifs/Gd0.04In1La2.96-MP-mp-20909-synth_doped.cif,data/source/MP/raw/cifs/mp-20909.cif,mp-20909,0.0,,2014-02-21 06:52:52,6.7455760598452565,10.17188/1196104,"@misc{osti_1196104,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La3In (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196104"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671685'}},0.0,8.16935076,520.0,-18.73796121,-4.6844903025,"{'tags': ['Indium lanthanum (1/3)', 'Lanthanum indium (3/1)']}",-18.73796121,-4.6844903025,-0.2945640412500001,"['xas', 'bandstructure']",True,"[639844, 51950, 639851, 639840, 603208, 107019]",True,2021-05-12 10:56:57.051000,NM,4,8,mp-20909,,La3In,"{'functional': 'PBE', 'labels': ['La', 'In_d'], 'pot_type': 'paw'}","{'La': 3.0, 'In': 1.0}",GGA,mp-20909,"['mp-906743', 'mp-921394', 'mp-920373', 'mp-20909', 'mp-1476042', 'mp-1671685', 'mp-1778647', 'mp-1590323']",0.0489742,"{'La': 3.0, 'In': 1.0}",130.84629766481785,[],NM,False,221,0,"[0, 0, 0, 0]",0.0003742880071811,0.0489742,0,0.0489742,MP,data/source/MP/cleaned/cifs/MP-mp-20909.cif,True,,data/final/MP/graphs/Gd0.04In1La2.96-MP-mp-20909-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
La0.7Pb3Pr0.3,3,0.15,1.0,True,La0.7Pb3Pr0.3,La1Pb3,0.37,Other,True,La17.5Pb75Pr7.5,La-Pb-Pr,3,Supercon,La0.7Pr0.3Pb3,MP-mp-21432,La1Pb3,La-Pb,La25Pb75,P m -3 m,cubic,4.968277,4.968277,4.968277,data/final/MP/cifs/La0.7Pb3Pr0.3-MP-mp-21432-synth_doped.cif,data/source/MP/raw/cifs/mp-21432.cif,mp-21432,0.0,,2014-02-21 08:53:02,10.297552988886016,10.17188/1196890,"@misc{osti_1196890,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaPb3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196890"",
    place = ""United States"",
    year = ""2016"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687535'}},0.0,7.94036935,520.0,-17.86283558,-4.465708895,{'tags': ['Lanthanum lead (1/3)']},-17.86283558,-4.465708895,-0.447221816249999,"['xas', 'elasticity', 'bandstructure']",True,"[641644, 104691, 641647, 641640, 104692, 151360]",True,2021-05-12 10:56:16.728000,NM,4,8,mp-21432,,LaPb3,"{'functional': 'PBE', 'labels': ['La', 'Pb_d'], 'pot_type': 'paw'}","{'La': 1.0, 'Pb': 3.0}",GGA,mp-21432,"['mp-993074', 'mp-991107', 'mp-21432', 'mp-1439281', 'mp-1687535', 'mp-1784789', 'mp-994394', 'mp-1589043']",0.0017048,"{'La': 1.0, 'Pb': 3.0}",122.63583830653424,[],NM,False,221,0,"[0, 0, 0, 0]",1.3901319740961604e-05,0.0017048,0,0.0017048,MP,data/source/MP/cleaned/cifs/MP-mp-21432.cif,True,,data/final/MP/graphs/La0.7Pb3Pr0.3-MP-mp-21432-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
As1Ce1F0.2Fe1O0.8,3,0.0999999999999999,2.0,False,As2Ce2F0.4Fe2O1.6,As2Ce2Fe2O2,40.4,Ferrite,True,As25Ce25F5Fe25O20,As-Ce-F-Fe-O,5,Supercon,Ce1Fe1As1F0.2O0.8,MP-mp-605060,Ce2Fe2As2O2,As-Ce-Fe-O,As25Ce25Fe25O25,P 4 m m,tetragonal,3.992256,3.992256,9.041971,data/final/MP/cifs/As1Ce1F0.2Fe1O0.8-MP-mp-605060-synth_doped.cif,data/source/MP/raw/cifs/mp-605060.cif,mp-605060,0.0,,2014-02-14 20:12:08,6.611233843492404,10.17188/1277425,"@misc{osti_1277425,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeFeAsO (SG:99) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277425"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-1751604'}},0.2072581873958352,6.30288445,520.0,-55.74271596,-6.967839495,{'tags': []},-55.74271596,-6.967839495,-1.7010452412499992,['bandstructure'],True,[],True,2021-05-12 10:58:51.532000,FiM,8,10,mp-605060,oxide,CeFeAsO,"{'functional': 'PBE', 'labels': ['Ce', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-605060,"['mp-605060', 'mp-917114', 'mp-918266', 'mp-919274', 'mp-1443189', 'mp-1751604', 'mp-1770633', 'mp-1779614', 'mp-1873964', 'mp-1622328']",2.99945325,"{'Ce': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",144.11191005541338,[],FiM,True,99,3,"[-0.5, -0.5, 3.5, 3.5, 0.0, 0.0, 0.0, 0.0]",0.0416267225775671,2.99945325,4,5.9989065,MP,data/source/MP/cleaned/cifs/MP-mp-605060.cif,True,,data/final/MP/graphs/As1Ce1F0.2Fe1O0.8-MP-mp-605060-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
Cr3O1,1,0.0,2.0,False,Cr6O2,Cr6O2,0.0,Oxide,True,Cr75O25,Cr-O,2,Supercon,Cr3O1,MP-mp-714896,Cr6O2,Cr-O,Cr75O25,R -3 c,trigonal,5.4932443391768935,5.4932443391768935,5.66676699,data/final/MP/cifs/Cr3O1-MP-mp-714896.cif,data/source/MP/raw/cifs/mp-714896.cif,mp-714896,0.0,,2013-12-31 06:53:50,4.654227733984328,10.17188/1286643,"@misc{osti_1286643,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Cr3O (SG:167) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1286643"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-1754959'}},1.0681918845833316,4.47026978,520.0,-53.78929765,-6.72366220625,{'tags': []},-53.78929765,-6.72366220625,0.0821136474999999,['bandstructure'],True,[],True,2021-05-12 10:58:53.520000,FM,8,9,mp-714896,oxide,Cr3O,"{'functional': 'PBE', 'labels': ['Cr_pv', 'O'], 'pot_type': 'paw'}","{'Cr': 3.0, 'O': 1.0}",GGA+U,mp-714896,"['mp-714896', 'mp-870263', 'mp-870491', 'mp-1395216', 'mp-1754959', 'mp-1771586', 'mp-1879278', 'mp-870762', 'mp-1618694']",13.1860074,"{'Cr': 6.0, 'O': 2.0}",122.72381634415416,[],FM,True,167,1,"[4.1, 4.1, 4.1, 4.1, 4.1, 4.1, -0.0, -0.0]",0.2148891355044322,13.1860074,6,26.3720148,MP,data/source/MP/cleaned/cifs/MP-mp-714896.cif,False,,data/final/MP/graphs/Cr3O1-MP-mp-714896.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ni20Zr80,1,0.0,0.1,False,Ni2Zr8,Ni2Zr8,3.53,Other,True,Ni20Zr80,Ni-Zr,2,Supercon,Ni20Zr80,MP-mp-1207489,Zr8Ni2,Ni-Zr,Ni20Zr80,F d -3 m,cubic,6.93639791,6.936397909999999,6.936397909999999,data/final/MP/cifs/Ni20Zr80-MP-mp-1207489.cif,data/source/MP/raw/cifs/mp-1207489.cif,mp-1207489,0.0,,2019-01-12 10:35:20.488000,5.961247843081591,,,,0.6438371240000009,3.76356076,520.0,-75.44189697,-7.544189697,"{'tags': ['ZrNi2', 'MgCu2', 'Friauf-Laves phase, Frank-Kasper phase']}",-75.44189697,-7.544189697,0.4499981429999991,[],False,[],True,2021-05-12 11:00:19.396000,NM,10,2,mp-1207489,,Zr4Ni,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Ni_pv'], 'pot_type': 'paw'}","{'Zr': 4.0, 'Ni': 1.0}",GGA,mp-1207489,"['mp-1207489', 'mp-1879293']",0.00107465,"{'Zr': 8.0, 'Ni': 2.0}",235.9864127152436,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",9.107727751230676e-06,0.00107465,0,0.0021493,MP,data/source/MP/cleaned/cifs/MP-mp-1207489.cif,False,,data/final/MP/graphs/Ni20Zr80-MP-mp-1207489.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Zn1,1,0.0,2.0,False,Zn2,Zn2,0.8508,Other,True,Zn100,Zn,1,Supercon,Zn1,MP-mp-79,Zn2,Zn,Zn100,P 63/m m c,hexagonal,2.626729995067967,2.6267309400000003,5.207234,data/final/MP/cifs/Zn1-MP-mp-79.cif,data/source/MP/raw/cifs/mp-79.cif,mp-79,0.0,,2011-05-12 19:28:50,6.981484851061407,10.17188/1307804,"@misc{osti_1307804,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Zn (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1307804"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1670900'}},0.0,2.8517219,520.0,-2.51948722,-1.25974361,"{'tags': ['Zinc', 'Zinc - nanocrystalline']}",-2.51948722,-1.25974361,0.0,"['eos', 'elasticity', 'bandstructure', 'surfaces']",True,"[247149, 52259, 421013, 247158, 247155, 247152, 236395, 53769, 247161, 653505, 247151, 247160, 247147, 247156, 653504, 247162, 426987, 52543, 247153, 421014, 653502, 653501, 421015, 247159, 181734, 247148, 247150, 64990, 247157, 247154]",True,2021-05-12 10:56:31.128000,NM,2,17,mp-79,,Zn,"{'functional': 'PBE', 'labels': ['Zn'], 'pot_type': 'paw'}",{'Zn': 1.0},GGA,mp-79,"['mp-988029', 'mp-79', 'mp-987170', 'mp-1057694', 'mp-1057726', 'mp-1057769', 'mp-1060154', 'mp-1060176', 'mp-1060230', 'mp-1440632', 'mp-1670900', 'mp-1791402', 'mp-988275', 'mp-1595491', 'mp-1594767', 'mp-1057746', 'mp-1060207']",0.00031825,{'Zn': 2.0},31.114928163376767,[],NM,False,194,0,"[0, 0]",2.045641875365729e-05,0.00031825,0,0.0006365,MP,data/source/MP/cleaned/cifs/MP-mp-79.cif,False,,data/final/MP/graphs/Zn1-MP-mp-79.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
B2C1Ni1.7Pd0.3Y1,3,0.1,1.0,True,B2C1Ni1.7Pd0.3Y1,B2C1Ni2Y1,10.7,Other,True,B33.333C16.667Ni28.333Pd5Y16.667,B-C-Ni-Pd-Y,5,Supercon,Y1Ni1.7Pd0.3B2C1,MP-mp-6576,Y1Ni2B2C1,B-C-Ni-Y,B33.333C16.667Ni33.333Y16.667,I 4/m m m,tetragonal,3.548790000501972,3.548790000501972,5.76144136,data/final/MP/cifs/B2C1Ni1.7Pd0.3Y1-MP-mp-6576-synth_doped.cif,data/source/MP/raw/cifs/mp-6576.cif,mp-6576,0.0,,2011-05-13 05:21:43,6.099730998852292,10.17188/1281366,"@misc{osti_1281366,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281366"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688230'}},0.0,6.81083016,520.0,-43.677878,-7.279646333333333,{'tags': []},-43.677878,-7.279646333333333,-0.5109282141666659,"['xas', 'bandstructure']",True,"[75816, 89142, 83231, 79574, 41549]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6576,,YNi2B2C,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6576,"['mp-6576', 'mp-1007054', 'mp-1000583', 'mp-1439516', 'mp-1688230', 'mp-1794280', 'mp-1011792', 'mp-1597064']",0.0006603,"{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.3152437079014,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",1.010943177297096e-05,0.0006603,0,0.0006603,MP,data/source/MP/cleaned/cifs/MP-mp-6576.cif,True,,data/final/MP/graphs/B2C1Ni1.7Pd0.3Y1-MP-mp-6576-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Cu2Mg1,1,0.0,2.0,False,Cu4Mg2,Cu4Mg2,0.0,Other,True,Cu66.667Mg33.333,Cu-Mg,2,Supercon,Cu2Mg1,MP-mp-1038,Mg2Cu4,Cu-Mg,Cu66.667Mg33.333,F d -3 m,cubic,4.96317401,4.96317401,4.96317401,data/final/MP/cifs/Cu2Mg1-MP-mp-1038.cif,data/source/MP/raw/cifs/mp-1038.cif,mp-1038,0.0,,2011-05-14 00:51:33,5.816113247109954,10.17188/1187054,"@misc{osti_1187054,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MgCu2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187054"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688449'}},0.0,5.74216182,520.0,-20.44588475,-3.4076474583333334,"{'tags': ['Magnesium cupride (1/2)', 'Magnesium copper (1/2)', 'Copper magnesium (2/1)']}",-20.44588475,-3.4076474583333334,-0.1414163283333334,"['xas', 'elasticity', 'bandstructure']",True,"[628325, 174177, 108388, 628329, 628327, 103048, 163699, 628324, 46007, 108142, 174174, 247836, 174171, 655138]",True,2021-05-12 10:56:10.715000,NM,6,8,mp-1038,,MgCu2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Cu_pv'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Cu': 2.0}",GGA,mp-1038,"['mp-919142', 'mp-906396', 'mp-920170', 'mp-1038', 'mp-1077333', 'mp-1440906', 'mp-1688449', 'mp-1798746']",0.00011575,"{'Mg': 2.0, 'Cu': 4.0}",86.44970356825907,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",2.677857649531579e-06,0.00011575,0,0.0002315,MP,data/source/MP/cleaned/cifs/MP-mp-1038.cif,False,,data/final/MP/graphs/Cu2Mg1-MP-mp-1038.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Cu1Dy2O4,1,0.0,2.0,False,Cu2Dy4O8,Cu2Dy4O8,0.0,Cuprate,True,Cu14.286Dy28.571O57.142857142857146,Cu-Dy-O,3,Supercon,Dy2Cu1O4,MP-mp-752673,Dy4Cu2O8,Cu-Dy-O,Cu14.286Dy28.571O57.142857142857146,C m c a,orthorhombic,5.490769,5.4942379978737,6.53614336,data/final/MP/cifs/Cu1Dy2O4-MP-mp-752673.cif,data/source/MP/raw/cifs/mp-752673.cif,mp-752673,0.0,,2014-02-14 20:03:10,8.400107964233438,10.17188/1288725,"@misc{osti_1288725,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Dy2CuO4 (SG:64) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1288725"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1737246'}},0.0235548657142787,3.52108188,520.0,-104.25147294,-7.446533781428571,{'tags': []},-104.25147294,-7.446533781428571,-3.1098731571428573,['bandstructure'],True,[],True,2021-05-12 10:58:55.498000,NM,14,7,mp-752673,oxide,Dy2CuO4,"{'functional': 'PBE', 'labels': ['Dy_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Dy': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-752673,"['mp-752673', 'mp-851337', 'mp-853362', 'mp-1443656', 'mp-1737246', 'mp-1827303', 'mp-854154']",0.00094255,"{'Dy': 4.0, 'Cu': 2.0, 'O': 8.0}",178.91825446516856,[],NM,False,12,0,"[0.0, 0.0, 0.0, 0.0, 0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",1.0536096529865194e-05,0.00094255,0,0.0018851,MP,data/source/MP/cleaned/cifs/MP-mp-752673.cif,False,,data/final/MP/graphs/Cu1Dy2O4-MP-mp-752673.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Be0.95Pt0.005,3,0.1433749496576723,12.61578947368421,False,Be12Pt0.063,Be12Pt1,0.0,Other,True,Be99.476Pt0.524,Be-Pt,2,Supercon,Be0.95Pt0.005,MP-mp-571622,Be12Pt1,Be-Pt,Be92.308Pt7.692,I 4/m m m,tetragonal,4.170970000179409,5.537376450774136,5.53737645,data/final/MP/cifs/Be0.95Pt0.005-MP-mp-571622-synth_doped.cif,data/source/MP/raw/cifs/mp-571622.cif,mp-571622,0.0,,2014-02-24 13:28:57,4.587850994706799,10.17188/1276359,"@misc{osti_1276359,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Be12Pt (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1276359"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695412'}},0.1187541596153858,5.64354527,520.0,-52.16983815,-4.0130644730769225,{'tags': ['Beryllium platinum (12/1)']},-52.16983815,-4.0130644730769225,-0.0943058507692308,"['xas', 'elasticity', 'bandstructure']",True,[109315],True,2021-05-12 10:56:27.046000,NM,13,8,mp-571622,,Be12Pt,"{'functional': 'PBE', 'labels': ['Be_sv', 'Pt'], 'pot_type': 'paw'}","{'Be': 12.0, 'Pt': 1.0}",GGA,mp-571622,"['mp-571622', 'mp-930193', 'mp-929673', 'mp-913162', 'mp-1417113', 'mp-1695412', 'mp-1805431', 'mp-1599489']",0.000437,"{'Be': 12.0, 'Pt': 1.0}",109.75194427309113,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.981706227569249e-06,0.000437,0,0.000437,MP,data/source/MP/cleaned/cifs/MP-mp-571622.cif,True,,data/final/MP/graphs/Be0.95Pt0.005-MP-mp-571622-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ba2Ca0.3Cu3Pr0.7O7,3,0.0461538461538461,1.0,True,Ba2Ca0.3Cu3Pr0.7O7,Ba2Cu3Pr1O7,0.0,Cuprate,True,Ba15.385Ca2.308Cu23.077Pr5.385O53.84615384615385,Ba-Ca-Cu-Pr-O,5,Supercon,Pr0.7Ca0.3Ba2Cu3O7,MP-mp-20936,Ba2Pr1Cu3O7,Ba-Cu-Pr-O,Ba15.385Cu23.077Pr7.692O53.84615384615385,P m m m,orthorhombic,3.903923,3.95568,11.916432,data/final/MP/cifs/Ba2Ca0.3Cu3Pr0.7O7-MP-mp-20936-synth_doped.cif,data/source/MP/raw/cifs/mp-20936.cif,mp-20936,0.0,,2014-02-22 14:41:55,6.480717836004672,10.17188/1196129,"@misc{osti_1196129,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2PrCu3O7 (SG:47) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196129"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698257'}},0.0256000172756332,3.18514576,520.0,-78.62827906,-6.048329158461538,"{'tags': ['Dibarium praseodymium tricopper heptaoxide', 'Praseodymium dibarium dicopper copper(III) oxide', 'Praseodymium dibarium tricopper heptaoxide', 'Praseodymium dibarium copper(III) dicopper oxide']}",-78.62827906,-6.048329158461538,-2.145007016153845,"['xas', 'bandstructure']",True,"[41452, 94377, 81168, 173910, 89221]",True,2021-05-12 10:56:57.051000,NM,13,8,mp-20936,oxide,Ba2PrCu3O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Pr_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Pr': 1.0, 'Cu': 3.0, 'O': 7.0}",GGA,mp-20936,"['mp-988090', 'mp-987725', 'mp-20936', 'mp-1417367', 'mp-1698257', 'mp-1833655', 'mp-988324', 'mp-1602318']",0.0007234,"{'Ba': 2.0, 'Pr': 1.0, 'Cu': 3.0, 'O': 7.0}",184.02152853403555,[],NM,False,47,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.931061793491212e-06,0.0007234,0,0.0007234,MP,data/source/MP/cleaned/cifs/MP-mp-20936.cif,True,,data/final/MP/graphs/Ba2Ca0.3Cu3Pr0.7O7-MP-mp-20936-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
C1Mo0.9W0.1,3,0.0999999999999999,1.0,True,C1Mo0.9W0.1,C1Mo1,11.7,Other,True,C50Mo45W5,C-Mo-W,3,Supercon,Mo0.9W0.1C1,MP-mp-2305,Mo1C1,C-Mo,C50Mo50,P -6 m 2,hexagonal,2.835086,2.92410600478411,2.92410507,data/final/MP/cifs/C1Mo0.9W0.1-MP-mp-2305-synth_doped.cif,data/source/MP/raw/cifs/mp-2305.cif,mp-2305,0.0,,2011-05-12 17:49:42,8.538697979393088,10.17188/1199194,"@misc{osti_1199194,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MoC (SG:187) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199194"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668222'}},0.0010243049999996,8.62658168,520.0,-20.24014809,-10.120074045,{'tags': ['Molybdenum carbide (1/1)']},-20.24014809,-10.120074045,-0.0838621800000005,"['xas', 'elasticity', 'bandstructure']",True,"[77156, 618300]",True,2021-05-12 10:56:16.728000,NM,2,9,mp-2305,,MoC,"{'functional': 'PBE', 'labels': ['Mo_pv', 'C'], 'pot_type': 'paw'}","{'Mo': 1.0, 'C': 1.0}",GGA,mp-2305,"['mp-927633', 'mp-927239', 'mp-911174', 'mp-2305', 'mp-1116092', 'mp-1440368', 'mp-1668222', 'mp-1791400', 'mp-1638434']",0.0001977,"{'Mo': 1.0, 'C': 1.0}",20.99340614335182,[],NM,False,187,0,"[0, 0]",9.417242664197564e-06,0.0001977,0,0.0001977,MP,data/source/MP/cleaned/cifs/MP-mp-2305.cif,True,,data/final/MP/graphs/C1Mo0.9W0.1-MP-mp-2305-synth_doped.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Be13Pd1,2,0.0109890109890109,0.9230384615384616,True,Be12Pd0.923,Be12Pd1,0.0,Other,True,Be92.857Pd7.143,Be-Pd,2,Supercon,Be13Pd1,MP-mp-12666,Be12Pd1,Be-Pd,Be92.308Pd7.692,I 4/m m m,tetragonal,4.182208000070801,5.551765528906616,5.55176553,data/final/MP/cifs/Be13Pd1-MP-mp-12666-synth_doped.cif,data/source/MP/raw/cifs/mp-12666.cif,mp-12666,0.0,,2011-05-28 08:59:23,3.2209885095075323,10.17188/1189114,"@misc{osti_1189114,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Be12Pd (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189114"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703087'}},0.0794515811538456,5.08493896,520.0,-50.91201729,-3.9163090223076926,{'tags': ['Beryllium palladium (12/1)']},-50.91201729,-3.9163090223076926,-0.0660908538461544,"['xas', 'elasticity', 'bandstructure']",True,[109314],True,2021-05-12 10:56:12.755000,NM,13,8,mp-12666,,Be12Pd,"{'functional': 'PBE', 'labels': ['Be_sv', 'Pd'], 'pot_type': 'paw'}","{'Be': 12.0, 'Pd': 1.0}",GGA,mp-12666,"['mp-929696', 'mp-930239', 'mp-913152', 'mp-12666', 'mp-1422139', 'mp-1703087', 'mp-1804618', 'mp-1597254']",0.0002701,"{'Be': 12.0, 'Pd': 1.0}",110.61682767622136,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.4417623039289328e-06,0.0002701,0,0.0002701,MP,data/source/MP/cleaned/cifs/MP-mp-12666.cif,True,,data/final/MP/graphs/Be13Pd1-MP-mp-12666-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Bi0.6Tl0.4,3,0.1333333333333333,3.0,False,Bi1.8Tl1.2,Bi2Tl1,6.0,Other,True,Bi60Tl40,Bi-Tl,2,Supercon,Bi0.6Tl0.4,MP-mp-30469,Tl1Bi2,Bi-Tl,Bi66.667Tl33.333,P 6/m m m,hexagonal,3.447658,5.7138640010821895,5.71386454,data/final/MP/cifs/Bi0.6Tl0.4-MP-mp-30469-synth_doped.cif,data/source/MP/raw/cifs/mp-30469.cif,mp-30469,0.0,,2014-02-23 19:09:44,10.601443696608747,10.17188/1204876,"@misc{osti_1204876,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TlBi2 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1204876"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1667986'}},0.0,5.99984218,520.0,-10.19271052,-3.397570173333333,"{'tags': ['Bismuth thallium (2/1)', 'Thallium bismuthide (1/2)']}",-10.19271052,-3.397570173333333,-0.0166662511111113,"['xas', 'elasticity', 'bandstructure']",True,"[617229, 58864]",True,2021-05-12 10:56:18.721000,NM,3,12,mp-30469,,TlBi2,"{'functional': 'PBE', 'labels': ['Tl_d', 'Bi'], 'pot_type': 'paw'}","{'Tl': 1.0, 'Bi': 2.0}",GGA,mp-30469,"['mp-991401', 'mp-993341', 'mp-30469', 'mp-1062299', 'mp-1062249', 'mp-1062265', 'mp-1438610', 'mp-1667986', 'mp-1796090', 'mp-994651', 'mp-1591277', 'mp-1062295']",0.0023699,"{'Tl': 1.0, 'Bi': 2.0}",97.4798075141969,[],NM,False,191,0,"[0, 0, 0]",2.431170167888205e-05,0.0023699,0,0.0023699,MP,data/source/MP/cleaned/cifs/MP-mp-30469.cif,True,,data/final/MP/graphs/Bi0.6Tl0.4-MP-mp-30469-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
N0.6Ti1,2,0.05,6.0,False,N3.6Ti6,N4Ti6,1.17,Other,True,N37.5Ti62.5,N-Ti,2,Supercon,N0.6Ti1,MP-mp-1187591,Ti6N4,N-Ti,N40Ti60,R -3 c,trigonal,5.197798262154429,5.197798262154429,5.67939291,data/final/MP/cifs/N0.6Ti1-MP-mp-1187591-synth_doped.cif,data/source/MP/raw/cifs/mp-1187591.cif,mp-1187591,0.0,,2019-01-11 15:12:10.231000,5.05188826948751,,,{'GGA': {'task_id': 'mp-1723361'}},0.0163365849999994,7.47693593,520.0,-95.32620021,-9.532620021,{'tags': []},-95.32620021,-9.532620021,-1.6051268409999992,['bandstructure'],True,[],True,2021-05-12 10:58:31.620000,NM,10,5,mp-1187591,,Ti3N2,"{'functional': 'PBE', 'labels': ['Ti_pv', 'N'], 'pot_type': 'paw'}","{'Ti': 3.0, 'N': 2.0}",GGA,mp-1187591,"['mp-1187591', 'mp-1401832', 'mp-1723361', 'mp-1803732', 'mp-1618630']",0.00166795,"{'Ti': 6.0, 'N': 4.0}",112.81817822943584,[],NM,False,167,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.9568816411977985e-05,0.00166795,0,0.0033359,MP,data/source/MP/cleaned/cifs/MP-mp-1187591.cif,True,,data/final/MP/graphs/N0.6Ti1-MP-mp-1187591-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
As1Fe1Nd1O0.9,2,0.0384615384615384,2.0,False,As2Fe2Nd2O1.8,As2Fe2Nd2O2,46.9,Ferrite,True,As25.641Fe25.641Nd25.641O23.07692307692308,As-Fe-Nd-O,4,Supercon,Nd1Fe1As1O0.9,MP-mp-622621,Nd2Fe2As2O2,As-Fe-Nd-O,As25Fe25Nd25O25,P 4/n m m,tetragonal,4.074653,4.074653,9.170967,data/final/MP/cifs/As1Fe1Nd1O0.9-MP-mp-622621-synth_doped.cif,data/source/MP/raw/cifs/mp-622621.cif,mp-622621,0.0,,2014-02-16 22:28:25,6.347279619112142,10.17188/1278150,"@misc{osti_1278150,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NdFeAsO (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278150"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-1677677'}},0.2809314202083302,3.74777613,520.0,-52.70842543,-6.58855317875,{'tags': ['Neodymium iron arsenic oxide (1/1/1/1)']},-52.70842543,-6.58855317875,-1.61299541125,"['xas', 'bandstructure']",True,"[163547, 164679, 422001, 163546, 236651, 236650, 602466, 164680, 164676]",True,2021-05-12 10:57:28.836000,FM,8,8,mp-622621,oxide,NdFeAsO,"{'functional': 'PBE', 'labels': ['Nd_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Nd': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-622621,"['mp-622621', 'mp-1079381', 'mp-1173401', 'mp-1438697', 'mp-1677677', 'mp-1772072', 'mp-1926310', 'mp-1592869']",3.83954265,"{'Nd': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",152.26370404041757,[],FM,True,129,1,"[0.0, 0.0, 3.6, 3.6, -0.0, -0.0, -0.0, -0.0]",0.0504328024094411,3.83954265,2,7.6790853,MP,data/source/MP/cleaned/cifs/MP-mp-622621.cif,True,,data/final/MP/graphs/As1Fe1Nd1O0.9-MP-mp-622621-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Au0.2Sn0.8,1,0.0,10.0,False,Au2Sn8,Au2Sn8,2.38,Other,True,Au20Sn80,Au-Sn,2,Supercon,Au0.2Sn0.8,MP-mp-1393,Sn8Au2,Au-Sn,Au20Sn80,C c c a,orthorhombic,6.658224,6.682378004837068,6.81154512,data/final/MP/cifs/Au0.2Sn0.8-MP-mp-1393.cif,data/source/MP/raw/cifs/mp-1393.cif,mp-1393,0.0,,2011-05-15 18:59:45,8.44802851267089,10.17188/1189819,"@misc{osti_1189819,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sn4Au (SG:68) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189819"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697690'}},0.0049967017500041,7.34767663,520.0,-39.37203868,-3.937203868,{'tags': ['Gold stannide (1/4)']},-39.37203868,-3.937203868,-0.074770076,"['xas', 'elasticity', 'bandstructure']",True,"[151194, 612348]",True,2021-05-12 10:56:12.755000,NM,10,11,mp-1393,,Sn4Au,"{'functional': 'PBE', 'labels': ['Sn_d', 'Au'], 'pot_type': 'paw'}","{'Sn': 4.0, 'Au': 1.0}",GGA,mp-1393,"['mp-919644', 'mp-905551', 'mp-918647', 'mp-1393', 'mp-569104', 'mp-1079850', 'mp-1115808', 'mp-1413869', 'mp-1697690', 'mp-1777866', 'mp-1597592']",3.89e-05,"{'Sn': 8.0, 'Au': 2.0}",264.0997367255139,[],NM,False,68,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.945856779889928e-07,3.89e-05,0,7.78e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1393.cif,False,,data/final/MP/graphs/Au0.2Sn0.8-MP-mp-1393.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
B0.15C0.85Cu1Sr2O5,2,0.0333333333333333,4.0,False,B0.6C3.4Cu4Sr8O20,C4Cu4Sr8O20,32.0,Cuprate,True,B1.667C9.444Cu11.111Sr22.222O55.55555555555556,B-C-Cu-Sr-O,5,Supercon,Sr2Cu1C0.85B0.15O5,MP-mp-1198030,Sr8Cu4C4O20,C-Cu-Sr-O,C11.111Cu11.111Sr22.222O55.55555555555556,I -4,tetragonal,7.877744002100394,7.877744002100395,9.46755054,data/final/MP/cifs/B0.15C0.85Cu1Sr2O5-MP-mp-1198030-synth_doped.cif,data/source/MP/raw/cifs/mp-1198030.cif,mp-1198030,0.0,,2019-01-12 02:53:33.853000,4.624821022244182,,,{'GGA': {'task_id': 'mp-1742814'}},0.0386187874999981,3.47889523,520.0,-237.90163358,-6.608378710555556,"{'tags': ['Distrontium copper dioxide carbonate - LT', 'Distrontium copper dioxide carbonate']}",-237.90163358,-6.608378710555556,-2.385069899259259,['bandstructure'],True,"[78650, 83095]",True,2021-05-12 10:58:37.524000,NM,36,6,mp-1198030,oxide,Sr2CuCO5,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Cu_pv', 'C', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Cu': 1.0, 'C': 1.0, 'O': 5.0}",GGA,mp-1198030,"['mp-1198030', 'mp-1200477', 'mp-1399692', 'mp-1742814', 'mp-1929945', 'mp-1655225']",0.000743875,"{'Sr': 8.0, 'Cu': 4.0, 'C': 4.0, 'O': 20.0}",475.08507610840775,[],NM,False,82,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.263088759540475e-06,0.000743875,0,0.0029755,MP,data/source/MP/cleaned/cifs/MP-mp-1198030.cif,True,,data/final/MP/graphs/B0.15C0.85Cu1Sr2O5-MP-mp-1198030-synth_doped.json,0,True,-4,0,0,0,0,2,0,0,0,0,1,0,1.0,False
C1Co0.1Mg1Ni2.9,2,0.04,1.0,True,C1Co0.1Mg1Ni2.9,C1Mg1Ni3,7.29,Other,True,C20Co2Mg20Ni58,C-Co-Mg-Ni,4,Supercon,Mg1C1Ni2.9Co0.1,MP-mp-10700,Mg1Ni3C1,C-Mg-Ni,C20Mg20Ni60,P m -3 m,cubic,3.810209,3.810209,3.810209,data/final/MP/cifs/C1Co0.1Mg1Ni2.9-MP-mp-10700-synth_doped.cif,data/source/MP/raw/cifs/mp-10700.cif,mp-10700,0.0,,2011-05-28 10:04:44,6.376007671789427,10.17188/1187303,"@misc{osti_1187303,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MgNi3C (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187303"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678621'}},0.0,6.64260176,520.0,-28.85099542,-5.770199084,{'tags': ['Magnesium nickel carbide (1/3/1)']},-28.85099542,-5.770199084,-0.1367049259999994,"['xas', 'elasticity', 'bandstructure']",True,[77152],True,2021-05-12 10:56:10.715000,NM,5,8,mp-10700,,MgNi3C,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Ni_pv', 'C'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",GGA,mp-10700,"['mp-927245', 'mp-927653', 'mp-911184', 'mp-10700', 'mp-1438083', 'mp-1678621', 'mp-1791467', 'mp-1591421']",0.0387875,"{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",55.31544309398296,[],NM,False,221,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",0.0007012056277683,0.0387875,0,0.0387875,MP,data/source/MP/cleaned/cifs/MP-mp-10700.cif,True,,data/final/MP/graphs/C1Co0.1Mg1Ni2.9-MP-mp-10700-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
B1Ba1Cu1Tb1O5,1,0.0,2.0,False,B2Ba2Cu2Tb2O10,B2Ba2Cu2Tb2O10,0.0,Cuprate,True,B11.111Ba11.111Cu11.111Tb11.111O55.55555555555556,B-Ba-Cu-Tb-O,5,Supercon,Tb1Ba1Cu1B1O5,MP-mp-1214316,Ba2Tb2Cu2B2O10,B-Ba-Cu-Tb-O,B11.111Ba11.111Cu11.111Tb11.111O55.55555555555556,P 4 b m,tetragonal,5.488984,5.488984,7.539017,data/final/MP/cifs/B1Ba1Cu1Tb1O5-MP-mp-1214316.cif,data/source/MP/raw/cifs/mp-1214316.cif,mp-1214316,0.0,,2019-01-12 16:10:52.707000,6.5883664715075545,,,,0.0158548738194168,3.68490909,520.0,-128.9512885,-7.163960472222223,{'tags': []},-128.9512885,-7.163960472222223,-2.8709893171296303,[],False,[],True,2021-05-12 11:00:35.508000,NM,18,3,mp-1214316,oxide,BaTbCuBO5,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Tb_3', 'Cu_pv', 'B', 'O'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Tb': 1.0, 'Cu': 1.0, 'B': 1.0, 'O': 5.0}",GGA,mp-1214316,"['mp-1214316', 'mp-1330370', 'mp-1862507']",0.0007515,"{'Ba': 2.0, 'Tb': 2.0, 'Cu': 2.0, 'B': 2.0, 'O': 10.0}",227.142631202729,[],NM,False,100,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",6.616987714026015e-06,0.0007515,0,0.001503,MP,data/source/MP/cleaned/cifs/MP-mp-1214316.cif,False,,data/final/MP/graphs/B1Ba1Cu1Tb1O5-MP-mp-1214316.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
Sb2Ti1,1,0.0,2.0,False,Sb4Ti2,Sb4Ti2,0.0,Other,True,Sb66.667Ti33.333,Sb-Ti,2,Supercon,Sb2Ti1,MP-mp-568,Ti2Sb4,Sb-Ti,Sb66.667Ti33.333,I 4/m c m,tetragonal,5.571181699793795,5.5711817,5.5711817,data/final/MP/cifs/Sb2Ti1-MP-mp-568.cif,data/source/MP/raw/cifs/mp-568.cif,mp-568,0.0,,2011-05-12 22:48:49,7.3764194084273,10.17188/1274170,"@misc{osti_1274170,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TiSb2 (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1274170"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699774'}},0.0,8.88758836,520.0,-34.65295145,-5.775491908333334,{'tags': ['Titanium antimonide (1/2)']},-34.65295145,-5.775491908333334,-0.5189937427777783,"['xas', 'elasticity', 'bandstructure']",True,"[249576, 42520, 651676, 52322, 409797]",True,2021-05-12 10:56:22.739000,NM,6,8,mp-568,,TiSb2,"{'functional': 'PBE', 'labels': ['Ti_pv', 'Sb'], 'pot_type': 'paw'}","{'Ti': 1.0, 'Sb': 2.0}",GGA,mp-568,"['mp-921253', 'mp-920242', 'mp-906537', 'mp-568', 'mp-1441588', 'mp-1699774', 'mp-1780051', 'mp-1588649']",1.675e-05,"{'Ti': 2.0, 'Sb': 4.0}",131.19088549834402,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0]",2.5535310530717365e-07,1.675e-05,0,3.35e-05,MP,data/source/MP/cleaned/cifs/MP-mp-568.cif,False,,data/final/MP/graphs/Sb2Ti1-MP-mp-568.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Nb0.72Sn0.28,3,0.06,8.0,False,Nb5.76Sn2.24,Nb6Sn2,18.2,Other,True,Nb72Sn28,Nb-Sn,2,Supercon,Nb0.72Sn0.28,MP-mp-1326,Nb6Sn2,Nb-Sn,Nb75Sn25,P m -3 n,cubic,5.334611,5.334611,5.334611,data/final/MP/cifs/Nb0.72Sn0.28-MP-mp-1326-synth_doped.cif,data/source/MP/raw/cifs/mp-1326.cif,mp-1326,0.0,,2011-05-14 09:51:48,8.694218121896231,10.17188/1189484,"@misc{osti_1189484,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Sn (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189484"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668415'}},0.0,6.59372491,520.0,-69.93787048,-8.74223381,{'tags': ['Niobium tin (3/1)']},-69.93787048,-8.74223381,-0.163862066250001,"['xas', 'elasticity', 'bandstructure']",True,"[105230, 645503, 645489, 105231, 645498, 645485, 645474, 645496, 645480, 645488, 645482, 645487, 645500, 645493, 645477, 645484, 645502, 645483, 150878, 645479, 645481, 645486, 645473]",True,2021-05-12 10:56:12.755000,NM,8,9,mp-1326,,Nb3Sn,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Sn_d'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Sn': 1.0}",GGA,mp-1326,"['mp-930046', 'mp-913770', 'mp-930577', 'mp-1326', 'mp-1440651', 'mp-1668415', 'mp-1880085', 'mp-1594093', 'mp-1594507']",0.62023085,"{'Nb': 6.0, 'Sn': 2.0}",151.81275738025872,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0081709977567491,0.62023085,0,1.2404617,MP,data/source/MP/cleaned/cifs/MP-mp-1326.cif,True,,data/final/MP/graphs/Nb0.72Sn0.28-MP-mp-1326-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba1.9Cu4La0.1Y1O8,2,0.0133333333333333,1.0,True,Ba1.9Cu4La0.1Y1O8,Ba2Cu4Y1O8,61.0,Cuprate,True,Ba12.667Cu26.667La0.667Y6.667O53.333333333333336,Ba-Cu-La-Y-O,5,Supercon,Y1Ba1.9La0.1Cu4O8,MP-mp-6790,Ba2Y1Cu4O8,Ba-Cu-Y-O,Ba13.333Cu26.667Y6.667O53.333333333333336,C m m m,orthorhombic,3.889922,3.899603999537882,13.88942687,data/final/MP/cifs/Ba1.9Cu4La0.1Y1O8-MP-mp-6790-synth_doped.cif,data/source/MP/raw/cifs/mp-6790.cif,mp-6790,0.0,,2011-05-16 03:21:24,5.936250568336678,10.17188/1283441,"@misc{osti_1283441,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Y(CuO2)4 (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1283441"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686864'}},0.0,3.31391536,520.0,-91.58381472,-6.105587648,"{'tags': ['Yttrium barium copper oxide (1/2/4/8)', 'High pressure experimental phase']}",-91.58381472,-6.105587648,-2.0529924817777783,"['xas', 'bandstructure']",True,"[72261, 85273, 74251, 400273, 85277, 85275, 400280, 67632, 85272, 67631, 83920, 66613, 85279, 400277, 75689, 74259, 85278, 85280, 66603, 94265, 400276, 88873, 71417, 75712, 97052, 66605, 72258, 85281, 85274, 400279, 66604, 69698]",True,2021-05-12 10:57:34.594000,NM,15,10,mp-6790,oxide,Ba2Y(CuO2)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-6790,"['mp-1000664', 'mp-6790', 'mp-1007136', 'mp-1237713', 'mp-1440937', 'mp-1686864', 'mp-1834179', 'mp-1011883', 'mp-1590064', 'mp-1590433']",0.0004643,"{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",208.60454115924333,[],NM,False,65,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.225742533790601e-06,0.0004643,0,0.0004643,MP,data/source/MP/cleaned/cifs/MP-mp-6790.cif,True,,data/final/MP/graphs/Ba1.9Cu4La0.1Y1O8-MP-mp-6790-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
S8Tl1V6,1,0.0,1.0,True,S8Tl1V6,S8Tl1V6,4.1,Chevrel,True,S53.333Tl6.667V40,S-Tl-V,3,Supercon,Tl1V6S8,MP-mp-1216802,Tl1V6S8,S-Tl-V,S53.333Tl6.667V40,P -3,trigonal,3.239422,9.235339996065402,9.23533995,data/final/MP/cifs/S8Tl1V6-MP-mp-1216802.cif,data/source/MP/raw/cifs/mp-1216802.cif,mp-1216802,0.0,,2019-01-12 18:14:51.659000,5.319697718368882,,,{'GGA': {'task_id': 'mp-1746697'}},0.0107068738888891,7.24509492,520.0,-104.03558489,-6.935705659333333,{'tags': []},-104.03558489,-6.935705659333333,-1.2067937592222222,[],False,[],True,2021-05-12 11:00:40.103000,NM,15,4,mp-1216802,,Tl(V3S4)2,"{'functional': 'PBE', 'labels': ['Tl_d', 'V_pv', 'S'], 'pot_type': 'paw'}","{'Tl': 1.0, 'V': 6.0, 'S': 8.0}",GGA,mp-1216802,"['mp-1216802', 'mp-1412110', 'mp-1746697', 'mp-1935035']",0.1974968,"{'Tl': 1.0, 'V': 6.0, 'S': 8.0}",239.2786410300724,[],NM,False,147,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.000825384159446,0.1974968,0,0.1974968,MP,data/source/MP/cleaned/cifs/MP-mp-1216802.cif,False,,data/final/MP/graphs/S8Tl1V6-MP-mp-1216802.json,0,True,-3,0,0,0,0,0,0,2,1,0,0,0,1.0,False
Al1Nb2.993Zr0.007,2,0.0035,2.0,False,Al2Nb5.986Zr0.014,Al2Nb6,17.6,Other,True,Al25Nb74.825Zr0.175,Al-Nb-Zr,3,Supercon,Nb2.9925Zr0.0075Al1,MP-mp-796,Nb6Al2,Al-Nb,Al25Nb75,P m -3 n,cubic,5.215254,5.215254,5.215254,data/final/MP/cifs/Al1Nb2.993Zr0.007-MP-mp-796-synth_doped.cif,data/source/MP/raw/cifs/mp-796.cif,mp-796,0.0,,2011-05-13 16:07:37,7.157298025966356,,,{'GGA': {'task_id': 'mp-1686893'}},0.0460773865000003,5.52947534,520.0,-69.48918494,-8.6861481175,"{'tags': ['Aluminium niobium (1/3)', 'Niobium aluminide (3/1)', 'Aluminum niobium (1/3)']}",-69.48918494,-8.6861481175,-0.1737753800000003,"['bandstructure', 'elasticity']",True,"[608675, 608654, 608688, 608668, 608669, 608685, 608676, 608683, 58014, 608657, 107856, 608655, 608666, 608691, 608656, 608665, 608673, 608653, 608661]",True,2021-05-12 10:56:31.128000,NM,8,10,mp-796,,Nb3Al,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Al': 1.0}",GGA,mp-796,"['mp-911586', 'mp-927906', 'mp-796', 'mp-927472', 'mp-1260512', 'mp-1440919', 'mp-1686893', 'mp-1927652', 'mp-1591599', 'mp-1587739']",0.16323955,"{'Nb': 6.0, 'Al': 2.0}",141.8490379078192,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0023015954483396,0.16323955,0,0.3264791,MP,data/source/MP/cleaned/cifs/MP-mp-796.cif,True,,data/final/MP/graphs/Al1Nb2.993Zr0.007-MP-mp-796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Al3La0.1Pd2U0.9,2,0.0333333333333333,1.0,True,Al3La0.1Pd2U0.9,Al3Pd2U1,0.0,Heavy_fermion,True,Al50La1.667Pd33.333U15,Al-La-Pd-U,4,Supercon,U0.9La0.1Pd2Al3,MP-mp-4561,U1Al3Pd2,Al-Pd-U,Al50Pd33.333U16.667,P 6/m m m,hexagonal,4.239652,5.384229999094356,5.3842309,data/final/MP/cifs/Al3La0.1Pd2U0.9-MP-mp-4561-synth_doped.cif,data/source/MP/raw/cifs/mp-4561.cif,mp-4561,0.0,,2011-05-12 23:59:10,8.296603403902926,10.17188/1208253,"@misc{osti_1208253,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UAl3Pd2 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208253"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700804'}},0.0796314472916668,8.0468212,520.0,-36.36476907,-6.060794845,"{'tags': ['Aluminium palladium uranium (3/2/1)', 'Aluminum palladium uranium (3/2/1)']}",-36.36476907,-6.060794845,-0.5794779916666665,"['xas', 'elasticity', 'bandstructure']",True,"[657574, 106242, 659234]",True,2021-05-12 10:56:20.740000,FM,6,9,mp-4561,,UAl3Pd2,"{'functional': 'PBE', 'labels': ['U', 'Al', 'Pd'], 'pot_type': 'paw'}","{'U': 1.0, 'Al': 3.0, 'Pd': 2.0}",GGA,mp-4561,"['mp-4561', 'mp-991619', 'mp-993538', 'mp-1251974', 'mp-1441898', 'mp-1700804', 'mp-1933710', 'mp-994863', 'mp-1593816']",2.2050571,"{'U': 1.0, 'Al': 3.0, 'Pd': 2.0}",106.4408038742404,[],FM,True,191,1,"[2.2, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0207162762750765,2.2050571,1,2.2050571,MP,data/source/MP/cleaned/cifs/MP-mp-4561.cif,True,,data/final/MP/graphs/Al3La0.1Pd2U0.9-MP-mp-4561-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ge2Y1,1,0.0,2.0,False,Ge4Y2,Ge4Y2,3.8,Other,True,Ge66.667Y33.333,Ge-Y,2,Supercon,Ge2Y1,MP-mp-10213,Y2Ge4,Ge-Y,Ge66.667Y33.333,I 41/a m d,tetragonal,3.9950320009544544,3.995032000954454,8.79228723,data/final/MP/cifs/Ge2Y1-MP-mp-10213.cif,data/source/MP/raw/cifs/mp-10213.cif,mp-10213,0.0,,2011-05-29 10:32:33,5.852708121597142,10.17188/1186819,"@misc{osti_1186819,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YGe2 (SG:141) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1186819"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1670929'}},0.1085602266666665,4.13686338,520.0,-34.61999816,-5.769999693333333,{'tags': ['Yttrium germanium (1/2)']},-34.61999816,-5.769999693333333,-0.5324907522222221,"['xas', 'elasticity', 'bandstructure']",True,[76344],True,2021-05-12 10:56:08.727000,NM,6,8,mp-10213,,YGe2,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ge_d'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ge': 2.0}",GGA,mp-10213,"['mp-926778', 'mp-910425', 'mp-926226', 'mp-10213', 'mp-1300221', 'mp-1670929', 'mp-1875755', 'mp-1590803']",0.0010403,"{'Y': 2.0, 'Ge': 4.0}",132.88711642220346,[],NM,False,141,0,"[0, 0, 0, 0, 0, 0]",1.5656897794287322e-05,0.0010403,0,0.0020806,MP,data/source/MP/cleaned/cifs/MP-mp-10213.cif,False,,data/final/MP/graphs/Ge2Y1-MP-mp-10213.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
La1Ni1Sn1,1,0.0,4.0,False,La4Ni4Sn4,La4Ni4Sn4,0.59,Other,True,La33.333Ni33.333Sn33.333,La-Ni-Sn,3,Supercon,La1Ni1Sn1,MP-mp-12613,La4Ni4Sn4,La-Ni-Sn,La33.333Ni33.333Sn33.333,P n m a,orthorhombic,4.753954,7.295764,7.81078,data/final/MP/cifs/La1Ni1Sn1-MP-mp-12613.cif,data/source/MP/raw/cifs/mp-12613.cif,mp-12613,0.0,,2014-12-22 16:18:18,7.755330343393208,10.17188/1189083,"@misc{osti_1189083,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaNiSn (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189083"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695301'}},0.0,8.78817387,520.0,-66.50338944,-5.541949120000001,"{'tags': ['Lanthanum nickel stannide (1/1/1)', 'Lanthanum nickel tin (1/1/1)', 'lanthanum nickel tin (1/1/1)']}",-66.50338944,-5.541949120000001,-0.6333772400000003,"['xas', 'bandstructure']",True,"[108860, 108571, 157921, 641591]",True,2021-05-12 10:56:51.169000,NM,12,8,mp-12613,,LaNiSn,"{'functional': 'PBE', 'labels': ['La', 'Ni_pv', 'Sn_d'], 'pot_type': 'paw'}","{'La': 1.0, 'Ni': 1.0, 'Sn': 1.0}",GGA,mp-12613,"['mp-977839', 'mp-914352', 'mp-12613', 'mp-1429326', 'mp-1695301', 'mp-1863430', 'mp-978141', 'mp-1599706']",0.000285275,"{'La': 4.0, 'Ni': 4.0, 'Sn': 4.0}",270.90695688781705,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.212147274137855e-06,0.000285275,0,0.0011411,MP,data/source/MP/cleaned/cifs/MP-mp-12613.cif,False,,data/final/MP/graphs/La1Ni1Sn1-MP-mp-12613.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Pd0.03Pt2.97U1,2,0.0149999999999999,2.0,False,Pd0.06Pt5.94U2,Pt6U2,0.0,Heavy_fermion,True,Pd0.75Pt74.25U25,Pd-Pt-U,3,Supercon,U1Pt2.97Pd0.03,MP-mp-30855,U2Pt6,Pt-U,Pt75U25,P 63/m m c,hexagonal,4.997603,5.777009996166576,5.7770105,data/final/MP/cifs/Pd0.03Pt2.97U1-MP-mp-30855-synth_doped.cif,data/source/MP/raw/cifs/mp-30855.cif,mp-30855,0.0,,2014-02-19 21:36:23,18.929034548497903,10.17188/1205211,"@misc{osti_1205211,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UPt3 (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1205211"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687777'}},0.0,9.26919984,520.0,-64.84444661,-8.10555582625,"{'tags': ['Platinum uranium (3/1)', 'Uranium platinum boride (1/3/0.11)', 'Uranium platinum (1/3)']}",-64.84444661,-8.10555582625,-0.7295225412500006,"['xas', 'bandstructure']",True,"[615213, 649804, 105833, 191938]",True,2021-05-12 10:57:04.957000,FM,8,11,mp-30855,,UPt3,"{'functional': 'PBE', 'labels': ['U', 'Pt'], 'pot_type': 'paw'}","{'U': 1.0, 'Pt': 3.0}",GGA,mp-30855,"['mp-943077', 'mp-932790', 'mp-942062', 'mp-30855', 'mp-1078485', 'mp-1079639', 'mp-1092253', 'mp-1299942', 'mp-1687777', 'mp-1924669', 'mp-1595664']",0.6726182,"{'U': 2.0, 'Pt': 6.0}",144.44372324836635,[],FM,True,187,1,"[0.0, 1.4, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0093132215768691,0.6726182,1,1.3452364,MP,data/source/MP/cleaned/cifs/MP-mp-30855.cif,True,,data/final/MP/graphs/Pd0.03Pt2.97U1-MP-mp-30855-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
B2C1Ce0.05Ni2Y0.95,2,0.0166666666666666,1.0,True,B2C1Ce0.05Ni2Y0.95,B2C1Ni2Y1,13.8,Other,True,B33.333C16.667Ce0.833Ni33.333Y15.833,B-C-Ce-Ni-Y,5,Supercon,Y0.95Ce0.05Ni2B2C1,MP-mp-6576,Y1Ni2B2C1,B-C-Ni-Y,B33.333C16.667Ni33.333Y16.667,I 4/m m m,tetragonal,3.548790000501972,3.548790000501972,5.76144136,data/final/MP/cifs/B2C1Ce0.05Ni2Y0.95-MP-mp-6576-synth_doped.cif,data/source/MP/raw/cifs/mp-6576.cif,mp-6576,0.0,,2011-05-13 05:21:43,6.099730998852292,10.17188/1281366,"@misc{osti_1281366,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281366"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688230'}},0.0,6.81083016,520.0,-43.677878,-7.279646333333333,{'tags': []},-43.677878,-7.279646333333333,-0.5109282141666659,"['xas', 'bandstructure']",True,"[75816, 89142, 83231, 79574, 41549]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6576,,YNi2B2C,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6576,"['mp-6576', 'mp-1007054', 'mp-1000583', 'mp-1439516', 'mp-1688230', 'mp-1794280', 'mp-1011792', 'mp-1597064']",0.0006603,"{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.3152437079014,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",1.010943177297096e-05,0.0006603,0,0.0006603,MP,data/source/MP/cleaned/cifs/MP-mp-6576.cif,True,,data/final/MP/graphs/B2C1Ce0.05Ni2Y0.95-MP-mp-6576-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B1Mo1,1,0.0,4.0,False,B4Mo4,B4Mo4,0.25,Other,True,B50Mo50,B-Mo,2,Supercon,B1Mo1,MP-mp-1890,B4Mo4,B-Mo,B50Mo50,I 41/a m d,tetragonal,3.1318799993486737,3.1318799993486737,8.8111873,data/final/MP/cifs/B1Mo1-MP-mp-1890.cif,data/source/MP/raw/cifs/mp-1890.cif,mp-1890,0.0,,2011-05-13 08:41:03,8.476293815107915,10.17188/1193603,"@misc{osti_1193603,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BMo (SG:141) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1193603"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701828'}},0.0,9.57659831,520.0,-74.11684746,-9.2646059325,"{'tags': ['Molybdenum boride (1/1)', 'Molydenum boride (1/1)', 'Molybdenum boride (1/1) - delta']}",-74.11684746,-9.2646059325,-0.5020885320833344,"['xas', 'elasticity', 'bandstructure']",True,"[614808, 614793, 24280]",True,2021-05-12 10:56:14.760000,NM,8,8,mp-1890,,BMo,"{'functional': 'PBE', 'labels': ['B', 'Mo_pv'], 'pot_type': 'paw'}","{'B': 1.0, 'Mo': 1.0}",GGA,mp-1890,"['mp-913371', 'mp-929806', 'mp-930356', 'mp-1890', 'mp-1475841', 'mp-1701828', 'mp-1801258', 'mp-1591332']",2.9e-06,"{'B': 4.0, 'Mo': 4.0}",83.65175146839091,[],NM,False,141,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.3867013895558708e-07,2.9e-06,0,1.16e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1890.cif,False,,data/final/MP/graphs/B1Mo1-MP-mp-1890.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ba2Co1Cu2Nd1O7.24,2,0.0167325122007901,0.9669701657458564,True,Ba1.934Co0.967Cu1.934Nd0.967O7,Ba2Co1Cu2Nd1O7,0.0,Cuprate,True,Ba15.106Co7.553Cu15.106Nd7.553O54.68277945619335,Ba-Co-Cu-Nd-O,5,Supercon,Nd1Ba2Cu2Co1O7.24,MP-mp-1214600,Ba2Nd1Co1Cu2O7,Ba-Co-Cu-Nd-O,Ba15.385Co7.692Cu15.385Nd7.692O53.84615384615385,P m m m,orthorhombic,3.915791,3.946729,11.960478,data/final/MP/cifs/Ba2Co1Cu2Nd1O7.24-MP-mp-1214600-synth_doped.cif,data/source/MP/raw/cifs/mp-1214600.cif,mp-1214600,0.0,,2019-01-12 16:24:59.217000,6.440396806037473,,,{'GGA+U': {'task_id': 'mp-1718586'}},0.0230506935256373,3.33908933,520.0,-80.65930419,-6.204561860769231,"{'tags': ['Ba2Cu2NdCoO7', 'Ba2Cu2(Cu0.89Al0.11)YO7', 'high-Tc cuprate family']}",-80.65930419,-6.204561860769231,-2.196750857692308,[],False,[],True,2021-05-12 11:00:37.845000,FM,13,4,mp-1214600,oxide,Ba2NdCoCu2O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Nd_3', 'Co', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Nd': 1.0, 'Co': 1.0, 'Cu': 2.0, 'O': 7.0}",GGA+U,mp-1214600,"['mp-1214600', 'mp-1385574', 'mp-1718586', 'mp-1832479']",2.6000313,"{'Ba': 2.0, 'Nd': 1.0, 'Co': 1.0, 'Cu': 2.0, 'O': 7.0}",184.8439954182616,[],FM,True,47,1,"[0.0, 0.0, 0.0, 2.2, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0140660847225072,2.6000313,1,2.6000313,MP,data/source/MP/cleaned/cifs/MP-mp-1214600.cif,True,,data/final/MP/graphs/Ba2Co1Cu2Nd1O7.24-MP-mp-1214600-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ga2Y1,1,0.0,1.0,True,Ga2Y1,Ga2Y1,1.68,Other,True,Ga66.667Y33.333,Ga-Y,2,Supercon,Ga2Y1,MP-mp-1914,Y1Ga2,Ga-Y,Ga66.667Y33.333,P 6/m m m,hexagonal,4.134033,4.217469998331065,4.21746986,data/final/MP/cifs/Ga2Y1-MP-mp-1914.cif,data/source/MP/raw/cifs/mp-1914.cif,mp-1914,0.0,,2011-05-12 21:57:30,5.954496935155665,10.17188/1193963,"@misc{osti_1193963,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YGa2 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1193963"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687833'}},0.0,3.6356174,520.0,-14.51396369,-4.837987896666667,{'tags': ['Gallium yttrium (2/1)']},-14.51396369,-4.837987896666667,-0.663766843888889,"['xas', 'elasticity', 'bandstructure']",True,"[104031, 104032, 635661]",True,2021-05-12 10:56:14.760000,NM,3,8,mp-1914,,YGa2,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ga_d'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ga': 2.0}",GGA,mp-1914,"['mp-993423', 'mp-991471', 'mp-1914', 'mp-1439570', 'mp-1687833', 'mp-1923876', 'mp-994732', 'mp-1588955']",0.0031895,"{'Y': 1.0, 'Ga': 2.0}",63.680806621402745,[],NM,False,191,0,"[0, 0, 0]",5.00857349210779e-05,0.0031895,0,0.0031895,MP,data/source/MP/cleaned/cifs/MP-mp-1914.cif,False,,data/final/MP/graphs/Ga2Y1-MP-mp-1914.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Cr1Ti3,3,0.1,2.0,False,Cr2Ti6,Cr2Ti8,3.7,Other,True,Cr25Ti75,Cr-Ti,2,Supercon,Cr1Ti3,MP-mp-1208307,Ti8Cr2,Cr-Ti,Cr20Ti80,F d -3 m,cubic,6.31085448,6.310854479999999,6.31085448,data/final/MP/cifs/Cr1Ti3-MP-mp-1208307-synth_doped.cif,data/source/MP/raw/cifs/mp-1208307.cif,mp-1208307,0.0038999999999997,,2019-01-12 11:14:57.337000,4.549508948926443,,,,0.807792282666667,5.19907617,520.0,-74.70536194,-7.470536194,"{'tags': ['MgCu2', 'TiCr2 rt', 'Friauf-Laves phase, Frank-Kasper phase']}",-74.70536194,-7.470536194,0.7764669133333328,[],False,[],True,2021-05-12 11:00:21.818000,NM,10,2,mp-1208307,,Ti4Cr,"{'functional': 'PBE', 'labels': ['Ti_pv', 'Cr_pv'], 'pot_type': 'paw'}","{'Ti': 4.0, 'Cr': 1.0}",GGA,mp-1208307,"['mp-1208307', 'mp-1833140']",0.0002126,"{'Ti': 8.0, 'Cr': 2.0}",177.72540021489934,[],NM,False,227,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",2.3924548741252685e-06,0.0002126,0,0.0004252,MP,data/source/MP/cleaned/cifs/MP-mp-1208307.cif,True,,data/final/MP/graphs/Cr1Ti3-MP-mp-1208307-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ba0.102Cu1La1.898O4,2,0.0291428571428571,1.0,True,Ba0.102Cu1La1.898O4,Cu1La2O4,29.0,Cuprate,True,Ba1.457Cu14.286La27.114O57.142857142857146,Ba-Cu-La-O,4,Supercon,La1.898Ba0.102Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ba0.102Cu1La1.898O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ba0.102Cu1La1.898O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Al0.01B0.99Li2Pt3,2,0.0033333333333333,4.0,False,Al0.04B3.96Li8Pt12,B4Li8Pt12,2.86,Other,True,Al0.167B16.5Li33.333Pt50,Al-B-Li-Pt,4,Supercon,Li2Pt3B0.99Al0.01,MP-mp-20234,Li8B4Pt12,B-Li-Pt,B16.667Li33.333Pt50,P 43 3 2,cubic,6.84464,6.84464,6.84464,data/final/MP/cifs/Al0.01B0.99Li2Pt3-MP-mp-20234-synth_doped.cif,data/source/MP/raw/cifs/mp-20234.cif,mp-20234,0.0,,2014-02-22 21:58:26,12.634205351017416,10.17188/1195368,"@misc{osti_1195368,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Li2BPt3 (SG:212) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195368"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671476'}},0.0,4.76758864,520.0,-128.53533033,-5.35563876375,{'tags': ['Lithium platinum boride (2/3/1)']},-128.53533033,-5.35563876375,-0.5706453247222214,"['xas', 'bandstructure']",True,"[156466, 246448, 84932]",True,2021-05-12 10:56:57.051000,NM,24,8,mp-20234,,Li2BPt3,"{'functional': 'PBE', 'labels': ['Li_sv', 'B', 'Pt'], 'pot_type': 'paw'}","{'Li': 2.0, 'B': 1.0, 'Pt': 3.0}",GGA,mp-20234,"['mp-920353', 'mp-906711', 'mp-921381', 'mp-20234', 'mp-1115994', 'mp-1430060', 'mp-1671476', 'mp-1809887']",0.000293725,"{'Li': 8.0, 'B': 4.0, 'Pt': 12.0}",320.6652014392893,[],NM,False,212,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.6639460556571824e-06,0.000293725,0,0.0011749,MP,data/source/MP/cleaned/cifs/MP-mp-20234.cif,True,,data/final/MP/graphs/Al0.01B0.99Li2Pt3-MP-mp-20234-synth_doped.json,0,True,432,4,0,0,0,0,0,0,1,0,0,0,1.0,False
Ga0.51Nb3Sn0.49,2,0.005,2.0,False,Ga1.02Nb6Sn0.98,Ga1Nb6Sn1,16.4,Other,True,Ga12.75Nb75Sn12.25,Ga-Nb-Sn,3,Supercon,Nb3Sn0.49Ga0.51,MP-mp-1220342,Nb6Ga1Sn1,Ga-Nb-Sn,Ga12.5Nb75Sn12.5,P m -3,cubic,5.267319,5.267319,5.267319,data/final/MP/cifs/Ga0.51Nb3Sn0.49-MP-mp-1220342-synth_doped.cif,data/source/MP/raw/cifs/mp-1220342.cif,mp-1220342,0.0,,2019-01-12 21:12:16.669000,8.475086109299342,,,{'GGA': {'task_id': 'mp-1733533'}},0.0480318309375,5.78514107,520.0,-68.8247362,-8.603092025,{'tags': []},-68.8247362,-8.603092025,-0.1474047603125008,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,8,5,mp-1220342,,Nb6GaSn,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Ga_d', 'Sn_d'], 'pot_type': 'paw'}","{'Nb': 6.0, 'Ga': 1.0, 'Sn': 1.0}",GGA,mp-1220342,"['mp-1220342', 'mp-1392260', 'mp-1733533', 'mp-1929075', 'mp-1619541']",0.5383733,"{'Nb': 6.0, 'Ga': 1.0, 'Sn': 1.0}",146.13991918453098,[],NM,False,200,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0036839578330421,0.5383733,0,0.5383733,MP,data/source/MP/cleaned/cifs/MP-mp-1220342.cif,True,,data/final/MP/graphs/Ga0.51Nb3Sn0.49-MP-mp-1220342-synth_doped.json,0,True,m-3,2,0,0,0,0,0,0,1,0,0,0,1.0,False
Ir0.85Rh0.15Te2,3,0.1,4.0,False,Ir3.4Rh0.6Te8,Ir4Te8,2.39,Other,True,Ir28.333Rh5Te66.667,Ir-Rh-Te,3,Supercon,Ir0.85Rh0.15Te2,MP-mp-569322,Te8Ir4,Ir-Te,Ir33.333Te66.667,P n m a,orthorhombic,4.049805,5.441863,13.587474,data/final/MP/cifs/Ir0.85Rh0.15Te2-MP-mp-569322-synth_doped.cif,data/source/MP/raw/cifs/mp-569322.cif,mp-569322,0.0,,2014-02-16 04:48:25,9.924328423353325,10.17188/1275037,"@misc{osti_1275037,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Te2Ir (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1275037"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1746248'}},0.0123894575000003,7.60847828,520.0,-63.94410921,-5.3286757675,{'tags': ['Iridium telluride (1/2)']},-63.94410921,-5.3286757675,-0.5683316741666667,"['xas', 'bandstructure']",True,[93894],True,2021-05-12 10:57:24.969000,NM,12,7,mp-569322,,Te2Ir,"{'functional': 'PBE', 'labels': ['Te', 'Ir'], 'pot_type': 'paw'}","{'Te': 2.0, 'Ir': 1.0}",GGA,mp-569322,"['mp-927873', 'mp-927408', 'mp-569322', 'mp-911451', 'mp-1392626', 'mp-1746248', 'mp-1810340']",0.000153075,"{'Te': 8.0, 'Ir': 4.0}",299.44732816890644,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.0447669503153013e-06,0.000153075,0,0.0006123,MP,data/source/MP/cleaned/cifs/MP-mp-569322.cif,True,,data/final/MP/graphs/Ir0.85Rh0.15Te2-MP-mp-569322-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
B1C0.85Lu1Ni1,3,0.0584415584415584,2.0,False,B2C1.7Lu2Ni2,B2C2Lu2Ni2,2.4,Other,True,B25.974C22.078Lu25.974Ni25.974,B-C-Lu-Ni,4,Supercon,Lu1Ni1B1C0.85,MP-mp-6188,Lu2Ni2B2C2,B-C-Lu-Ni,B25C25Lu25Ni25,P 4/n m m,tetragonal,3.499459,3.499459,7.54108,data/final/MP/cifs/B1C0.85Lu1Ni1-MP-mp-6188-synth_doped.cif,data/source/MP/raw/cifs/mp-6188.cif,mp-6188,0.0,,2011-05-13 11:39:58,9.22360692471969,10.17188/1277950,"@misc{osti_1277950,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LuNiBC (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277950"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701902'}},0.0,5.56637243,520.0,-56.94584528,-7.11823066,{'tags': []},-56.94584528,-7.11823066,-0.5664157422916656,"['xas', 'bandstructure']",True,"[54041, 75610]",True,2021-05-12 10:57:28.836000,NM,8,8,mp-6188,,LuNiBC,"{'functional': 'PBE', 'labels': ['Lu_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Lu': 1.0, 'Ni': 1.0, 'B': 1.0, 'C': 1.0}",GGA,mp-6188,"['mp-6188', 'mp-1007095', 'mp-1000629', 'mp-1426768', 'mp-1701902', 'mp-1796435', 'mp-1011840', 'mp-1591367']",0.0004347,"{'Lu': 2.0, 'Ni': 2.0, 'B': 2.0, 'C': 2.0}",92.34967413717082,[],NM,False,129,0,"[0, 0, 0, 0, 0, 0, 0, 0]",9.414218383798992e-06,0.0004347,0,0.0008694,MP,data/source/MP/cleaned/cifs/MP-mp-6188.cif,True,,data/final/MP/graphs/B1C0.85Lu1Ni1-MP-mp-6188-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ge3Pd1Sr1,1,0.0,1.0,True,Ge3Pd1Sr1,Ge3Pd1Sr1,1.5,Other,True,Ge60Pd20Sr20,Ge-Pd-Sr,3,Supercon,Sr1Pd1Ge3,MP-mp-978987,Sr1Ge3Pd1,Ge-Pd-Sr,Ge60Pd20Sr20,I 4 m m,tetragonal,4.510452002208024,4.510452002208024,6.11174542,data/final/MP/cifs/Ge3Pd1Sr1-MP-mp-978987.cif,data/source/MP/raw/cifs/mp-978987.cif,mp-978987,0.0,,2015-10-09 03:22:41,6.449537276273672,10.17188/1316058,"@misc{osti_1316058,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SrGe3Pd (SG:107) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1316058"",
    place = ""United States"",
    year = ""2016"",
    month = ""9"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704022'}},0.0,3.96148735,520.0,-23.5031058,-4.70062116,{'tags': ['Strontium palladium germanide (1/1/3)']},-23.5031058,-4.70062116,-0.5529293943333329,"['xas', 'elasticity', 'bandstructure']",True,[168862],True,2021-05-12 10:56:37.246000,NM,5,9,mp-978987,,SrGe3Pd,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ge_d', 'Pd'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Ge': 3.0, 'Pd': 1.0}",GGA,mp-978987,"['mp-978987', 'mp-979738', 'mp-1005867', 'mp-1005774', 'mp-1422168', 'mp-1704022', 'mp-1932498', 'mp-1011085', 'mp-1593325']",0.000378,"{'Sr': 1.0, 'Ge': 3.0, 'Pd': 1.0}",106.06585318811771,[],NM,False,107,0,"[0, 0, 0, 0, 0]",3.563823687248163e-06,0.000378,0,0.000378,MP,data/source/MP/cleaned/cifs/MP-mp-978987.cif,False,,data/final/MP/graphs/Ge3Pd1Sr1-MP-mp-978987.json,0,True,4mm,0,0,0,0,5,0,0,0,0,1,0,1.0,False
B0.978C0.022Si1,2,0.022,2.0,False,B1.956C0.044Si2,B2Si2,1.35,Other,True,B48.9C1.1Si50,B-C-Si,3,Supercon,B0.978C0.022Si1,MP-mp-978495,Si2B2,B-Si,B50Si50,P 63 m c,hexagonal,3.175173998994726,3.1751737,5.860929,data/final/MP/cifs/B0.978C0.022Si1-MP-mp-978495-synth_doped.cif,data/source/MP/raw/cifs/mp-978495.cif,mp-978495,0.0,,2015-10-06 21:04:18,2.524396216179016,10.17188/1315914,"@misc{osti_1315914,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SiB (SG:186) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1315914"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1764655'}},0.4118098600000071,5.73179061,520.0,-22.66944935,-5.6673623375,{'tags': []},-22.66944935,-5.6673623375,0.3849905579166668,"['xas', 'elasticity', 'bandstructure']",True,[],True,2021-05-12 10:56:37.246000,NM,4,8,mp-978495,,SiB,"{'functional': 'PBE', 'labels': ['Si', 'B'], 'pot_type': 'paw'}","{'Si': 1.0, 'B': 1.0}",GGA,mp-978495,"['mp-978635', 'mp-978495', 'mp-1143858', 'mp-1260296', 'mp-1415102', 'mp-1764655', 'mp-1793478', 'mp-1616688']",0.00015305,"{'Si': 2.0, 'B': 2.0}",51.171965311983016,[],NM,False,186,0,"[0, 0, 0, 0]",5.981790969601868e-06,0.00015305,0,0.0003061,MP,data/source/MP/cleaned/cifs/MP-mp-978495.cif,True,,data/final/MP/graphs/B0.978C0.022Si1-MP-mp-978495-synth_doped.json,0,True,6mm,0,5,0,0,0,0,0,1,0,0,0,1.0,False
As2Ba0.833Fe2K0.167,3,0.0665333333333333,3.0,False,As6Ba2.499Fe6K0.501,As6Ba2Fe6K1,7.0,Ferrite,True,As40Ba16.66Fe40K3.34,As-Ba-Fe-K,4,Supercon,Ba0.833K0.167Fe2As2,MP-mp-1223567,K1Ba2Fe6As6,As-Ba-Fe-K,As40Ba13.333Fe40K6.667,C 1 2/m 1,monoclinic,5.48060788,7.102799640000001,8.784942288492543,data/final/MP/cifs/As2Ba0.833Fe2K0.167-MP-mp-1223567-synth_doped.cif,data/source/MP/raw/cifs/mp-1223567.cif,mp-1223567,0.0,,2019-01-12 23:56:38.667000,6.101417464045543,,,,0.0186882046666676,4.38014394,520.0,-90.51509253,-6.034339502,{'tags': []},-90.51509253,-6.034339502,-0.4527993862000007,[],False,[],True,2021-05-12 11:00:52.054000,FM,15,4,mp-1223567,,KBa2(FeAs)6,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 2.0, 'Fe': 6.0, 'As': 6.0}",GGA,mp-1223567,"['mp-1223567', 'mp-1374097', 'mp-1656306', 'mp-1808539']",1.3326448,"{'K': 1.0, 'Ba': 2.0, 'Fe': 6.0, 'As': 6.0}",298.92336486922324,[],FM,True,12,2,"[0.0, 0.0, 0.0, 0.3, 0.3, 0.1, 0.3, 0.1, 0.3, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0044581486649028,1.3326448,6,1.3326448,MP,data/source/MP/cleaned/cifs/MP-mp-1223567.cif,True,,data/final/MP/graphs/As2Ba0.833Fe2K0.167-MP-mp-1223567-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
B1.96C0.04Mg1,2,0.0266666666666666,1.0,True,B1.96C0.04Mg1,B2Mg1,36.25,Other,True,B65.333C1.333Mg33.333,B-C-Mg,3,Supercon,Mg1B1.96C0.04,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B1.96C0.04Mg1-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B1.96C0.04Mg1-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ga0.2Nb3Sn0.8,3,0.0999999999999999,2.0,False,Ga0.4Nb6Sn1.6,Nb6Sn2,17.4,Other,True,Ga5Nb75Sn20,Ga-Nb-Sn,3,Supercon,Nb3Sn0.8Ga0.2,MP-mp-1326,Nb6Sn2,Nb-Sn,Nb75Sn25,P m -3 n,cubic,5.334611,5.334611,5.334611,data/final/MP/cifs/Ga0.2Nb3Sn0.8-MP-mp-1326-synth_doped.cif,data/source/MP/raw/cifs/mp-1326.cif,mp-1326,0.0,,2011-05-14 09:51:48,8.694218121896231,10.17188/1189484,"@misc{osti_1189484,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Sn (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189484"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668415'}},0.0,6.59372491,520.0,-69.93787048,-8.74223381,{'tags': ['Niobium tin (3/1)']},-69.93787048,-8.74223381,-0.163862066250001,"['xas', 'elasticity', 'bandstructure']",True,"[105230, 645503, 645489, 105231, 645498, 645485, 645474, 645496, 645480, 645488, 645482, 645487, 645500, 645493, 645477, 645484, 645502, 645483, 150878, 645479, 645481, 645486, 645473]",True,2021-05-12 10:56:12.755000,NM,8,9,mp-1326,,Nb3Sn,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Sn_d'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Sn': 1.0}",GGA,mp-1326,"['mp-930046', 'mp-913770', 'mp-930577', 'mp-1326', 'mp-1440651', 'mp-1668415', 'mp-1880085', 'mp-1594093', 'mp-1594507']",0.62023085,"{'Nb': 6.0, 'Sn': 2.0}",151.81275738025872,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0081709977567491,0.62023085,0,1.2404617,MP,data/source/MP/cleaned/cifs/MP-mp-1326.cif,True,,data/final/MP/graphs/Ga0.2Nb3Sn0.8-MP-mp-1326-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Mn1Sb1,1,0.0,2.0,False,Mn2Sb2,Mn2Sb2,0.0,Other,True,Mn50Sb50,Mn-Sb,2,Supercon,Mn1Sb1,MP-mp-786,Mn2Sb2,Mn-Sb,Mn50Sb50,P 63/m m c,hexagonal,4.100530003063719,4.10053074,5.612143,data/final/MP/cifs/Mn1Sb1-MP-mp-786.cif,data/source/MP/raw/cifs/mp-786.cif,mp-786,0.0,,2011-05-12 21:28:31,7.180776111183655,,,{'GGA': {'task_id': 'mp-1064897'}},0.0,7.26638109,520.0,-26.70344976,-6.67586244,"{'tags': ['Manganese antimonide (1/1)', 'Manganese antimony (1/1)', 'Manganese antimonide', 'Manganese(III) antimonide']}",-26.70344976,-6.67586244,-0.1263541739655176,"['bandstructure', 'elasticity']",True,"[643532, 603577, 191176, 643535, 643515, 643523, 191783, 643529, 643533, 76620, 643517, 54266, 163322, 53970, 643514, 76258, 643530, 601839, 643519, 76212, 643511, 643522, 643527, 643513]",True,2021-05-12 10:56:31.128000,FM,4,17,mp-786,,MnSb,"{'functional': 'PBE', 'labels': ['Mn_pv', 'Sb'], 'pot_type': 'paw'}","{'Mn': 1.0, 'Sb': 1.0}",GGA,mp-786,"['mp-905133', 'mp-919444', 'mp-918442', 'mp-786', 'mp-1064269', 'mp-1064220', 'mp-1064332', 'mp-1064897', 'mp-1064777', 'mp-1064828', 'mp-1440674', 'mp-1686748', 'mp-1800746', 'mp-1588671', 'mp-1587476', 'mp-1064879', 'mp-1064334']",3.15442765,"{'Mn': 2.0, 'Sb': 2.0}",81.72208746555096,[],FM,True,194,1,"[3.2, 3.2, 0.0, 0.0]",0.0771989005133946,3.15442765,2,6.3088553,MP,data/source/MP/cleaned/cifs/MP-mp-786.cif,False,,data/final/MP/graphs/Mn1Sb1-MP-mp-786.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Re1O3,1,0.0,1.0,True,Re1O3,Re1O3,0.0,Oxide,True,Re25O75,Re-O,2,Supercon,Re1O3,MP-mp-190,Re1O3,Re-O,Re25O75,P m -3 m,cubic,3.796324,3.796324,3.796324,data/final/MP/cifs/Re1O3-MP-mp-190.cif,data/source/MP/raw/cifs/mp-190.cif,mp-190,0.0,,2011-05-12 20:25:17,7.10813748506322,10.17188/1193781,"@misc{osti_1193781,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ReO3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1193781"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700855'}},0.0,1.93540255,520.0,-33.76895324,-8.44223831,{'tags': ['Rhenium(VI) oxide']},-33.76895324,-8.44223831,-2.13538576,"['xas', 'elasticity', 'bandstructure']",True,"[105546, 16810, 77679, 647350, 647352, 647365]",True,2021-05-12 10:56:14.760000,NM,4,14,mp-190,oxide,ReO3,"{'functional': 'PBE', 'labels': ['Re_pv', 'O'], 'pot_type': 'paw'}","{'Re': 1.0, 'O': 3.0}",GGA,mp-190,"['mp-991424', 'mp-993360', 'mp-190', 'mp-1023852', 'mp-1023881', 'mp-1022966', 'mp-1097746', 'mp-1140287', 'mp-1413084', 'mp-1700855', 'mp-1791209', 'mp-994665', 'mp-1023905', 'mp-1591255']",0.0008324,"{'Re': 1.0, 'O': 3.0}",54.71290967825269,[],NM,False,221,0,"[0, 0, 0, 0]",1.521395964672781e-05,0.0008324,0,0.0008324,MP,data/source/MP/cleaned/cifs/MP-mp-190.cif,False,,data/final/MP/graphs/Re1O3-MP-mp-190.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
As2Fe1.7Pt0.3Sr1,3,0.12,1.0,True,As2Fe1.7Pt0.3Sr1,As2Fe2Sr1,12.6,Ferrite,True,As40Fe34Pt6Sr20,As-Fe-Pt-Sr,4,Supercon,Sr1Fe1.7Pt0.3As2,MP-mp-4488,Sr1Fe2As2,As-Fe-Sr,As40Fe40Sr20,I 4/m m m,tetragonal,3.9729799997357778,3.9729799997357778,6.45523327,data/final/MP/cifs/As2Fe1.7Pt0.3Sr1-MP-mp-4488-synth_doped.cif,data/source/MP/raw/cifs/mp-4488.cif,mp-4488,0.0,,2011-05-13 03:37:13,6.319998834487784,10.17188/1208187,"@misc{osti_1208187,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr(FeAs)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208187"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672865'}},0.0,5.13397273,520.0,-30.61898897,-6.123797794,"{'tags': ['Strontium diiron arsenide - HT', 'Strontium diiron arsenide', 'Strontium diiron diarsenide', 'Iron strontium arsenide (2/1/2)', 'Strontium diiron arsenide - LT']}",-30.61898897,-6.123797794,-0.5342483613333335,"['xas', 'elasticity', 'bandstructure']",True,"[182330, 181993, 610527, 163209, 163208, 163869]",True,2021-05-12 10:56:20.740000,NM,5,8,mp-4488,,Sr(FeAs)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Fe': 2.0, 'As': 2.0}",GGA,mp-4488,"['mp-906356', 'mp-920135', 'mp-919110', 'mp-4488', 'mp-1439153', 'mp-1672865', 'mp-1873948', 'mp-1592272']",0.0029206,"{'Sr': 1.0, 'Fe': 2.0, 'As': 2.0}",91.7377588211838,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",3.183640016422098e-05,0.0029206,0,0.0029206,MP,data/source/MP/cleaned/cifs/MP-mp-4488.cif,True,,data/final/MP/graphs/As2Fe1.7Pt0.3Sr1-MP-mp-4488-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ba2Cu1Hg1O4.01,2,0.0012484394506866,0.9977515586034912,True,Ba1.995Cu0.998Hg0.998O4,Ba2Cu1Hg1O4,64.5,Cuprate,True,Ba24.969Cu12.484Hg12.484O50.06242197253433,Ba-Cu-Hg-O,4,Supercon,Hg1Ba2Cu1O4.01,MP-mp-6562,Ba2Cu1Hg1O4,Ba-Cu-Hg-O,Ba25Cu12.5Hg12.5O50,P 4/m m m,tetragonal,3.933714,3.933714,9.827602,data/final/MP/cifs/Ba2Cu1Hg1O4.01-MP-mp-6562-synth_doped.cif,data/source/MP/raw/cifs/mp-6562.cif,mp-6562,0.0,,2011-05-13 18:18:06,6.582036471328142,10.17188/1281336,"@misc{osti_1281336,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2CuHgO4 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281336"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697135'}},0.0234340381250053,2.58068675,520.0,-40.91481298,-5.1143516225,"{'tags': ['Mercury dibarium copper oxide', 'High pressure experimental phase']}",-40.91481298,-5.1143516225,-1.953767533125,"['xas', 'bandstructure']",True,"[75722, 75720, 75724, 75721, 75723]",True,2021-05-12 10:57:32.679000,NM,8,8,mp-6562,oxide,Ba2CuHgO4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Cu_pv', 'Hg', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",GGA,mp-6562,"['mp-6562', 'mp-990899', 'mp-992892', 'mp-1435690', 'mp-1697135', 'mp-1878488', 'mp-994198', 'mp-1592659']",0.0003984,"{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",152.07335344042525,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0, 0, 0]",2.619788352047311e-06,0.0003984,0,0.0003984,MP,data/source/MP/cleaned/cifs/MP-mp-6562.cif,True,,data/final/MP/graphs/Ba2Cu1Hg1O4.01-MP-mp-6562-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Be2Zr1,1,0.0,1.0,True,Be2Zr1,Be2Zr1,0.0,Other,True,Be66.667Zr33.333,Be-Zr,2,Supercon,Be2Zr1,MP-mp-1252,Zr1Be2,Be-Zr,Be66.667Zr33.333,P 6/m m m,hexagonal,3.237522,3.82206000139299,3.82206082,data/final/MP/cifs/Be2Zr1-MP-mp-1252.cif,data/source/MP/raw/cifs/mp-1252.cif,mp-1252,0.0,,2011-05-12 18:40:48,4.429202686272893,10.17188/1188954,"@misc{osti_1188954,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrBe2 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188954"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688482'}},0.028948296666666,3.27686516,520.0,-16.51830494,-5.506101646666667,"{'tags': ['Beryllium zirconium (2/1)', 'Zirconium beryllide (1/2)']}",-16.51830494,-5.506101646666667,-0.1639261933333339,"['xas', 'elasticity', 'bandstructure']",True,"[616515, 58756, 616512]",True,2021-05-12 10:56:12.755000,NM,3,10,mp-1252,,ZrBe2,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Be_sv'], 'pot_type': 'paw'}","{'Zr': 1.0, 'Be': 2.0}",GGA,mp-1252,"['mp-928233', 'mp-912111', 'mp-928731', 'mp-1252', 'mp-1062736', 'mp-1076908', 'mp-1439011', 'mp-1688482', 'mp-1791907', 'mp-1591518']",0.0015537,"{'Zr': 1.0, 'Be': 2.0}",40.95797578791586,[],NM,False,191,0,"[0, 0, 0]",3.79340035758896e-05,0.0015537,0,0.0015537,MP,data/source/MP/cleaned/cifs/MP-mp-1252.cif,False,,data/final/MP/graphs/Be2Zr1-MP-mp-1252.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ga1Sn1Sr1,1,0.0,4.0,False,Ga4Sn4Sr4,Ga4Sn4Sr4,0.0,Other,True,Ga33.333Sn33.333Sr33.333,Ga-Sn-Sr,3,Supercon,Sr1Ga1Sn1,MP-mp-8914,Sr4Ga4Sn4,Ga-Sn-Sr,Ga33.333Sn33.333Sr33.333,P 63/m m c,hexagonal,4.633228003271462,4.63322874,18.797509,data/final/MP/cifs/Ga1Sn1Sr1-MP-mp-8914.cif,data/source/MP/raw/cifs/mp-8914.cif,mp-8914,0.0,,2011-06-05 22:07:34,5.24690487101312,10.17188/1312825,"@misc{osti_1312825,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SrGaSn (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1312825"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1708067'}},0.0,4.38739537,520.0,-41.37104476,-3.447587063333333,"{'tags': ['Strontium gallium stannide (1/1/1)', 'Strontium gallium tin (1/1/1)']}",-41.37104476,-3.447587063333333,-0.5385332863888888,"['xas', 'bandstructure']",True,"[166387, 66003]",True,2021-05-12 10:57:55.580000,NM,12,8,mp-8914,,SrGaSn,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ga_d', 'Sn_d'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Ga': 1.0, 'Sn': 1.0}",GGA,mp-8914,"['mp-922782', 'mp-923561', 'mp-908450', 'mp-8914', 'mp-1426373', 'mp-1708067', 'mp-1836187', 'mp-1598583']",0.0003325,"{'Sr': 4.0, 'Ga': 4.0, 'Sn': 4.0}",349.460721870201,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.80586405499957e-06,0.0003325,0,0.00133,MP,data/source/MP/cleaned/cifs/MP-mp-8914.cif,False,,data/final/MP/graphs/Ga1Sn1Sr1-MP-mp-8914.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Bi2Ca1Cu2Sr2O8.01,2,0.0006218076837663,1.9976006242197253,False,Bi3.995Ca1.998Cu3.995Sr3.995O16,Bi4Ca2Cu4Sr4O16,0.0,Cuprate,True,Bi13.324Ca6.662Cu13.324Sr13.324O53.364423717521646,Bi-Ca-Cu-Sr-O,5,Supercon,Bi2Sr2Ca1Cu2O8.01,MP-mp-1218930,Sr4Ca2Cu4Bi4O16,Bi-Ca-Cu-Sr-O,Bi13.333Ca6.667Cu13.333Sr13.333O53.333333333333336,C c c 2,orthorhombic,5.417115,5.472898000129128,16.11398919,data/final/MP/cifs/Bi2Ca1Cu2Sr2O8.01-MP-mp-1218930-synth_doped.cif,data/source/MP/raw/cifs/mp-1218930.cif,mp-1218930,0.0,,2019-01-12 20:01:06.544000,6.266668983881059,,,,0.039252223722225,4.51768334,520.0,-173.15021002,-5.771673667333333,{'tags': []},-173.15021002,-5.771673667333333,-2.074956548222222,[],False,[],True,2021-05-12 11:00:42.526000,NM,30,3,mp-1218930,oxide,Sr2CaCu2(BiO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",GGA,mp-1218930,"['mp-1218930', 'mp-1359698', 'mp-1817714']",0.00011165,"{'Sr': 4.0, 'Ca': 2.0, 'Cu': 4.0, 'Bi': 4.0, 'O': 16.0}",470.7976286073367,[],NM,False,37,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.743014544498498e-07,0.00011165,0,0.0002233,MP,data/source/MP/cleaned/cifs/MP-mp-1218930.cif,True,,data/final/MP/graphs/Bi2Ca1Cu2Sr2O8.01-MP-mp-1218930-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Ir3V1,1,0.0,2.0,False,Ir6V2,Ir6V2,0.0,Other,True,Ir75V25,Ir-V,2,Supercon,Ir3V1,MP-mp-865496,V2Ir6,Ir-V,Ir75V25,P 63/m m c,hexagonal,4.357791,5.465859995403375,5.46586033,data/final/MP/cifs/Ir3V1-MP-mp-865496.cif,data/source/MP/raw/cifs/mp-865496.cif,mp-865496,0.0,,2014-08-31 09:40:48,18.485992220668543,10.17188/1310775,"@misc{osti_1310775,
    author = ""Persson, Kristin"",
    title = ""Materials Data on VIr3 (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1310775"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1754012'}},0.0,9.09781236,520.0,-75.34714804,-9.418393505,{'tags': []},-75.34714804,-9.418393505,-0.5185941725000003,"['bandstructure', 'elasticity']",True,[],True,2021-05-12 10:56:33.121000,NM,8,8,mp-865496,,VIr3,"{'functional': 'PBE', 'labels': ['V_pv', 'Ir'], 'pot_type': 'paw'}","{'V': 1.0, 'Ir': 3.0}",GGA,mp-865496,"['mp-865496', 'mp-1052895', 'mp-1052882', 'mp-1385950', 'mp-1754012', 'mp-1805082', 'mp-1618796', 'mp-1052898']",9.57e-05,"{'V': 2.0, 'Ir': 6.0}",112.74935656307134,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.6975706632341792e-06,9.57e-05,0,0.0001914,MP,data/source/MP/cleaned/cifs/MP-mp-865496.cif,False,,data/final/MP/graphs/Ir3V1-MP-mp-865496.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Re1,1,0.0,2.0,False,Re2,Re2,2.581333333,Other,True,Re100,Re,1,Supercon,Re1,MP-mp-8,Re2,Re,Re100,P 63/m m c,hexagonal,2.781049995862666,2.78105004,4.497136,data/final/MP/cifs/Re1-MP-mp-8.cif,data/source/MP/raw/cifs/mp-8.cif,mp-8,0.0,,2011-05-12 19:45:09,20.53008937068705,10.17188/1307890,"@misc{osti_1307890,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Re (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1307890"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686756'}},0.0,7.22936518,520.0,-24.88905437,-12.444527185,"{'tags': ['Rhenium hydride (1/0.25)', 'Rhenium', 'High pressure experimental phase']}",-24.88905437,-12.444527185,0.0,"['eos', 'elasticity', 'bandstructure', 'surfaces']",True,"[650067, 650066, 40355, 181195, 650069, 187306, 169880, 64719, 650068, 56135, 109248, 638452, 426968, 650071]",True,2021-05-12 10:56:31.128000,NM,2,21,mp-8,,Re,"{'functional': 'PBE', 'labels': ['Re_pv'], 'pot_type': 'paw'}",{'Re': 1.0},GGA,mp-8,"['mp-905010', 'mp-919350', 'mp-918360', 'mp-8', 'mp-1059662', 'mp-1059838', 'mp-1059732', 'mp-1061251', 'mp-1061334', 'mp-1061474', 'mp-1061537', 'mp-1061811', 'mp-1061748', 'mp-1440583', 'mp-1686756', 'mp-1791863', 'mp-1588011', 'mp-1593851', 'mp-1059784', 'mp-1061404', 'mp-1061778']",6.48e-05,{'Re': 2.0},30.12203136493589,[],NM,False,194,0,"[0, 0]",4.302498673806684e-06,6.48e-05,0,0.0001296,MP,data/source/MP/cleaned/cifs/MP-mp-8.cif,False,,data/final/MP/graphs/Re1-MP-mp-8.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Ca0.1Cu4Y0.9O8,2,0.0133333333333333,1.0,True,Ba2Ca0.1Cu4Y0.9O8,Ba2Cu4Y1O8,87.35714286,Cuprate,True,Ba13.333Ca0.667Cu26.667Y6O53.333333333333336,Ba-Ca-Cu-Y-O,5,Supercon,Y0.9Ca0.1Ba2Cu4O8,MP-mp-6790,Ba2Y1Cu4O8,Ba-Cu-Y-O,Ba13.333Cu26.667Y6.667O53.333333333333336,C m m m,orthorhombic,3.889922,3.899603999537882,13.88942687,data/final/MP/cifs/Ba2Ca0.1Cu4Y0.9O8-MP-mp-6790-synth_doped.cif,data/source/MP/raw/cifs/mp-6790.cif,mp-6790,0.0,,2011-05-16 03:21:24,5.936250568336678,10.17188/1283441,"@misc{osti_1283441,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Y(CuO2)4 (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1283441"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686864'}},0.0,3.31391536,520.0,-91.58381472,-6.105587648,"{'tags': ['Yttrium barium copper oxide (1/2/4/8)', 'High pressure experimental phase']}",-91.58381472,-6.105587648,-2.0529924817777783,"['xas', 'bandstructure']",True,"[72261, 85273, 74251, 400273, 85277, 85275, 400280, 67632, 85272, 67631, 83920, 66613, 85279, 400277, 75689, 74259, 85278, 85280, 66603, 94265, 400276, 88873, 71417, 75712, 97052, 66605, 72258, 85281, 85274, 400279, 66604, 69698]",True,2021-05-12 10:57:34.594000,NM,15,10,mp-6790,oxide,Ba2Y(CuO2)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-6790,"['mp-1000664', 'mp-6790', 'mp-1007136', 'mp-1237713', 'mp-1440937', 'mp-1686864', 'mp-1834179', 'mp-1011883', 'mp-1590064', 'mp-1590433']",0.0004643,"{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",208.60454115924333,[],NM,False,65,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.225742533790601e-06,0.0004643,0,0.0004643,MP,data/source/MP/cleaned/cifs/MP-mp-6790.cif,True,,data/final/MP/graphs/Ba2Ca0.1Cu4Y0.9O8-MP-mp-6790-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Bi2Ca1Cu2Sr2O8.217,2,0.013309675582134,1.9470365340148472,False,Bi3.894Ca1.947Cu3.894Sr3.894O16,Bi4Ca2Cu4Sr4O16,0.0,Cuprate,True,Bi13.143Ca6.572Cu13.143Sr13.143O53.99881711244004,Bi-Ca-Cu-Sr-O,5,Supercon,Bi2Sr2Ca1Cu2O8.217,MP-mp-1218930,Sr4Ca2Cu4Bi4O16,Bi-Ca-Cu-Sr-O,Bi13.333Ca6.667Cu13.333Sr13.333O53.333333333333336,C c c 2,orthorhombic,5.417115,5.472898000129128,16.11398919,data/final/MP/cifs/Bi2Ca1Cu2Sr2O8.217-MP-mp-1218930-synth_doped.cif,data/source/MP/raw/cifs/mp-1218930.cif,mp-1218930,0.0,,2019-01-12 20:01:06.544000,6.266668983881059,,,,0.039252223722225,4.51768334,520.0,-173.15021002,-5.771673667333333,{'tags': []},-173.15021002,-5.771673667333333,-2.074956548222222,[],False,[],True,2021-05-12 11:00:42.526000,NM,30,3,mp-1218930,oxide,Sr2CaCu2(BiO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",GGA,mp-1218930,"['mp-1218930', 'mp-1359698', 'mp-1817714']",0.00011165,"{'Sr': 4.0, 'Ca': 2.0, 'Cu': 4.0, 'Bi': 4.0, 'O': 16.0}",470.7976286073367,[],NM,False,37,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.743014544498498e-07,0.00011165,0,0.0002233,MP,data/source/MP/cleaned/cifs/MP-mp-1218930.cif,True,,data/final/MP/graphs/Bi2Ca1Cu2Sr2O8.217-MP-mp-1218930-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Ir3Si5Y2,1,0.0,2.0,False,Ir6Si10Y4,Ir6Si10Y4,3.005,Other,True,Ir30Si50Y20,Ir-Si-Y,3,Supercon,Y2Ir3Si5,MP-mp-1189012,Y4Si10Ir6,Ir-Si-Y,Ir30Si50Y20,I b a m,orthorhombic,5.848959999720539,8.14465683,8.144656829606705,data/final/MP/cifs/Ir3Si5Y2-MP-mp-1189012.cif,data/source/MP/raw/cifs/mp-1189012.cif,mp-1189012,0.0,,2019-01-11 19:52:29.679000,8.877360693332184,,,{'GGA': {'task_id': 'mp-1674734'}},0.0,8.03030999,520.0,-152.81910981,-7.6409554905,"{'tags': ['U2Co3Si5', 'Yttrium iridium silicide (2/3/5)', 'Y2Ir3Si5']}",-152.81910981,-7.6409554905,-0.9479751318333328,['bandstructure'],True,[641029],True,2021-05-12 10:58:33.577000,NM,20,5,mp-1189012,,Y2Si5Ir3,"{'functional': 'PBE', 'labels': ['Y_sv', 'Si', 'Ir'], 'pot_type': 'paw'}","{'Y': 2.0, 'Si': 5.0, 'Ir': 3.0}",GGA,mp-1189012,"['mp-1189012', 'mp-1426134', 'mp-1674734', 'mp-1812603', 'mp-1605214']",0.002001,"{'Y': 4.0, 'Si': 10.0, 'Ir': 6.0}",334.7842199390697,[],NM,False,72,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.1953968441906728e-05,0.002001,0,0.004002,MP,data/source/MP/cleaned/cifs/MP-mp-1189012.cif,False,,data/final/MP/graphs/Ir3Si5Y2-MP-mp-1189012.json,0,True,mmm,0,0,0,7,0,0,0,0,0,1,0,1.0,False
H0.983Pd1,2,0.0085728693898134,2.0,False,H1.966Pd2,H2Pd2,7.355,Other,True,H49.571Pd50.429,H-Pd,2,Supercon,H0.983Pd1,MP-mp-1184548,H2Pd2,H-Pd,H50Pd50,P 63 m c,hexagonal,2.968136003881316,2.96813585,5.040799,data/final/MP/cifs/H0.983Pd1-MP-mp-1184548-synth_doped.cif,data/source/MP/raw/cifs/mp-1184548.cif,mp-1184548,0.0,,2019-01-11 12:52:40.348000,9.276812227294194,,,{'GGA': {'task_id': 'mp-1734957'}},0.0,3.52113336,520.0,-17.47744839,-4.3693620975,{'tags': []},-17.47744839,-4.3693620975,-0.0830581699999992,['bandstructure'],True,[],True,2021-05-12 10:58:27.755000,NM,4,5,mp-1184548,,HPd,"{'functional': 'PBE', 'labels': ['H', 'Pd'], 'pot_type': 'paw'}","{'H': 1.0, 'Pd': 1.0}",GGA,mp-1184548,"['mp-1184548', 'mp-1426775', 'mp-1734957', 'mp-1792734', 'mp-1612181']",3.7e-05,"{'H': 2.0, 'Pd': 2.0}",38.45896345503417,[],NM,False,186,0,"[0, 0, 0, 0]",1.924128820749941e-06,3.7e-05,0,7.4e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1184548.cif,True,,data/final/MP/graphs/H0.983Pd1-MP-mp-1184548-synth_doped.json,0,True,6mm,0,5,0,0,0,0,0,1,0,0,0,1.0,False
Nb0.69Pd0.31,2,0.0466666666666666,3.0,False,Nb2.07Pd0.93,Nb2Pd1,1.84,Other,True,Nb69Pd31,Nb-Pd,2,Supercon,Nb0.69Pd0.31,MP-mp-1220678,Nb2Pd1,Nb-Pd,Nb66.667Pd33.333,F m m m,orthorhombic,2.8240621319204884,2.82406213,6.78333523,data/final/MP/cifs/Nb0.69Pd0.31-MP-mp-1220678-synth_doped.cif,data/source/MP/raw/cifs/mp-1220678.cif,mp-1220678,0.0,,2019-01-12 21:29:16.302000,9.433924184220336,,,{'GGA': {'task_id': 'mp-1764792'}},0.0,5.1760297,520.0,-26.07874005,-8.69291335,{'tags': []},-26.07874005,-8.69291335,-0.2320827199999998,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,3,5,mp-1220678,,Nb2Pd,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Pd'], 'pot_type': 'paw'}","{'Nb': 2.0, 'Pd': 1.0}",GGA,mp-1220678,"['mp-1220678', 'mp-1427348', 'mp-1764792', 'mp-1792829', 'mp-1612674']",0.0072664,"{'Nb': 2.0, 'Pd': 1.0}",51.43818256797303,[],NM,False,69,0,"[0, 0, 0]",0.0001412647111005,0.0072664,0,0.0072664,MP,data/source/MP/cleaned/cifs/MP-mp-1220678.cif,True,,data/final/MP/graphs/Nb0.69Pd0.31-MP-mp-1220678-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,0,0,1,1.0,False
Al0.964Nb3Si0.036,2,0.018,2.0,False,Al1.928Nb6Si0.072,Al2Nb6,18.4,Other,True,Al24.1Nb75Si0.9,Al-Nb-Si,3,Supercon,Nb3Al0.964Si0.036,MP-mp-796,Nb6Al2,Al-Nb,Al25Nb75,P m -3 n,cubic,5.215254,5.215254,5.215254,data/final/MP/cifs/Al0.964Nb3Si0.036-MP-mp-796-synth_doped.cif,data/source/MP/raw/cifs/mp-796.cif,mp-796,0.0,,2011-05-13 16:07:37,7.157298025966356,,,{'GGA': {'task_id': 'mp-1686893'}},0.0460773865000003,5.52947534,520.0,-69.48918494,-8.6861481175,"{'tags': ['Aluminium niobium (1/3)', 'Niobium aluminide (3/1)', 'Aluminum niobium (1/3)']}",-69.48918494,-8.6861481175,-0.1737753800000003,"['bandstructure', 'elasticity']",True,"[608675, 608654, 608688, 608668, 608669, 608685, 608676, 608683, 58014, 608657, 107856, 608655, 608666, 608691, 608656, 608665, 608673, 608653, 608661]",True,2021-05-12 10:56:31.128000,NM,8,10,mp-796,,Nb3Al,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Al': 1.0}",GGA,mp-796,"['mp-911586', 'mp-927906', 'mp-796', 'mp-927472', 'mp-1260512', 'mp-1440919', 'mp-1686893', 'mp-1927652', 'mp-1591599', 'mp-1587739']",0.16323955,"{'Nb': 6.0, 'Al': 2.0}",141.8490379078192,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0023015954483396,0.16323955,0,0.3264791,MP,data/source/MP/cleaned/cifs/MP-mp-796.cif,True,,data/final/MP/graphs/Al0.964Nb3Si0.036-MP-mp-796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Cu2La2Ti2O11,1,0.0,1.0,True,Ba2Cu2La2Ti2O11,Ba2Cu2La2Ti2O11,0.0,Cuprate,True,Ba10.526Cu10.526La10.526Ti10.526O57.89473684210527,Ba-Cu-La-Ti-O,5,Supercon,La2Ba2Cu2Ti2O11,MP-mp-1214655,Ba2La2Ti2Cu2O11,Ba-Cu-La-Ti-O,Ba10.526Cu10.526La10.526Ti10.526O57.89473684210527,P 4/m m m,tetragonal,3.960973,3.960973,16.024023,data/final/MP/cifs/Ba2Cu2La2Ti2O11-MP-mp-1214655.cif,data/source/MP/raw/cifs/mp-1214655.cif,mp-1214655,0.0,,2019-01-12 16:27:43.683000,6.28324683576035,,,,0.015037209078951,5.28889849,520.0,-142.6844791,-7.50970942631579,"{'tags': ['high-Tc cuprate family', 'Ba2Cu2La2Ti2O11', 'Ba2Cu2Eu2Ti2O11']}",-142.6844791,-7.50970942631579,-3.058660779035088,[],False,[],True,2021-05-12 11:00:37.845000,NM,19,3,mp-1214655,oxide,Ba2La2Ti2Cu2O11,"{'functional': 'PBE', 'labels': ['Ba_sv', 'La', 'Ti_pv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'La': 2.0, 'Ti': 2.0, 'Cu': 2.0, 'O': 11.0}",GGA,mp-1214655,"['mp-1214655', 'mp-1368752', 'mp-1776995']",0.0004888,"{'Ba': 2.0, 'La': 2.0, 'Ti': 2.0, 'Cu': 2.0, 'O': 11.0}",251.40581793228893,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.94426685913708e-06,0.0004888,0,0.0004888,MP,data/source/MP/cleaned/cifs/MP-mp-1214655.cif,False,,data/final/MP/graphs/Ba2Cu2La2Ti2O11-MP-mp-1214655.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ce0.052La0.948Sn3,2,0.026,1.0,True,Ce0.052La0.948Sn3,La1Sn3,1.92,Other,True,Ce1.3La23.7Sn75,Ce-La-Sn,3,Supercon,La0.9481Ce0.0519Sn3,MP-mp-633,La1Sn3,La-Sn,La25Sn75,P m -3 m,cubic,4.820061,4.820061,4.820061,data/final/MP/cifs/Ce0.052La0.948Sn3-MP-mp-633-synth_doped.cif,data/source/MP/raw/cifs/mp-633.cif,mp-633,0.0,,2011-05-13 04:30:54,7.340536659909055,10.17188/1279358,"@misc{osti_1279358,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaSn3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1279358"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688008'}},0.0,8.68748013,520.0,-19.26482408,-4.81620602,"{'tags': ['Lanthanum stannide (1/3)', 'Lanthanum tin (1/3)']}",-19.26482408,-4.81620602,-0.5750253525,"['xas', 'bandstructure']",True,"[641991, 104721, 641986, 261870, 104720, 151359, 642000, 641998, 191074]",True,2021-05-12 10:57:30.779000,NM,4,12,mp-633,,LaSn3,"{'functional': 'PBE', 'labels': ['La', 'Sn_d'], 'pot_type': 'paw'}","{'La': 1.0, 'Sn': 3.0}",GGA,mp-633,"['mp-991111', 'mp-993073', 'mp-633', 'mp-1066557', 'mp-1066573', 'mp-1066594', 'mp-1442023', 'mp-1688008', 'mp-1787436', 'mp-994393', 'mp-1590336', 'mp-1066601']",0.0055557,"{'La': 1.0, 'Sn': 3.0}",111.98441958300587,[],NM,False,221,0,"[0, 0, 0, 0]",4.961136576577034e-05,0.0055557,0,0.0055557,MP,data/source/MP/cleaned/cifs/MP-mp-633.cif,True,,data/final/MP/graphs/Ce0.052La0.948Sn3-MP-mp-633-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Mo0.75Re0.25,1,0.0,4.0,False,Mo3Re1,Mo3Re1,10.0,Other,True,Mo75Re25,Mo-Re,2,Supercon,Mo0.75Re0.25,MP-mp-1219493,Re1Mo3,Mo-Re,Mo75Re25,C m m m,orthorhombic,2.73022832,2.73022832,8.953999,data/final/MP/cifs/Mo0.75Re0.25-MP-mp-1219493.cif,data/source/MP/raw/cifs/mp-1219493.cif,mp-1219493,0.0,,2019-01-12 20:29:22.603000,12.534415736537218,,,{'GGA': {'task_id': 'mp-1733902'}},0.0651010393749977,8.41908862,520.0,-44.73776103,-11.1844402575,{'tags': []},-44.73776103,-11.1844402575,0.0609238112499994,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,4,5,mp-1219493,,ReMo3,"{'functional': 'PBE', 'labels': ['Re_pv', 'Mo_pv'], 'pot_type': 'paw'}","{'Re': 1.0, 'Mo': 3.0}",GGA,mp-1219493,"['mp-1219493', 'mp-1411836', 'mp-1733902', 'mp-1783881', 'mp-1615479']",0.007992,"{'Re': 1.0, 'Mo': 3.0}",62.79832811263168,[],NM,False,65,0,"[0.0, 0.0, -0.0, 0.0]",0.0001272645345854,0.007992,0,0.007992,MP,data/source/MP/cleaned/cifs/MP-mp-1219493.cif,False,,data/final/MP/graphs/Mo0.75Re0.25-MP-mp-1219493.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Re2Sc1,1,0.0,4.0,False,Re8Sc4,Re8Sc4,1.71,Other,True,Re66.667Sc33.333,Re-Sc,2,Supercon,Re2Sc1,MP-mp-11557,Sc4Re8,Re-Sc,Re66.667Sc33.333,P 63/m m c,hexagonal,5.302148001389928,5.30214812,8.60798,data/final/MP/cifs/Re2Sc1-MP-mp-11557.cif,data/source/MP/raw/cifs/mp-11557.cif,mp-11557,0.0,,2011-06-05 22:21:19,13.22801383185608,10.17188/1188062,"@misc{osti_1188062,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ScRe2 (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188062"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695124'}},0.0,5.98571358,520.0,-129.06395674,-10.755329728333336,{'tags': ['Rhenium scandium (2/1)']},-129.06395674,-10.755329728333336,-0.3481552366666669,"['xas', 'elasticity', 'bandstructure']",True,"[105890, 650085]",True,2021-05-12 10:56:12.755000,NM,12,9,mp-11557,,ScRe2,"{'functional': 'PBE', 'labels': ['Sc_sv', 'Re_pv'], 'pot_type': 'paw'}","{'Sc': 1.0, 'Re': 2.0}",GGA,mp-11557,"['mp-912781', 'mp-929135', 'mp-929547', 'mp-11557', 'mp-1103304', 'mp-1435067', 'mp-1695124', 'mp-1788722', 'mp-1598976']",5.895e-05,"{'Sc': 4.0, 'Re': 8.0}",209.57312349654777,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.1251442745418846e-06,5.895e-05,0,0.0002358,MP,data/source/MP/cleaned/cifs/MP-mp-11557.cif,False,,data/final/MP/graphs/Re2Sc1-MP-mp-11557.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Bi2Ca1Cu2Sr2O8.14,2,0.008630559225011,1.9656203931203933,False,Bi3.931Ca1.966Cu3.931Sr3.931O16,Bi4Ca2Cu4Sr4O16,81.0,Cuprate,True,Bi13.21Ca6.605Cu13.21Sr13.21O53.76486129458389,Bi-Ca-Cu-Sr-O,5,Supercon,Bi2Sr2Ca1Cu2O8.14,MP-mp-1218930,Sr4Ca2Cu4Bi4O16,Bi-Ca-Cu-Sr-O,Bi13.333Ca6.667Cu13.333Sr13.333O53.333333333333336,C c c 2,orthorhombic,5.417115,5.472898000129128,16.11398919,data/final/MP/cifs/Bi2Ca1Cu2Sr2O8.14-MP-mp-1218930-synth_doped.cif,data/source/MP/raw/cifs/mp-1218930.cif,mp-1218930,0.0,,2019-01-12 20:01:06.544000,6.266668983881059,,,,0.039252223722225,4.51768334,520.0,-173.15021002,-5.771673667333333,{'tags': []},-173.15021002,-5.771673667333333,-2.074956548222222,[],False,[],True,2021-05-12 11:00:42.526000,NM,30,3,mp-1218930,oxide,Sr2CaCu2(BiO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",GGA,mp-1218930,"['mp-1218930', 'mp-1359698', 'mp-1817714']",0.00011165,"{'Sr': 4.0, 'Ca': 2.0, 'Cu': 4.0, 'Bi': 4.0, 'O': 16.0}",470.7976286073367,[],NM,False,37,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.743014544498498e-07,0.00011165,0,0.0002233,MP,data/source/MP/cleaned/cifs/MP-mp-1218930.cif,True,,data/final/MP/graphs/Bi2Ca1Cu2Sr2O8.14-MP-mp-1218930-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Cu1Se1Te1,1,0.0,4.0,False,Cu4Se4Te4,Cu4Se4Te4,1.7000000000000002,Other,True,Cu33.333Se33.333Te33.333,Cu-Se-Te,3,Supercon,Cu1Se1Te1,MP-mp-1225744,Cu4Te4Se4,Cu-Se-Te,Cu33.333Se33.333Te33.333,P 21 3,cubic,6.400343,6.400343,6.400343,data/final/MP/cifs/Cu1Se1Te1-MP-mp-1225744.cif,data/source/MP/raw/cifs/mp-1225744.cif,mp-1225744,0.0,,2019-01-13 01:48:42.523000,6.842795699984449,,,{'GGA': {'task_id': 'mp-1746549'}},0.0032660208333328,6.09949047,520.0,-43.41869113,-3.618224260833333,{'tags': []},-43.41869113,-3.618224260833333,-0.3367512349479167,[],False,[],True,2021-05-12 11:00:54.298000,NM,12,4,mp-1225744,,CuTeSe,"{'functional': 'PBE', 'labels': ['Cu_pv', 'Te', 'Se'], 'pot_type': 'paw'}","{'Cu': 1.0, 'Te': 1.0, 'Se': 1.0}",GGA,mp-1225744,"['mp-1225744', 'mp-1389496', 'mp-1746549', 'mp-1776884']",0.000585575,"{'Cu': 4.0, 'Te': 4.0, 'Se': 4.0}",262.1861500989012,[],NM,False,198,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",8.933728952183186e-06,0.000585575,0,0.0023423,MP,data/source/MP/cleaned/cifs/MP-mp-1225744.cif,False,,data/final/MP/graphs/Cu1Se1Te1-MP-mp-1225744.json,0,True,23,1,0,0,0,0,0,0,1,0,0,0,1.0,False
Ir1Se2.9,2,0.0326340326340326,2.7588103448275865,False,Ir2.759Se8,Ir3Se8,0.0,Other,True,Ir25.641Se74.359,Ir-Se,2,Supercon,Ir1Se2.9,MP-mp-9888,Ir3Se8,Ir-Se,Ir27.273Se72.727,R -3,trigonal,6.06125485,6.06125485,6.06125495,data/final/MP/cifs/Ir1Se2.9-MP-mp-9888-synth_doped.cif,data/source/MP/raw/cifs/mp-9888.cif,mp-9888,0.0,,2011-05-29 06:34:51,9.01145573873218,10.17188/1316771,"@misc{osti_1316771,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ir3Se8 (SG:148) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1316771"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702947'}},0.0,6.17902764,520.0,-57.72140107,-5.247400097272728,{'tags': ['Iridium selenide (3/8)']},-57.72140107,-5.247400097272728,-0.6377107262499997,"['xas', 'elasticity', 'bandstructure']",True,[40823],True,2021-05-12 10:56:37.246000,NM,11,5,mp-9888,,Ir3Se8,"{'functional': 'PBE', 'labels': ['Ir', 'Se'], 'pot_type': 'paw'}","{'Ir': 3.0, 'Se': 8.0}",GGA,mp-9888,"['mp-9888', 'mp-1420458', 'mp-1702947', 'mp-1786803', 'mp-1602575']",0.0029716,"{'Ir': 3.0, 'Se': 8.0}",222.6589009653324,[],NM,False,148,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.334597443496172e-05,0.0029716,0,0.0029716,MP,data/source/MP/cleaned/cifs/MP-mp-9888.cif,True,,data/final/MP/graphs/Ir1Se2.9-MP-mp-9888-synth_doped.json,0,True,-3,0,0,0,0,0,0,2,1,0,0,0,1.0,False
Pd0.19Ti0.81,3,0.12,8.0,False,Pd1.52Ti6.48,Pd2Ti6,3.08,Other,True,Pd19Ti81,Pd-Ti,2,Supercon,Pd0.19Ti0.81,MP-mp-1079796,Ti6Pd2,Pd-Ti,Pd25Ti75,P m -3 n,cubic,5.062402,5.062402,5.062402,data/final/MP/cifs/Pd0.19Ti0.81-MP-mp-1079796-synth_doped.cif,data/source/MP/raw/cifs/mp-1079796.cif,mp-1079796,0.0,,2018-04-16 08:50:50,6.400084291337905,,,{'GGA': {'task_id': 'mp-1753631'}},0.0,5.87293662,520.0,-60.50496802,-7.5631210025,{'tags': ['Titanium palladium (3/1)']},-60.50496802,-7.5631210025,-0.3465315374999997,['bandstructure'],True,[167644],True,2021-05-12 10:58:16.596000,NM,8,5,mp-1079796,,Ti3Pd,"{'functional': 'PBE', 'labels': ['Ti_pv', 'Pd'], 'pot_type': 'paw'}","{'Ti': 3.0, 'Pd': 1.0}",GGA,mp-1079796,"['mp-1079796', 'mp-1389837', 'mp-1753631', 'mp-1788391', 'mp-1624029']",0.06889515,"{'Ti': 6.0, 'Pd': 2.0}",129.73880313804727,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0010620592811649,0.06889515,0,0.1377903,MP,data/source/MP/cleaned/cifs/MP-mp-1079796.cif,True,,data/final/MP/graphs/Pd0.19Ti0.81-MP-mp-1079796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Nd0.9Ni1Sr0.1O3,2,0.0399999999999999,4.0,False,Nd3.6Ni4Sr0.4O12,Nd4Ni4O12,0.0,Oxide,True,Nd18Ni20Sr2O60,Nd-Ni-Sr-O,4,Supercon,Nd0.9Sr0.1Ni1O3,MP-mp-22106,Nd4Ni4O12,Nd-Ni-O,Nd20Ni20O60,P n m a,orthorhombic,5.431762,5.495849,7.709429,data/final/MP/cifs/Nd0.9Ni1Sr0.1O3-MP-mp-22106-synth_doped.cif,data/source/MP/raw/cifs/mp-22106.cif,mp-22106,0.0,,2014-02-19 13:18:08,7.242194237367626,,,{'GGA+U': {'task_id': 'mp-1701351'}},0.0,3.99854667,520.0,-131.66600273,-6.5833001365,"{'tags': ['Neodymium nickel(III) oxide', 'Dineodymium niccolate', 'Neodymium niccolate', 'Neodymium nickel oxide', 'Neodymium niccolate(III)']}",-131.66600273,-6.5833001365,-2.425267555500001,"['xas', 'bandstructure']",True,"[155746, 67725, 164825, 67724, 416213, 78319, 164562, 155747, 67723, 69788, 155748, 67722, 24875, 416212]",True,2021-05-12 10:57:01.079000,FM,20,11,mp-22106,oxide,NdNiO3,"{'functional': 'PBE', 'labels': ['Nd_3', 'Ni_pv', 'O'], 'pot_type': 'paw'}","{'Nd': 1.0, 'Ni': 1.0, 'O': 3.0}",GGA+U,mp-22106,"['mp-919926', 'mp-918860', 'mp-905914', 'mp-602303', 'mp-25591', 'mp-1189695', 'mp-22106', 'mp-1416651', 'mp-1701351', 'mp-1930748', 'mp-1599871']",1.00005245,"{'Nd': 4.0, 'Ni': 4.0, 'O': 12.0}",230.14298278419733,[],FM,True,62,1,"[0.0, 0.0, 0.0, 0.0, 1.4, 1.4, 1.4, 1.4, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0173814111193255,1.00005245,4,4.0002098,MP,data/source/MP/cleaned/cifs/MP-mp-22106.cif,True,,data/final/MP/graphs/Nd0.9Ni1Sr0.1O3-MP-mp-22106-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
As1F0.18Fe1Nd1O0.82,3,0.09,2.0,False,As2F0.36Fe2Nd2O1.64,As2Fe2Nd2O2,49.66666667,Ferrite,True,As25F4.5Fe25Nd25O20.5,As-F-Fe-Nd-O,5,Supercon,Nd1Fe1As1F0.18O0.82,MP-mp-622621,Nd2Fe2As2O2,As-Fe-Nd-O,As25Fe25Nd25O25,P 4/n m m,tetragonal,4.074653,4.074653,9.170967,data/final/MP/cifs/As1F0.18Fe1Nd1O0.82-MP-mp-622621-synth_doped.cif,data/source/MP/raw/cifs/mp-622621.cif,mp-622621,0.0,,2014-02-16 22:28:25,6.347279619112142,10.17188/1278150,"@misc{osti_1278150,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NdFeAsO (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278150"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-1677677'}},0.2809314202083302,3.74777613,520.0,-52.70842543,-6.58855317875,{'tags': ['Neodymium iron arsenic oxide (1/1/1/1)']},-52.70842543,-6.58855317875,-1.61299541125,"['xas', 'bandstructure']",True,"[163547, 164679, 422001, 163546, 236651, 236650, 602466, 164680, 164676]",True,2021-05-12 10:57:28.836000,FM,8,8,mp-622621,oxide,NdFeAsO,"{'functional': 'PBE', 'labels': ['Nd_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Nd': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-622621,"['mp-622621', 'mp-1079381', 'mp-1173401', 'mp-1438697', 'mp-1677677', 'mp-1772072', 'mp-1926310', 'mp-1592869']",3.83954265,"{'Nd': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",152.26370404041757,[],FM,True,129,1,"[0.0, 0.0, 3.6, 3.6, -0.0, -0.0, -0.0, -0.0]",0.0504328024094411,3.83954265,2,7.6790853,MP,data/source/MP/cleaned/cifs/MP-mp-622621.cif,True,,data/final/MP/graphs/As1F0.18Fe1Nd1O0.82-MP-mp-622621-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ir1.2Os0.8Th1,3,0.1333333333333333,2.0,False,Ir2.4Os1.6Th2,Ir2Os2Th2,3.16,Other,True,Ir40Os26.667Th33.333,Ir-Os-Th,3,Supercon,Th1Ir1.2Os0.8,MP-mp-1217331,Th2Ir2Os2,Ir-Os-Th,Ir33.333Os33.333Th33.333,I m m a,orthorhombic,5.229975999739646,5.51065975,5.510659749819138,data/final/MP/cifs/Ir1.2Os0.8Th1-MP-mp-1217331-synth_doped.cif,data/source/MP/raw/cifs/mp-1217331.cif,mp-1217331,0.0,,2019-01-12 18:41:08.802000,17.693529320010914,,,{'GGA': {'task_id': 'mp-1760937'}},0.1405699283333366,8.83618928,520.0,-58.21941631,-9.703236051666666,{'tags': []},-58.21941631,-9.703236051666666,-0.5433510766666672,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,6,5,mp-1217331,,ThIrOs,"{'functional': 'PBE', 'labels': ['Th', 'Ir', 'Os_pv'], 'pot_type': 'paw'}","{'Th': 1.0, 'Ir': 1.0, 'Os': 1.0}",GGA,mp-1217331,"['mp-1217331', 'mp-1384641', 'mp-1760937', 'mp-1803919', 'mp-1626460']",9.775e-05,"{'Th': 2.0, 'Ir': 2.0, 'Os': 2.0}",115.33893883093477,[],NM,False,74,0,"[0, 0, 0, 0, 0, 0]",1.6950043236184645e-06,9.775e-05,0,0.0001955,MP,data/source/MP/cleaned/cifs/MP-mp-1217331.cif,True,,data/final/MP/graphs/Ir1.2Os0.8Th1-MP-mp-1217331-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,0,1,0,1.0,False
Mo0.8Pt0.2,3,0.1,8.0,False,Mo6.4Pt1.6,Mo6Pt2,4.56,Other,True,Mo80Pt20,Mo-Pt,2,Supercon,Mo0.8Pt0.2,MP-mp-1232,Mo6Pt2,Mo-Pt,Mo75Pt25,P m -3 n,cubic,5.021457,5.021457,5.021457,data/final/MP/cifs/Mo0.8Pt0.2-MP-mp-1232-synth_doped.cif,data/source/MP/raw/cifs/mp-1232.cif,mp-1232,0.0,,2011-05-14 07:33:46,12.666325713651156,10.17188/1188699,"@misc{osti_1188699,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Mo3Pt (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188699"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703333'}},0.0468418224999993,8.12451675,520.0,-78.11615432,-9.76451929,{'tags': ['Molybdenum platinum (3/1)']},-78.11615432,-9.76451929,-0.1125600900000005,"['xas', 'elasticity', 'bandstructure']",True,"[105071, 161106]",True,2021-05-12 10:56:12.755000,NM,8,8,mp-1232,,Mo3Pt,"{'functional': 'PBE', 'labels': ['Mo_pv', 'Pt'], 'pot_type': 'paw'}","{'Mo': 3.0, 'Pt': 1.0}",GGA,mp-1232,"['mp-906180', 'mp-919006', 'mp-920031', 'mp-1232', 'mp-1435577', 'mp-1703333', 'mp-1787044', 'mp-1597150']",0.00115405,"{'Mo': 6.0, 'Pt': 2.0}",126.61619092159891,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.822910627148136e-05,0.00115405,0,0.0023081,MP,data/source/MP/cleaned/cifs/MP-mp-1232.cif,True,,data/final/MP/graphs/Mo0.8Pt0.2-MP-mp-1232-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Cu1Mg1Sb1,1,0.0,1.0,True,Cu1Mg1Sb1,Cu1Mg1Sb1,0.0,Other,True,Cu33.333Mg33.333Sb33.333,Cu-Mg-Sb,3,Supercon,Cu1Mg1Sb1,MP-mp-3522,Mg1Cu1Sb1,Cu-Mg-Sb,Cu33.333Mg33.333Sb33.333,F -4 3 m,cubic,4.41277765,4.412777649999999,4.412777649999999,data/final/MP/cifs/Cu1Mg1Sb1-MP-mp-3522.cif,data/source/MP/raw/cifs/mp-3522.cif,mp-3522,0.0,,2011-05-12 20:25:00,5.728514683772858,10.17188/1206961,"@misc{osti_1206961,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MgCuSb (SG:216) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1206961"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1674343'}},0.0,6.26805234,520.0,-10.64358446,-3.5478614866666667,{'tags': ['Copper(I) magnesium antimonide']},-10.64358446,-3.5478614866666667,-0.3356988333333331,"['xas', 'elasticity', 'bandstructure']",True,"[77364, 412294]",True,2021-05-12 10:56:20.740000,NM,3,8,mp-3522,,MgCuSb,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Cu_pv', 'Sb'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Cu': 1.0, 'Sb': 1.0}",GGA,mp-3522,"['mp-927663', 'mp-911169', 'mp-927231', 'mp-3522', 'mp-1439519', 'mp-1674343', 'mp-1791294', 'mp-1592193']",8.2e-06,"{'Mg': 1.0, 'Cu': 1.0, 'Sb': 1.0}",60.76047169348475,[],NM,False,216,0,"[0, 0, 0]",1.3495616099503176e-07,8.2e-06,0,8.2e-06,MP,data/source/MP/cleaned/cifs/MP-mp-3522.cif,False,,data/final/MP/graphs/Cu1Mg1Sb1-MP-mp-3522.json,0,True,-43m,5,0,0,0,0,0,0,0,0,0,1,1.0,False
C8Cs1,1,0.0,1.0,True,C8Cs1,C8Cs1,0.0675,Carbon,True,C88.889Cs11.111,C-Cs,2,Supercon,C8Cs1,MP-mp-28861,Cs1C8,C-Cs,C88.889Cs11.111,P 6/m m m,hexagonal,4.976537996589497,4.97653771,6.12733,data/final/MP/cifs/C8Cs1-MP-mp-28861.cif,data/source/MP/raw/cifs/mp-28861.cif,mp-28861,0.0,,2014-02-24 07:04:04,2.893417415694679,10.17188/1202941,"@misc{osti_1202941,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CsC8 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1202941"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1705772'}},0.0,4.62417225,520.0,-75.12178257,-8.34686473,{'tags': ['Cesium carbide (1/8)']},-75.12178257,-8.34686473,-0.0457927331034461,"['xas', 'bandstructure']",True,[74641],True,2021-05-12 10:57:03.017000,NM,9,8,mp-28861,,CsC8,"{'functional': 'PBE', 'labels': ['Cs_sv', 'C'], 'pot_type': 'paw'}","{'Cs': 1.0, 'C': 8.0}",GGA,mp-28861,"['mp-1000671', 'mp-1007125', 'mp-28861', 'mp-1430028', 'mp-1705772', 'mp-1925194', 'mp-1011870', 'mp-1604210']",0.0005152,"{'Cs': 1.0, 'C': 8.0}",131.41850378006535,[],NM,False,191,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0]",3.920300301563392e-06,0.0005152,0,0.0005152,MP,data/source/MP/cleaned/cifs/MP-mp-28861.cif,False,,data/final/MP/graphs/C8Cs1-MP-mp-28861.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
As1La1,1,0.0,1.0,True,As1La1,As1La1,0.0,Other,True,As50La50,As-La,2,Supercon,As1La1,MP-mp-708,La1As1,As-La,As50La50,F m -3 m,cubic,4.38151929,4.381519289999999,4.381519289999999,data/final/MP/cifs/As1La1-MP-mp-708.cif,data/source/MP/raw/cifs/mp-708.cif,mp-708,0.0413999999999994,,2011-05-12 17:47:25,5.969701239775118,,,{'GGA': {'task_id': 'mp-1686551'}},0.0,5.87039302,520.0,-12.72249617,-6.361248085,"{'tags': ['Lanthanum arsenide (1/1)', 'Lanthanum arsenide - B1', 'Lanthanum arsenide']}",-12.72249617,-6.361248085,-1.5636853300000002,"['bandstructure', 'elasticity']",True,"[163361, 52008, 106265]",True,2021-05-12 10:56:29.056000,NM,2,8,mp-708,,LaAs,"{'functional': 'PBE', 'labels': ['La', 'As'], 'pot_type': 'paw'}","{'La': 1.0, 'As': 1.0}",GGA,mp-708,"['mp-919119', 'mp-906374', 'mp-920149', 'mp-708', 'mp-1440340', 'mp-1686551', 'mp-1795309', 'mp-1596395']",1.08e-05,"{'La': 1.0, 'As': 1.0}",59.478387438529246,[],NM,False,225,0,"[0, 0]",1.815785609716096e-07,1.08e-05,0,1.08e-05,MP,data/source/MP/cleaned/cifs/MP-mp-708.cif,False,,data/final/MP/graphs/As1La1-MP-mp-708.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
B4Lu1Ru4,1,0.0,4.0,False,B16Lu4Ru16,B16Lu4Ru16,2.0,Other,True,B44.444Lu11.111Ru44.444,B-Lu-Ru,3,Supercon,Lu1Ru4B4,MP-mp-568184,Lu4B16Ru16,B-Lu-Ru,B44.444Lu11.111Ru44.444,I 41/a c d,tetragonal,7.456733997406393,7.456733997406393,9.17382212,data/final/MP/cifs/B4Lu1Ru4-MP-mp-568184.cif,data/source/MP/raw/cifs/mp-568184.cif,mp-568184,0.0,,2015-02-14 21:52:17,9.905324978466046,10.17188/1274288,"@misc{osti_1274288,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Lu(BRu)4 (SG:142) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1274288"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1729688'}},0.0,6.89494169,520.0,-291.30306173,-8.091751714722223,{'tags': ['Lutetium ruthenium boride (1/4/4)']},-291.30306173,-8.091751714722223,-0.4988543565740744,"['xas', 'bandstructure']",True,[44440],True,2021-05-12 10:57:23.123000,NM,36,8,mp-568184,,Lu(BRu)4,"{'functional': 'PBE', 'labels': ['Lu_3', 'B', 'Ru_pv'], 'pot_type': 'paw'}","{'Lu': 1.0, 'B': 4.0, 'Ru': 4.0}",GGA,mp-568184,"['mp-933252', 'mp-943588', 'mp-943429', 'mp-568184', 'mp-1397742', 'mp-1729688', 'mp-1817019', 'mp-1623840']",0.0111344,"{'Lu': 4.0, 'B': 16.0, 'Ru': 16.0}",417.42017605846434,[],NM,False,142,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001066972862226,0.0111344,0,0.0445376,MP,data/source/MP/cleaned/cifs/MP-mp-568184.cif,False,,data/final/MP/graphs/B4Lu1Ru4-MP-mp-568184.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Rh1Y3,1,0.0,4.0,False,Rh4Y12,Rh4Y12,0.65,Other,True,Rh25Y75,Rh-Y,2,Supercon,Rh1Y3,MP-mp-1207780,Y12Rh4,Rh-Y,Rh25Y75,P n m a,orthorhombic,6.303588,7.242159,9.526733,data/final/MP/cifs/Rh1Y3-MP-mp-1207780.cif,data/source/MP/raw/cifs/mp-1207780.cif,mp-1207780,0.0,,2019-01-12 10:49:22.295000,5.645056148011324,,,{'GGA': {'task_id': 'mp-1708949'}},0.0,3.78051559,520.0,-115.16988947,-7.198118091875,"{'tags': ['Yttrium rhodium (3/1)', 'Fe3C', 'Y3Rh']}",-115.16988947,-7.198118091875,-0.5071877893750001,['bandstructure'],True,[650529],True,2021-05-12 10:58:39.488000,NM,16,5,mp-1207780,,Y3Rh,"{'functional': 'PBE', 'labels': ['Y_sv', 'Rh_pv'], 'pot_type': 'paw'}","{'Y': 3.0, 'Rh': 1.0}",GGA,mp-1207780,"['mp-1207780', 'mp-1430017', 'mp-1708949', 'mp-1818014', 'mp-1629921']",0.00204995,"{'Y': 12.0, 'Rh': 4.0}",434.9104762453561,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.885399512743413e-05,0.00204995,0,0.0081998,MP,data/source/MP/cleaned/cifs/MP-mp-1207780.cif,False,,data/final/MP/graphs/Rh1Y3-MP-mp-1207780.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Pd1Sn2,1,0.0,8.0,False,Pd8Sn16,Pd8Sn16,3.34,Other,True,Pd33.333Sn66.667,Pd-Sn,2,Supercon,Pd1Sn2,MP-mp-1573,Sn16Pd8,Pd-Sn,Pd33.333Sn66.667,I 41/a c d,tetragonal,6.601567998720824,6.601567998720824,13.25238475,data/final/MP/cifs/Pd1Sn2-MP-mp-1573.cif,data/source/MP/raw/cifs/mp-1573.cif,mp-1573,0.0,,2011-05-23 09:57:08,8.45032098798913,10.17188/1191347,"@misc{osti_1191347,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sn2Pd (SG:142) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191347"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1734223'}},0.0,7.76414121,520.0,-114.92187327,-4.78841138625,"{'tags': ['Palladium tin (16/32)', 'Palladium tin (1/2)']}",-114.92187327,-4.78841138625,-0.3887362129166671,"['xas', 'elasticity', 'bandstructure']",True,"[413281, 30235]",True,2021-05-12 10:56:12.755000,NM,24,5,mp-1573,,Sn2Pd,"{'functional': 'PBE', 'labels': ['Sn_d', 'Pd'], 'pot_type': 'paw'}","{'Sn': 2.0, 'Pd': 1.0}",GGA,mp-1573,"['mp-1573', 'mp-1427804', 'mp-1734223', 'mp-1880321', 'mp-1638380']",0.0002695125,"{'Sn': 16.0, 'Pd': 8.0}",540.5330788937158,[],NM,False,142,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.988840062134201e-06,0.0002695125,0,0.0021561,MP,data/source/MP/cleaned/cifs/MP-mp-1573.cif,False,,data/final/MP/graphs/Pd1Sn2-MP-mp-1573.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Cu2Fe1Sr2Y1O7.32,2,0.0221760221760221,1.9127136612021856,False,Cu3.825Fe1.913Sr3.825Y1.913O14,Cu4Fe2Sr4Y2O14,0.0,Cuprate,True,Cu15.015Fe7.508Sr15.015Y7.508O54.95495495495496,Cu-Fe-Sr-Y-O,5,Supercon,Fe1Sr2Y1Cu2O7.32,MP-mvc-771,Sr4Y2Fe2Cu4O14,Cu-Fe-Sr-Y-O,Cu15.385Fe7.692Sr15.385Y7.692O53.84615384615385,I m a 2,orthorhombic,5.428009999807786,5.524618000554629,12.28734132,data/final/MP/cifs/Cu2Fe1Sr2Y1O7.32-MP-mvc-771-synth_doped.cif,data/source/MP/raw/cifs/mvc-771.cif,mvc-771,0.0,,2017-12-02 01:24:31,5.309669206142082,10.17188/1322699,"@misc{osti_1322699,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr2YFeCu2O7 (SG:46) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1322699"",
    place = ""United States"",
    year = ""2014"",
    month = ""9"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-1680490'}},0.0199638557692258,3.37539656,520.0,-169.36345348,-6.51397898,{'tags': []},-169.36345348,-6.51397898,-2.353624607307692,"['xas', 'bandstructure']",True,[],True,2021-05-12 10:58:07.127000,FM,26,8,mvc-771,oxide,Sr2YFeCu2O7,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Y_sv', 'Fe_pv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Y': 1.0, 'Fe': 1.0, 'Cu': 2.0, 'O': 7.0}",GGA+U,mvc-771,"['mvc-771', 'mp-1042547', 'mp-1042574', 'mp-1345426', 'mp-1655657', 'mp-1680490', 'mp-1836639', 'mp-1042570']",4.95893815,"{'Sr': 4.0, 'Y': 2.0, 'Fe': 2.0, 'Cu': 4.0, 'O': 14.0}",349.6910649548837,[],FM,True,5,5,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 4.2, 4.2, -0.0, -0.0, 0.0, 0.0, 0.2, 0.2, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0283618236035844,4.95893815,4,9.9178763,MP,data/source/MP/cleaned/cifs/MP-mvc-771.cif,True,,data/final/MP/graphs/Cu2Fe1Sr2Y1O7.32-MP-mvc-771-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,0,1,0,1.0,False
Ru0.43V0.57,3,0.1399999999999999,2.0,False,Ru0.86V1.14,Ru1V1,2.92,Other,True,Ru43V57,Ru-V,2,Supercon,Ru0.43V0.57,MP-mp-1395,V1Ru1,Ru-V,Ru50V50,P m -3 m,cubic,3.014694,3.014694,3.014694,data/final/MP/cifs/Ru0.43V0.57-MP-mp-1395-synth_doped.cif,data/source/MP/raw/cifs/mp-1395.cif,mp-1395,0.0,,2011-05-12 19:37:14,9.21288886283982,10.17188/1189837,"@misc{osti_1189837,
    author = ""Persson, Kristin"",
    title = ""Materials Data on VRu (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189837"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688485'}},0.0,7.72767567,520.0,-18.82570789,-9.412853945,"{'tags': ['Ruthenium vanadium (1/1)', 'Ruthenium vanadium (1/1) - HT']}",-18.82570789,-9.412853945,-0.2337060825000012,"['xas', 'elasticity', 'bandstructure']",True,"[106010, 106011]",True,2021-05-12 10:56:12.755000,FiM,2,17,mp-1395,,VRu,"{'functional': 'PBE', 'labels': ['V_pv', 'Ru_pv'], 'pot_type': 'paw'}","{'V': 1.0, 'Ru': 1.0}",GGA,mp-1395,"['mp-991544', 'mp-993492', 'mp-2829', 'mp-1395', 'mp-1059722', 'mp-1059669', 'mp-1059766', 'mp-1059703', 'mp-1059619', 'mp-1059801', 'mp-1442257', 'mp-1688485', 'mp-1792970', 'mp-994797', 'mp-1591529', 'mp-1059798', 'mp-1059699']",0.647887,"{'V': 1.0, 'Ru': 1.0}",27.39868439535897,[],FiM,True,221,2,"[0.7, -0.1]",0.023646646337141,0.647887,2,0.647887,MP,data/source/MP/cleaned/cifs/MP-mp-1395.cif,True,,data/final/MP/graphs/Ru0.43V0.57-MP-mp-1395-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Pd0.009Pt2.991U1,2,0.0044999999999999,2.0,False,Pd0.018Pt5.982U2,Pt6U2,0.345,Heavy_fermion,True,Pd0.225Pt74.775U25,Pd-Pt-U,3,Supercon,U1Pt2.991Pd0.009,MP-mp-30855,U2Pt6,Pt-U,Pt75U25,P 63/m m c,hexagonal,4.997603,5.777009996166576,5.7770105,data/final/MP/cifs/Pd0.009Pt2.991U1-MP-mp-30855-synth_doped.cif,data/source/MP/raw/cifs/mp-30855.cif,mp-30855,0.0,,2014-02-19 21:36:23,18.929034548497903,10.17188/1205211,"@misc{osti_1205211,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UPt3 (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1205211"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687777'}},0.0,9.26919984,520.0,-64.84444661,-8.10555582625,"{'tags': ['Platinum uranium (3/1)', 'Uranium platinum boride (1/3/0.11)', 'Uranium platinum (1/3)']}",-64.84444661,-8.10555582625,-0.7295225412500006,"['xas', 'bandstructure']",True,"[615213, 649804, 105833, 191938]",True,2021-05-12 10:57:04.957000,FM,8,11,mp-30855,,UPt3,"{'functional': 'PBE', 'labels': ['U', 'Pt'], 'pot_type': 'paw'}","{'U': 1.0, 'Pt': 3.0}",GGA,mp-30855,"['mp-943077', 'mp-932790', 'mp-942062', 'mp-30855', 'mp-1078485', 'mp-1079639', 'mp-1092253', 'mp-1299942', 'mp-1687777', 'mp-1924669', 'mp-1595664']",0.6726182,"{'U': 2.0, 'Pt': 6.0}",144.44372324836635,[],FM,True,187,1,"[0.0, 1.4, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0093132215768691,0.6726182,1,1.3452364,MP,data/source/MP/cleaned/cifs/MP-mp-30855.cif,True,,data/final/MP/graphs/Pd0.009Pt2.991U1-MP-mp-30855-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Th2Zn1,1,0.0,2.0,False,Th4Zn2,Th4Zn2,0.67,Other,True,Th66.667Zn33.333,Th-Zn,2,Supercon,Th2Zn1,MP-mp-2387,Th4Zn2,Th-Zn,Th66.667Zn33.333,I 4/m c m,tetragonal,5.572681997586297,6.075191939715465,6.07519194,data/final/MP/cifs/Th2Zn1-MP-mp-2387.cif,data/source/MP/raw/cifs/mp-2387.cif,mp-2387,0.0,,2011-05-13 18:46:15,10.827184680446866,10.17188/1199772,"@misc{osti_1199772,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Th2Zn (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199772"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697305'}},0.0,6.48070644,520.0,-33.1156874,-5.519281233333333,"{'tags': ['Thorium zinc (2/1)', 'Zinc thorium (1/2)']}",-33.1156874,-5.519281233333333,-0.1567945300000003,"['xas', 'bandstructure']",True,"[653254, 102811]",True,2021-05-12 10:57:01.079000,NM,6,8,mp-2387,,Th2Zn,"{'functional': 'PBE', 'labels': ['Th', 'Zn'], 'pot_type': 'paw'}","{'Th': 2.0, 'Zn': 1.0}",GGA,mp-2387,"['mp-912330', 'mp-928346', 'mp-928863', 'mp-2387', 'mp-1423993', 'mp-1697305', 'mp-1926294', 'mp-1591947']",0.00028065,"{'Th': 4.0, 'Zn': 2.0}",162.4116984965109,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0]",3.4560318326580306e-06,0.00028065,0,0.0005613,MP,data/source/MP/cleaned/cifs/MP-mp-2387.cif,False,,data/final/MP/graphs/Th2Zn1-MP-mp-2387.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As1F1Fe1La0.2Sr0.8,3,0.0999999999999999,2.0,False,As2F2Fe2La0.4Sr1.6,As2F2Fe2Sr2,24.4,Ferrite,True,As25F25Fe25La5Sr20,As-F-Fe-La-Sr,5,Supercon,Sr0.8La0.2Fe1As1F1,MP-mp-20807,Sr2Fe2As2F2,As-F-Fe-Sr,As25F25Fe25Sr25,P 4/n m m,tetragonal,4.157413,4.157413,9.372332,data/final/MP/cifs/As1F1Fe1La0.2Sr0.8-MP-mp-20807-synth_doped.cif,data/source/MP/raw/cifs/mp-20807.cif,mp-20807,0.0,,2018-04-13 12:50:49,4.866742499159453,,,{'GGA+U': {'task_id': 'mp-1696380'}},0.2379540762499967,3.54876534,520.0,-41.4894831,-5.1861853875,"{'tags': ['Strontium iron arsenide fluoride', 'High pressure experimental phase', 'LaFeAsO', 'SrFeAsF lt']}",-41.4894831,-5.1861853875,-1.683160568541667,['bandstructure'],True,"[186506, 162808, 186507, 168774, 163916, 163915, 168775]",True,2021-05-12 10:58:49.477000,FM,8,12,mp-20807,,SrFeAsF,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Fe_pv', 'As', 'F'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Fe': 1.0, 'As': 1.0, 'F': 1.0}",GGA+U,mp-20807,"['mp-1078931', 'mp-1078979', 'mp-1079045', 'mp-1079606', 'mp-1080125', 'mp-1080447', 'mp-1091412', 'mp-20807', 'mp-1441549', 'mp-1696380', 'mp-1779098', 'mp-1595923']",3.9344288,"{'Sr': 2.0, 'Fe': 2.0, 'As': 2.0, 'F': 2.0}",161.99216280978374,[],FM,True,129,1,"[0.0, 0.0, 3.7, 3.7, 0.0, 0.0, 0.0, 0.0]",0.0485755450357179,3.9344288,2,7.8688576,MP,data/source/MP/cleaned/cifs/MP-mp-20807.cif,True,,data/final/MP/graphs/As1F1Fe1La0.2Sr0.8-MP-mp-20807-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ir1Sn2,1,0.0,1.0,True,Ir1Sn2,Ir1Sn2,0.715,Other,True,Ir33.333Sn66.667,Ir-Sn,2,Supercon,Ir1Sn2,MP-mp-2083,Sn2Ir1,Ir-Sn,Ir33.333Sn66.667,F m -3 m,cubic,4.55358524,4.55358524,4.55358524,data/final/MP/cifs/Ir1Sn2-MP-mp-2083.cif,data/source/MP/raw/cifs/mp-2083.cif,mp-2083,0.0,,2011-05-12 22:03:31,10.685758613057205,10.17188/1196030,"@misc{osti_1196030,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sn2Ir (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196030"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1674372'}},0.0,8.38124583,520.0,-17.75881578,-5.91960526,"{'tags': ['Iridium stannide (1/2)', 'Iridium tin (1/2)']}",-17.75881578,-5.91960526,-0.3004138833333331,"['xas', 'elasticity', 'bandstructure']",True,"[150761, 641054]",True,2021-05-12 10:56:14.760000,NM,3,8,mp-2083,,Sn2Ir,"{'functional': 'PBE', 'labels': ['Sn_d', 'Ir'], 'pot_type': 'paw'}","{'Sn': 2.0, 'Ir': 1.0}",GGA,mp-2083,"['mp-991018', 'mp-993009', 'mp-2083', 'mp-1439608', 'mp-1674372', 'mp-1795068', 'mp-994348', 'mp-1596311']",0.0017132,"{'Sn': 2.0, 'Ir': 1.0}",66.76447117989983,[],NM,False,225,0,"[0, 0, 0]",2.5660354522747684e-05,0.0017132,0,0.0017132,MP,data/source/MP/cleaned/cifs/MP-mp-2083.cif,False,,data/final/MP/graphs/Ir1Sn2-MP-mp-2083.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
As2Fe1.8Mn0.2Sr1,3,0.0799999999999999,1.0,True,As2Fe1.8Mn0.2Sr1,As2Fe2Sr1,0.0,Ferrite,True,As40Fe36Mn4Sr20,As-Fe-Mn-Sr,4,Supercon,Sr1Fe1.8Mn0.2As2,MP-mp-4488,Sr1Fe2As2,As-Fe-Sr,As40Fe40Sr20,I 4/m m m,tetragonal,3.9729799997357778,3.9729799997357778,6.45523327,data/final/MP/cifs/As2Fe1.8Mn0.2Sr1-MP-mp-4488-synth_doped.cif,data/source/MP/raw/cifs/mp-4488.cif,mp-4488,0.0,,2011-05-13 03:37:13,6.319998834487784,10.17188/1208187,"@misc{osti_1208187,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr(FeAs)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208187"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672865'}},0.0,5.13397273,520.0,-30.61898897,-6.123797794,"{'tags': ['Strontium diiron arsenide - HT', 'Strontium diiron arsenide', 'Strontium diiron diarsenide', 'Iron strontium arsenide (2/1/2)', 'Strontium diiron arsenide - LT']}",-30.61898897,-6.123797794,-0.5342483613333335,"['xas', 'elasticity', 'bandstructure']",True,"[182330, 181993, 610527, 163209, 163208, 163869]",True,2021-05-12 10:56:20.740000,NM,5,8,mp-4488,,Sr(FeAs)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Fe': 2.0, 'As': 2.0}",GGA,mp-4488,"['mp-906356', 'mp-920135', 'mp-919110', 'mp-4488', 'mp-1439153', 'mp-1672865', 'mp-1873948', 'mp-1592272']",0.0029206,"{'Sr': 1.0, 'Fe': 2.0, 'As': 2.0}",91.7377588211838,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",3.183640016422098e-05,0.0029206,0,0.0029206,MP,data/source/MP/cleaned/cifs/MP-mp-4488.cif,True,,data/final/MP/graphs/As2Fe1.8Mn0.2Sr1-MP-mp-4488-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As1Pd3,1,0.0,4.0,False,As4Pd12,As4Pd12,0.0,Other,True,As25Pd75,As-Pd,2,Supercon,As1Pd3,MP-mp-1105134,As4Pd12,As-Pd,As25Pd75,I -4,tetragonal,4.922701998731481,7.570468349622597,7.57046835,data/final/MP/cifs/As1Pd3-MP-mp-1105134.cif,data/source/MP/raw/cifs/mp-1105134.cif,mp-1105134,0.0,,2018-07-19 01:15:49,10.377107347408453,,,{'GGA': {'task_id': 'mp-1670106'}},0.0,5.66280066,520.0,-86.63060959,-5.414413099375,"{'tags': ['Palladium arsenide (3/1)', 'Tripalladium arsenide', 'Pd3As', 'Ni3P']}",-86.63060959,-5.414413099375,-0.3647221406250001,['bandstructure'],True,"[430924, 611183, 611189]",True,2021-05-12 10:58:20.361000,NM,16,6,mp-1105134,,AsPd3,"{'functional': 'PBE', 'labels': ['As', 'Pd'], 'pot_type': 'paw'}","{'As': 1.0, 'Pd': 3.0}",GGA,mp-1105134,"['mp-1105134', 'mp-1190139', 'mp-1430055', 'mp-1670106', 'mp-1775654', 'mp-1599308']",0.000168425,"{'As': 4.0, 'Pd': 12.0}",252.30689987932368,[],NM,False,82,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.670160825257752e-06,0.000168425,0,0.0006737,MP,data/source/MP/cleaned/cifs/MP-mp-1105134.cif,False,,data/final/MP/graphs/As1Pd3-MP-mp-1105134.json,0,True,-4,0,0,0,0,2,0,0,0,0,1,0,1.0,False
Ba1.7Cu3La0.3Y1O7,3,0.0461538461538461,1.0,True,Ba1.7Cu3La0.3Y1O7,Ba2Cu3Y1O7,57.45,Cuprate,True,Ba13.077Cu23.077La2.308Y7.692O53.84615384615385,Ba-Cu-La-Y-O,5,Supercon,Y1La0.3Ba1.7Cu3O7,MP-mp-20674,Ba2Y1Cu3O7,Ba-Cu-Y-O,Ba15.385Cu23.077Y7.692O53.84615384615385,P m m m,orthorhombic,3.844668,3.926152,11.823664,data/final/MP/cifs/Ba1.7Cu3La0.3Y1O7-MP-mp-20674-synth_doped.cif,data/source/MP/raw/cifs/mp-20674.cif,mp-20674,0.0,,2014-02-22 18:23:22,6.198285186087997,10.17188/1195834,"@misc{osti_1195834,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2YCu3O7 (SG:47) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195834"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686609'}},0.0313759126602519,3.28295453,520.0,-80.7708035,-6.213138730769231,"{'tags': ['Yttrium barium copper oxide (1/2/3/7)', 'Dibarium yttrium dicopper copper(III) oxide', 'Yttrium barium copper oxide (1/2/3/6.93)', 'Dibarium yttrium copper(III) dicopper oxide', 'High pressure experimental phase', 'Yttrium dibarium dicopper copper(III) oxide']}",-80.7708035,-6.213138730769231,-2.180157206282052,"['xas', 'elasticity', 'bandstructure']",True,"[196266, 196264, 196265, 71423, 66620, 63483, 66621, 164530, 56507, 63487, 66602, 66601, 68394, 63486, 63485, 202774, 62466, 62465, 41646, 65224, 202773, 66600, 63335, 66611, 78598, 66617, 81175, 66610, 66619, 66615, 63484, 86958, 262809, 66609, 184677, 202775, 66616, 63488, 66618, 66623, 202771, 66622, 202772, 77737, 202770, 62928, 77745]",True,2021-05-12 10:56:14.760000,NM,13,14,mp-20674,oxide,Ba2YCu3O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Cu': 3.0, 'O': 7.0}",GGA,mp-20674,"['mp-923155', 'mp-917354', 'mp-922372', 'mp-20674', 'mp-1103385', 'mp-1103741', 'mp-1103748', 'mp-1104329', 'mp-1104589', 'mp-1440689', 'mp-1686609', 'mp-1832558', 'mp-1596594', 'mp-1592890']",0.0001806,"{'Ba': 2.0, 'Y': 1.0, 'Cu': 3.0, 'O': 7.0}",178.47526348558395,[],NM,False,47,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.0119049355799813e-06,0.0001806,0,0.0001806,MP,data/source/MP/cleaned/cifs/MP-mp-20674.cif,True,,data/final/MP/graphs/Ba1.7Cu3La0.3Y1O7-MP-mp-20674-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Bi1Pd1Se1,1,0.0,4.0,False,Bi4Pd4Se4,Bi4Pd4Se4,1.0,Other,True,Bi33.333Pd33.333Se33.333,Bi-Pd-Se,3,Supercon,Bi1Pd1Se1,MP-mp-1095370,Bi4Pd4Se4,Bi-Pd-Se,Bi33.333Pd33.333Se33.333,P 21 3,cubic,6.536896,6.536896,6.536896,data/final/MP/cifs/Bi1Pd1Se1-MP-mp-1095370.cif,data/source/MP/raw/cifs/mp-1095370.cif,mp-1095370,0.0,,2018-04-27 18:55:05,9.377512692693434,,,{'GGA': {'task_id': 'mp-1699269'}},0.0,5.39536921,520.0,-54.74547775,-4.562123145833334,"{'tags': ['NiSbS', 'PdBiSe', 'Palladium bismuth selenide (1/1/1)', 'pyrite-marcasite family']}",-54.74547775,-4.562123145833334,-0.5308472799479164,['bandstructure'],True,"[239305, 616956]",True,2021-05-12 10:58:18.470000,NM,12,6,mp-1095370,,BiPdSe,"{'functional': 'PBE', 'labels': ['Bi', 'Pd', 'Se'], 'pot_type': 'paw'}","{'Bi': 1.0, 'Pd': 1.0, 'Se': 1.0}",GGA,mp-1095370,"['mp-1095370', 'mp-1102957', 'mp-1431156', 'mp-1699269', 'mp-1926143', 'mp-1608385']",1.5775e-05,"{'Bi': 4.0, 'Pd': 4.0, 'Se': 4.0}",279.32816386598336,[],NM,False,198,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.258991686576734e-07,1.5775e-05,0,6.31e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1095370.cif,False,,data/final/MP/graphs/Bi1Pd1Se1-MP-mp-1095370.json,0,True,23,1,0,0,0,0,0,0,1,0,0,0,1.0,False
Al1,1,0.0,4.0,False,Al4,Al4,1.254033333,Other,True,Al100,Al,1,Supercon,Al1,MP-mp-1183144,Al4,Al,Al100,P 63/m m c,hexagonal,2.8571459996723534,2.85714685,9.296985,data/final/MP/cifs/Al1-MP-mp-1183144.cif,data/source/MP/raw/cifs/mp-1183144.cif,mp-1183144,0.0,,2019-01-11 11:47:09.816000,2.726704024337018,,,{'GGA': {'task_id': 'mp-1712379'}},0.0114459724999997,8.05297754,520.0,-14.93651943,-3.7341298575,{'tags': []},-14.93651943,-3.7341298575,0.0114459724999997,['bandstructure'],True,[],True,2021-05-12 10:58:25.879000,NM,4,5,mp-1183144,,Al,"{'functional': 'PBE', 'labels': ['Al'], 'pot_type': 'paw'}",{'Al': 1.0},GGA,mp-1183144,"['mp-1183144', 'mp-1413168', 'mp-1712379', 'mp-1794253', 'mp-1614003']",3.025e-06,{'Al': 4.0},65.7260905802487,[],NM,False,194,0,"[0, 0, 0, 0]",1.840973636675747e-07,3.025e-06,0,1.21e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1183144.cif,False,,data/final/MP/graphs/Al1-MP-mp-1183144.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
B2Mg0.99Sn0.01,2,0.0066666666666666,1.0,True,B2Mg0.99Sn0.01,B2Mg1,33.5,Other,True,B66.667Mg33Sn0.333,B-Mg-Sn,3,Supercon,Mg0.99Sn0.01B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B2Mg0.99Sn0.01-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B2Mg0.99Sn0.01-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ce1Co0.95In5Ni0.05,2,0.0142857142857142,1.0,True,Ce1Co0.95In5Ni0.05,Ce1Co1In5,1.86,Heavy_fermion,True,Ce14.286Co13.571In71.429Ni0.714,Ce-Co-In-Ni,4,Supercon,Ce1Co0.95Ni0.05In5,MP-mp-19961,Ce1In5Co1,Ce-Co-In,Ce14.286Co14.286In71.429,P 4/m m m,tetragonal,4.635989,4.635989,7.564124,data/final/MP/cifs/Ce1Co0.95In5Ni0.05-MP-mp-19961-synth_doped.cif,data/source/MP/raw/cifs/mp-19961.cif,mp-19961,0.0,,2014-02-21 14:08:25,7.897022127398995,10.17188/1195145,"@misc{osti_1195145,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeIn5Co (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195145"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701944'}},0.0,7.80626318,520.0,-28.52795357,-4.075421938571429,{'tags': ['Cerium cobalt indium (1/1/5)']},-28.52795357,-4.075421938571429,-0.2468754242857146,"['xas', 'bandstructure']",True,[102108],True,2021-05-12 10:56:57.051000,FM,7,8,mp-19961,,CeIn5Co,"{'functional': 'PBE', 'labels': ['Ce', 'In_d', 'Co'], 'pot_type': 'paw'}","{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",GGA,mp-19961,"['mp-928775', 'mp-912209', 'mp-928270', 'mp-19961', 'mp-1504062', 'mp-1701944', 'mp-1785253', 'mp-1593180']",0.9310323,"{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",162.57113333428427,[],FM,True,123,1,"[0.7, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0057269226147644,0.9310323,1,0.9310323,MP,data/source/MP/cleaned/cifs/MP-mp-19961.cif,True,,data/final/MP/graphs/Ce1Co0.95In5Ni0.05-MP-mp-19961-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ti0.8Zr0.2,3,0.1,8.0,False,Ti6.4Zr1.6,Ti6Zr2,0.0,Other,True,Ti80Zr20,Ti-Zr,2,Supercon,Ti0.8Zr0.2,MP-mp-1183046,Zr2Ti6,Ti-Zr,Ti75Zr25,P 63/m m c,hexagonal,4.763093,6.066705998188113,6.06670642,data/final/MP/cifs/Ti0.8Zr0.2-MP-mp-1183046-synth_doped.cif,data/source/MP/raw/cifs/mp-1183046.cif,mp-1183046,0.0,,2019-01-11 11:42:41.617000,5.1368607488850575,,,{'GGA': {'task_id': 'mp-1731734'}},0.0312529124999994,5.37493703,520.0,-64.21833006,-8.0272912575,{'tags': []},-64.21833006,-8.0272912575,0.0312529124999994,['bandstructure'],True,[],True,2021-05-12 10:58:25.879000,NM,8,5,mp-1183046,,ZrTi3,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Ti_pv'], 'pot_type': 'paw'}","{'Zr': 1.0, 'Ti': 3.0}",GGA,mp-1183046,"['mp-1183046', 'mp-1385669', 'mp-1731734', 'mp-1924284', 'mp-1621980']",0.0026917,"{'Zr': 2.0, 'Ti': 6.0}",151.81882685801034,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",3.5459370299540414e-05,0.0026917,0,0.0053834,MP,data/source/MP/cleaned/cifs/MP-mp-1183046.cif,True,,data/final/MP/graphs/Ti0.8Zr0.2-MP-mp-1183046-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ni31Zr69,2,0.0466666666666666,0.0579693782141187,False,Ni1.797Zr4,Ni2Zr4,2.44,Other,True,Ni31Zr69,Ni-Zr,2,Supercon,Ni31Zr69,MP-mp-328,Zr4Ni2,Ni-Zr,Ni33.333Zr66.667,I 4/m c m,tetragonal,5.262569995425936,5.300086679397286,5.30008668,data/final/MP/cifs/Ni31Zr69-MP-mp-328-synth_doped.cif,data/source/MP/raw/cifs/mp-328.cif,mp-328,0.0,,2011-05-13 23:00:52,7.189329355994663,10.17188/1206385,"@misc{osti_1206385,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Zr2Ni (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1206385"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704571'}},0.0,5.05377097,520.0,-47.68946569,-7.948244281666667,{'tags': ['Nickel zirconium (1/2)']},-47.68946569,-7.948244281666667,-0.3230649683333328,"['xas', 'elasticity', 'bandstructure']",True,"[656070, 647167, 102805, 105479]",True,2021-05-12 10:56:20.740000,NM,6,11,mp-328,,Zr2Ni,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Ni_pv'], 'pot_type': 'paw'}","{'Zr': 2.0, 'Ni': 1.0}",GGA,mp-328,"['mp-918996', 'mp-919988', 'mp-906163', 'mp-604722', 'mp-328', 'mp-1076983', 'mp-1205320', 'mp-1413019', 'mp-1704571', 'mp-1802467', 'mp-1592827']",0.00134705,"{'Zr': 4.0, 'Ni': 2.0}",111.39417752247834,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0]",2.4185285621920005e-05,0.00134705,0,0.0026941,MP,data/source/MP/cleaned/cifs/MP-mp-328.cif,True,,data/final/MP/graphs/Ni31Zr69-MP-mp-328-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ca1Cl1Cu1Sm1O3,1,0.0,2.0,False,Ca2Cl2Cu2Sm2O6,Ca2Cl2Cu2Sm2O6,0.0,Cuprate,True,Ca14.286Cl14.286Cu14.286Sm14.286O42.85714285714286,Ca-Cl-Cu-Sm-O,5,Supercon,Ca1Sm1Cu1Cl1O3,MP-mp-620364,Ca2Sm2Cu2Cl2O6,Ca-Cl-Cu-Sm-O,Ca14.286Cl14.286Cu14.286Sm14.286O42.85714285714286,P 4/n m m,tetragonal,3.921618,3.921618,13.571283,data/final/MP/cifs/Ca1Cl1Cu1Sm1O3-MP-mp-620364.cif,data/source/MP/raw/cifs/mp-620364.cif,mp-620364,0.0,,2013-06-10 20:46:31,5.369304033090635,10.17188/1278023,"@misc{osti_1278023,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CaSmCuClO3 (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278023"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702820'}},0.0146560968749991,3.63975654,520.0,-87.73025745,-6.266446960714285,{'tags': ['Calcium samarium copper trioxide chloride']},-87.73025745,-6.266446960714285,-2.7177594807142853,"['xas', 'bandstructure']",True,[86428],True,2021-05-12 10:57:28.836000,NM,14,8,mp-620364,oxide,CaSmCuClO3,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Sm_3', 'Cu_pv', 'Cl', 'O'], 'pot_type': 'paw'}","{'Ca': 1.0, 'Sm': 1.0, 'Cu': 1.0, 'Cl': 1.0, 'O': 3.0}",GGA,mp-620364,"['mp-620364', 'mp-916797', 'mp-937365', 'mp-939923', 'mp-1475753', 'mp-1702820', 'mp-1882873', 'mp-1602835']",6.525e-05,"{'Ca': 2.0, 'Sm': 2.0, 'Cu': 2.0, 'Cl': 2.0, 'O': 6.0}",208.71395197319643,[],NM,False,129,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.252576733191231e-07,6.525e-05,0,0.0001305,MP,data/source/MP/cleaned/cifs/MP-mp-620364.cif,False,,data/final/MP/graphs/Ca1Cl1Cu1Sm1O3-MP-mp-620364.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Bi1Sb1,1,0.0,1.0,True,Bi1Sb1,Bi1Sb1,1.47,Other,True,Bi50Sb50,Bi-Sb,2,Supercon,Bi1Sb1,MP-mp-1227290,Bi1Sb1,Bi-Sb,Bi50Sb50,R 3 m,trigonal,4.499305376541022,4.499305376541021,4.72361771,data/final/MP/cifs/Bi1Sb1-MP-mp-1227290.cif,data/source/MP/raw/cifs/mp-1227290.cif,mp-1227290,0.1055999999999999,,2019-01-13 03:08:40.815000,7.940448998445383,,,{'GGA': {'task_id': 'mp-1730032'}},0.0,5.46382017,520.0,-8.02875942,-4.01437971,{'tags': []},-8.02875942,-4.01437971,-0.1008619350000001,['bandstructure'],True,[],True,2021-05-12 10:58:49.477000,NM,2,5,mp-1227290,,BiSb,"{'functional': 'PBE', 'labels': ['Bi', 'Sb'], 'pot_type': 'paw'}","{'Bi': 1.0, 'Sb': 1.0}",GGA,mp-1227290,"['mp-1227290', 'mp-1413325', 'mp-1730032', 'mp-1801701', 'mp-1610078']",0.0006589,"{'Bi': 1.0, 'Sb': 1.0}",69.16578082806613,[],NM,False,160,0,"[0, 0]",9.526387067586336e-06,0.0006589,0,0.0006589,MP,data/source/MP/cleaned/cifs/MP-mp-1227290.cif,False,,data/final/MP/graphs/Bi1Sb1-MP-mp-1227290.json,0,True,3m,0,0,0,0,0,0,5,1,0,0,0,1.0,False
Ni2Zn11,1,0.0,2.0,False,Ni4Zn22,Ni4Zn22,0.0,Other,True,Ni15.385Zn84.615,Ni-Zn,2,Supercon,Ni2Zn11,MP-mp-11532,Zn22Ni4,Ni-Zn,Ni15.385Zn84.615,I -4 3 m,cubic,7.763309801721006,7.763309800000001,7.7633098,data/final/MP/cifs/Ni2Zn11-MP-mp-11532.cif,data/source/MP/raw/cifs/mp-11532.cif,mp-11532,0.0,,2011-08-10 11:22:15,7.716607872975785,10.17188/1188038,"@misc{osti_1188038,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Zn11Ni2 (SG:217) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188038"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672625'}},0.0,4.03601861,520.0,-55.05540679,-2.1175156457692306,"{'tags': ['Nickel zinc (4/22)', 'Nickel zinc (2/11)', 'Nickel zinc (3/14)']}",-55.05540679,-2.1175156457692306,-0.162326948076923,"['xas', 'bandstructure']",True,"[424900, 105475, 647140]",True,2021-05-12 10:56:51.169000,NM,26,11,mp-11532,,Zn11Ni2,"{'functional': 'PBE', 'labels': ['Zn', 'Ni_pv'], 'pot_type': 'paw'}","{'Zn': 11.0, 'Ni': 2.0}",GGA,mp-11532,"['mp-912736', 'mp-929110', 'mp-929527', 'mp-11532', 'mp-1192385', 'mp-1194453', 'mp-1115688', 'mp-1431188', 'mp-1672625', 'mp-1843176', 'mp-1637798']",0.00259215,"{'Zn': 22.0, 'Ni': 4.0}",360.1793917893837,[],NM,False,217,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.4393660820637788e-05,0.00259215,0,0.0051843,MP,data/source/MP/cleaned/cifs/MP-mp-11532.cif,False,,data/final/MP/graphs/Ni2Zn11-MP-mp-11532.json,0,True,-43m,5,0,0,0,0,0,0,0,0,1,0,1.0,False
Fe3Lu1.9Si5Y0.1,2,0.02,4.0,False,Fe12Lu7.6Si20Y0.4,Fe12Lu8Si20,4.16,Other,True,Fe30Lu19Si50Y1,Fe-Lu-Si-Y,4,Supercon,Lu1.9Y0.1Fe3Si5,MP-mp-541557,Lu8Fe12Si20,Fe-Lu-Si,Fe30Lu20Si50,P 4/m n c,tetragonal,5.385917,10.270814,10.270814,data/final/MP/cifs/Fe3Lu1.9Si5Y0.1-MP-mp-541557-synth_doped.cif,data/source/MP/raw/cifs/mp-541557.cif,mp-541557,0.0,,2014-03-04 18:23:36,7.69125622397548,10.17188/1265154,"@misc{osti_1265154,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Lu2Fe3Si5 (SG:128) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1265154"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1746411'}},0.0,7.47471245,520.0,-273.951322,-6.84878305,{'tags': ['Lutetium iron silicide (2/3/5)']},-273.951322,-6.84878305,-0.6554334009999998,"['xas', 'bandstructure']",True,"[84198, 247832, 632470]",True,2021-05-12 10:57:10.838000,NM,40,10,mp-541557,,Lu2Fe3Si5,"{'functional': 'PBE', 'labels': ['Lu_3', 'Fe_pv', 'Si'], 'pot_type': 'paw'}","{'Lu': 2.0, 'Fe': 3.0, 'Si': 5.0}",GGA,mp-541557,"['mp-939885', 'mp-916724', 'mp-937397', 'mp-541557', 'mp-1170743', 'mp-1200451', 'mp-1255960', 'mp-1383694', 'mp-1746411', 'mp-1892871']",0.000409375,"{'Lu': 8.0, 'Fe': 12.0, 'Si': 20.0}",568.1583388804236,[],NM,False,90,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",2.8821190994516645e-06,0.000409375,0,0.0016375,MP,data/source/MP/cleaned/cifs/MP-mp-541557.cif,True,,data/final/MP/graphs/Fe3Lu1.9Si5Y0.1-MP-mp-541557-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Pt1Si1,1,0.0,4.0,False,Pt4Si4,Pt4Si4,0.88,Other,True,Pt50Si50,Pt-Si,2,Supercon,Pt1Si1,MP-mp-696,Si4Pt4,Pt-Si,Pt50Si50,P n m a,orthorhombic,3.639333,5.651347,5.978206,data/final/MP/cifs/Pt1Si1-MP-mp-696.cif,data/source/MP/raw/cifs/mp-696.cif,mp-696,0.0,,2011-05-13 06:44:23,12.055890181325836,10.17188/1284936,"@misc{osti_1284936,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SiPt (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1284936"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704326'}},0.0,9.15125464,520.0,-51.29827188,-6.412283985,"{'tags': ['Platinum silicide (1/1)', 'Platinum silicide']}",-51.29827188,-6.412283985,-0.6286731200000002,"['bandstructure', 'elasticity']",True,"[248491, 79238, 2623, 649603, 76627, 659967]",True,2021-05-12 10:56:29.056000,NM,8,11,mp-696,,SiPt,"{'functional': 'PBE', 'labels': ['Si', 'Pt'], 'pot_type': 'paw'}","{'Si': 1.0, 'Pt': 1.0}",GGA,mp-696,"['mp-908837', 'mp-923847', 'mp-696', 'mp-924430', 'mp-1078892', 'mp-1125278', 'mp-1138233', 'mp-1441139', 'mp-1704326', 'mp-1788091', 'mp-1589503']",0.000122275,"{'Si': 4.0, 'Pt': 4.0}",122.95456167894,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0]",3.977892266227113e-06,0.000122275,0,0.0004891,MP,data/source/MP/cleaned/cifs/MP-mp-696.cif,False,,data/final/MP/graphs/Pt1Si1-MP-mp-696.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Hg1Na1,1,0.0,4.0,False,Hg4Na4,Hg4Na4,0.0,Other,True,Hg50Na50,Hg-Na,2,Supercon,Hg1Na1,MP-mp-255,Na4Hg4,Hg-Na,Hg50Na50,C m c m,orthorhombic,5.396051,6.54550797,6.54550797,data/final/MP/cifs/Hg1Na1-MP-mp-255.cif,data/source/MP/raw/cifs/mp-255.cif,mp-255,0.0,,2011-05-13 19:55:45,6.938359664765078,10.17188/1200698,"@misc{osti_1200698,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NaHg (SG:63) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1200698"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1705092'}},0.0,1.87454718,520.0,-8.48186951,-1.06023368875,"{'tags': ['Sodium mercury (1/1)', 'Mercury sodium (1/1)']}",-8.48186951,-1.06023368875,-0.247130859525862,"['xas', 'elasticity', 'bandstructure']",True,"[33900, 104326]",True,2021-05-12 10:56:18.721000,NM,8,8,mp-255,,NaHg,"{'functional': 'PBE', 'labels': ['Na_pv', 'Hg'], 'pot_type': 'paw'}","{'Na': 1.0, 'Hg': 1.0}",GGA,mp-255,"['mp-921902', 'mp-922142', 'mp-907508', 'mp-255', 'mp-1419483', 'mp-1705092', 'mp-1832444', 'mp-1601415']",0.000534225,"{'Na': 4.0, 'Hg': 4.0}",214.0349934733024,[],NM,False,63,0,"[0, 0, 0, 0, 0, 0, 0, 0]",9.98388144537938e-06,0.000534225,0,0.0021369,MP,data/source/MP/cleaned/cifs/MP-mp-255.cif,False,,data/final/MP/graphs/Hg1Na1-MP-mp-255.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
La0.967Pr0.033Tl3,2,0.0165,1.0,True,La0.967Pr0.033Tl3,La1Tl3,1.16,Other,True,La24.175Pr0.825Tl75,La-Pr-Tl,3,Supercon,La0.967Pr0.033Tl3,MP-mp-2001,La1Tl3,La-Tl,La25Tl75,P m -3 m,cubic,4.907746,4.907746,4.907746,data/final/MP/cifs/La0.967Pr0.033Tl3-MP-mp-2001-synth_doped.cif,data/source/MP/raw/cifs/mp-2001.cif,mp-2001,0.0,,2011-05-13 03:01:14,10.564590817587634,10.17188/1195185,"@misc{osti_1195185,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaTl3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195185"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672173'}},0.0,7.0710754,520.0,-13.48295662,-3.370739155,{'tags': ['Lanthanum thallium (1/3)']},-13.48295662,-3.370739155,-0.3647550187499999,"['xas', 'elasticity', 'bandstructure']",True,"[642070, 642074, 104731, 191075]",True,2021-05-12 10:56:14.760000,NM,4,12,mp-2001,,LaTl3,"{'functional': 'PBE', 'labels': ['La', 'Tl_d'], 'pot_type': 'paw'}","{'La': 1.0, 'Tl': 3.0}",GGA,mp-2001,"['mp-912617', 'mp-929406', 'mp-929013', 'mp-2001', 'mp-1067206', 'mp-1067244', 'mp-1067279', 'mp-1437566', 'mp-1672173', 'mp-1784822', 'mp-1591944', 'mp-1067301']",0.0014032,"{'La': 1.0, 'Tl': 3.0}",118.20782685234924,[],NM,False,221,0,"[0, 0, 0, 0]",1.18706183622909e-05,0.0014032,0,0.0014032,MP,data/source/MP/cleaned/cifs/MP-mp-2001.cif,True,,data/final/MP/graphs/La0.967Pr0.033Tl3-MP-mp-2001-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Bi3Zn1,1,0.0,1.0,True,Bi3Zn1,Bi3Zn1,0.87,Other,True,Bi75Zn25,Bi-Zn,2,Supercon,Bi3Zn1,MP-mp-971718,Zn1Bi3,Bi-Zn,Bi75Zn25,I 4/m m m,tetragonal,5.045335999598357,5.792050260000001,5.0453359995983575,data/final/MP/cifs/Bi3Zn1-MP-mp-971718.cif,data/source/MP/raw/cifs/mp-971718.cif,mp-971718,0.0,,2015-09-15 19:30:27,9.89812477416886,10.17188/1313590,"@misc{osti_1313590,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZnBi3 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1313590"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1760793'}},0.1775809224999993,5.64799493,520.0,-12.21952285,-3.0548807125,{'tags': []},-12.21952285,-3.0548807125,0.1775809224999993,"['xas', 'elasticity', 'bandstructure']",True,[],True,2021-05-12 10:56:35.166000,NM,4,8,mp-971718,,ZnBi3,"{'functional': 'PBE', 'labels': ['Zn', 'Bi'], 'pot_type': 'paw'}","{'Zn': 1.0, 'Bi': 3.0}",GGA,mp-971718,"['mp-971745', 'mp-971755', 'mp-971718', 'mp-1475788', 'mp-1760793', 'mp-1790468', 'mp-971765', 'mp-1585995']",0.0030395,"{'Zn': 1.0, 'Bi': 3.0}",116.15074381246734,[],NM,False,139,0,"[0, 0, 0, 0]",2.6168579728662463e-05,0.0030395,0,0.0030395,MP,data/source/MP/cleaned/cifs/MP-mp-971718.cif,False,,data/final/MP/graphs/Bi3Zn1-MP-mp-971718.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ba0.7Bi1K0.3O3,3,0.12,4.0,False,Ba2.8Bi4K1.2O12,Ba4Bi4O12,29.9,Oxide,True,Ba14Bi20K6O60,Ba-Bi-K-O,4,Supercon,Ba0.7K0.3Bi1O3,MP-mp-559051,Ba4Bi4O12,Ba-Bi-O,Ba20Bi20O60,P 1 21/c 1,monoclinic,6.244045,6.28001,8.808393428799683,data/final/MP/cifs/Ba0.7Bi1K0.3O3-MP-mp-559051-synth_doped.cif,data/source/MP/raw/cifs/mp-559051.cif,mp-559051,0.0769000000000001,,2015-02-15 08:08:39,7.5826930836026865,10.17188/1270621,"@misc{osti_1270621,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BaBiO3 (SG:14) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1270621"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1709167'}},0.0,3.73830111,520.0,-119.03610928,-5.951805464,"{'tags': ['Barium bismuth(III) bismuth(V) oxide', 'Perovskite, double']}",-119.03610928,-5.951805464,-2.2334278330000004,"['xas', 'elasticity', 'bandstructure']",True,[172756],True,2021-05-12 10:56:22.739000,NM,20,8,mp-559051,oxide,BaBiO3,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Bi': 1.0, 'O': 3.0}",GGA,mp-559051,"['mp-944043', 'mp-933995', 'mp-944705', 'mp-559051', 'mp-1422516', 'mp-1709167', 'mp-1843835', 'mp-1607458']",9.0625e-05,"{'Ba': 4.0, 'Bi': 4.0, 'O': 12.0}",345.39699590112576,[],NM,False,14,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.0495169451438142e-06,9.0625e-05,0,0.0003625,MP,data/source/MP/cleaned/cifs/MP-mp-559051.cif,True,,data/final/MP/graphs/Ba0.7Bi1K0.3O3-MP-mp-559051-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,1,0,0,0,1.0,False
Fe1Te1,1,0.0,2.0,False,Fe2Te2,Fe2Te2,1.5,Ferrite,True,Fe50Te50,Fe-Te,2,Supercon,Fe1Te1,MP-mp-21273,Fe2Te2,Fe-Te,Fe50Te50,P 4/n m m,tetragonal,3.65601,3.65601,6.514508,data/final/MP/cifs/Fe1Te1-MP-mp-21273.cif,data/source/MP/raw/cifs/mp-21273.cif,mp-21273,0.0,,2015-11-26 15:42:53,6.996625048410066,10.17188/1196541,"@misc{osti_1196541,
    author = ""Persson, Kristin"",
    title = ""Materials Data on FeTe (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196541"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687548'}},0.0764545287500002,6.29104431,520.0,-23.46280856,-5.86570214,"{'tags': ['Iron telluride', 'Iron telluride - beta', 'Iron telluride (1/1)']}",-23.46280856,-5.86570214,-0.2700474499999998,"['xas', 'elasticity', 'bandstructure']",True,"[44753, 633877, 180602, 169974]",True,2021-05-12 10:56:16.728000,FM,4,9,mp-21273,,FeTe,"{'functional': 'PBE', 'labels': ['Fe_pv', 'Te'], 'pot_type': 'paw'}","{'Fe': 1.0, 'Te': 1.0}",GGA,mp-21273,"['mp-991220', 'mp-987578', 'mp-992375', 'mp-21273', 'mp-1439792', 'mp-1687548', 'mp-1800961', 'mp-993959', 'mp-1596778']",1.99364605,"{'Fe': 2.0, 'Te': 2.0}",87.07557914416442,[],FM,True,129,1,"[2.0, 2.0, 0.0, 0.0]",0.0457911637130606,1.99364605,2,3.9872921,MP,data/source/MP/cleaned/cifs/MP-mp-21273.cif,False,,data/final/MP/graphs/Fe1Te1-MP-mp-21273.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
N0.78Nb1,3,0.1235955056179775,1.0,True,N0.78Nb1,N1Nb1,10.5,Other,True,N43.82Nb56.18,N-Nb,2,Supercon,N0.78Nb1,MP-mp-2634,Nb1N1,N-Nb,N50Nb50,P -6 m 2,hexagonal,2.898656,2.9761920047347994,2.97619211,data/final/MP/cifs/N0.78Nb1-MP-mp-2634-synth_doped.cif,data/source/MP/raw/cifs/mp-2634.cif,mp-2634,0.0,,2011-05-12 17:49:04,7.984187332554685,10.17188/1201157,"@misc{osti_1201157,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbN (SG:187) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201157"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671304'}},0.0,7.12357548,520.0,-20.57319827,-10.286599135,"{'tags': ['Niobium nitride (1/1)', 'Niobium nitride', 'Niobium nitride (1/1) - gamma']}",-20.57319827,-10.286599135,-1.2481991524999998,"['xas', 'elasticity', 'bandstructure']",True,"[185569, 644536, 76385, 191062]",True,2021-05-12 10:56:18.721000,NM,2,17,mp-2634,,NbN,"{'functional': 'PBE', 'labels': ['Nb_pv', 'N'], 'pot_type': 'paw'}","{'Nb': 1.0, 'N': 1.0}",GGA,mp-2634,"['mp-926732', 'mp-910421', 'mp-926222', 'mp-2634', 'mp-1058402', 'mp-1058440', 'mp-1058487', 'mp-1061535', 'mp-1061589', 'mp-1061648', 'mp-1116126', 'mp-1442283', 'mp-1671304', 'mp-1924826', 'mp-1594881', 'mp-1061618', 'mp-1058457']",0.0002504,"{'Nb': 1.0, 'N': 1.0}",22.23561881453577,[],NM,False,187,0,"[0, 0]",1.1261211216496917e-05,0.0002504,0,0.0002504,MP,data/source/MP/cleaned/cifs/MP-mp-2634.cif,True,,data/final/MP/graphs/N0.78Nb1-MP-mp-2634-synth_doped.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Cu1La1.875Sr0.125O4,2,0.0357142857142857,1.0,True,Cu1La1.875Sr0.125O4,Cu1La2O4,30.04,Cuprate,True,Cu14.286La26.786Sr1.786O57.142857142857146,Cu-La-Sr-O,4,Supercon,La1.875Sr0.125Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La1.875Sr0.125O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La1.875Sr0.125O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ge2Pd1.96Pt0.04Sr1,2,0.016,1.0,True,Ge2Pd1.96Pt0.04Sr1,Ge2Pd2Sr1,3.16,Other,True,Ge40Pd39.2Pt0.8Sr20,Ge-Pd-Pt-Sr,4,Supercon,Sr1Pd1.96Pt0.04Ge2,MP-mp-978986,Sr1Ge2Pd2,Ge-Pd-Sr,Ge40Pd40Sr20,I 4/m m m,tetragonal,4.438671999438209,4.438671999438209,6.03054834,data/final/MP/cifs/Ge2Pd1.96Pt0.04Sr1-MP-mp-978986-synth_doped.cif,data/source/MP/raw/cifs/mp-978986.cif,mp-978986,0.0,,2015-10-09 03:56:43,7.295677176868866,10.17188/1316057,"@misc{osti_1316057,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr(GePd)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1316057"",
    place = ""United States"",
    year = ""2016"",
    month = ""9"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688092'}},0.0,4.0155429,520.0,-24.8627221,-4.97254442,"{'tags': ['Strontium palladium germanide (1/2/2)', 'Strontium palladium germanium (1/2/2)', 'High pressure experimental phase']}",-24.8627221,-4.97254442,-0.7134818633333324,"['xas', 'elasticity', 'bandstructure']",True,"[165985, 181157, 181155, 181156, 168133]",True,2021-05-12 10:56:37.246000,NM,5,9,mp-978986,,Sr(GePd)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ge_d', 'Pd'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Ge': 2.0, 'Pd': 2.0}",GGA,mp-978986,"['mp-1005776', 'mp-978986', 'mp-1005866', 'mp-979737', 'mp-1438850', 'mp-1688092', 'mp-1782349', 'mp-1011093', 'mp-1589601']",0.0012593,"{'Sr': 1.0, 'Ge': 2.0, 'Pd': 2.0}",101.45304755163892,[],NM,False,139,0,"[0, 0, 0, 0, 0]",1.2412638460752248e-05,0.0012593,0,0.0012593,MP,data/source/MP/cleaned/cifs/MP-mp-978986.cif,True,,data/final/MP/graphs/Ge2Pd1.96Pt0.04Sr1-MP-mp-978986-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As1Ce1F0.06Fe1O0.94,2,0.03,2.0,False,As2Ce2F0.12Fe2O1.88,As2Ce2Fe2O2,0.0,Ferrite,True,As25Ce25F1.5Fe25O23.5,As-Ce-F-Fe-O,5,Supercon,Ce1Fe1As1F0.06O0.94,MP-mp-605060,Ce2Fe2As2O2,As-Ce-Fe-O,As25Ce25Fe25O25,P 4 m m,tetragonal,3.992256,3.992256,9.041971,data/final/MP/cifs/As1Ce1F0.06Fe1O0.94-MP-mp-605060-synth_doped.cif,data/source/MP/raw/cifs/mp-605060.cif,mp-605060,0.0,,2014-02-14 20:12:08,6.611233843492404,10.17188/1277425,"@misc{osti_1277425,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeFeAsO (SG:99) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277425"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-1751604'}},0.2072581873958352,6.30288445,520.0,-55.74271596,-6.967839495,{'tags': []},-55.74271596,-6.967839495,-1.7010452412499992,['bandstructure'],True,[],True,2021-05-12 10:58:51.532000,FiM,8,10,mp-605060,oxide,CeFeAsO,"{'functional': 'PBE', 'labels': ['Ce', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-605060,"['mp-605060', 'mp-917114', 'mp-918266', 'mp-919274', 'mp-1443189', 'mp-1751604', 'mp-1770633', 'mp-1779614', 'mp-1873964', 'mp-1622328']",2.99945325,"{'Ce': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",144.11191005541338,[],FiM,True,99,3,"[-0.5, -0.5, 3.5, 3.5, 0.0, 0.0, 0.0, 0.0]",0.0416267225775671,2.99945325,4,5.9989065,MP,data/source/MP/cleaned/cifs/MP-mp-605060.cif,True,,data/final/MP/graphs/As1Ce1F0.06Fe1O0.94-MP-mp-605060-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
Al0.02B2Mg0.98,2,0.0133333333333333,1.0,True,Al0.02B2Mg0.98,B2Mg1,36.7,Other,True,Al0.667B66.667Mg32.667,Al-B-Mg,3,Supercon,Mg0.98Al0.02B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/Al0.02B2Mg0.98-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/Al0.02B2Mg0.98-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Co4Ge7U3,1,0.0,1.0,True,Co4Ge7U3,Co4Ge7U3,0.0,Heavy_fermion,True,Co28.571Ge50U21.429,Co-Ge-U,3,Supercon,U3Co4Ge7,MP-mp-20462,U3Co4Ge7,Co-Ge-U,Co28.571Ge50U21.429,I 4/m m m,tetragonal,4.138102001630384,4.138102001630384,13.88967522,data/final/MP/cifs/Co4Ge7U3-MP-mp-20462.cif,data/source/MP/raw/cifs/mp-20462.cif,mp-20462,0.0,,2014-02-23 03:11:49,10.41498766002704,10.17188/1195592,"@misc{osti_1195592,
    author = ""Persson, Kristin"",
    title = ""Materials Data on U3Co4Ge7 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195592"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1711613'}},0.0,8.96917179,520.0,-99.46851372,-7.104893837142858,{'tags': ['Uranium cobalt germanide (3/4/7)']},-99.46851372,-7.104893837142858,-0.342844108928572,"['xas', 'bandstructure']",True,"[290504, 43091, 290506, 290505, 43090]",True,2021-05-12 10:56:57.051000,FM,14,10,mp-20462,,U3Co4Ge7,"{'functional': 'PBE', 'labels': ['U', 'Co', 'Ge_d'], 'pot_type': 'paw'}","{'U': 3.0, 'Co': 4.0, 'Ge': 7.0}",GGA,mp-20462,"['mp-909945', 'mp-992387', 'mp-925920', 'mp-20462', 'mp-1103887', 'mp-1104721', 'mp-1105345', 'mp-1348839', 'mp-1711613', 'mp-1922675']",1.7489162,"{'U': 3.0, 'Co': 4.0, 'Ge': 7.0}",232.50755413303585,[],FM,True,139,2,"[0.0, 0.0, 0.0, 0.8, 0.8, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0075219758193288,1.7489162,2,1.7489162,MP,data/source/MP/cleaned/cifs/MP-mp-20462.cif,False,,data/final/MP/graphs/Co4Ge7U3-MP-mp-20462.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ba1Bi0.3Pb0.7O3,3,0.12,2.0,False,Ba2Bi0.6Pb1.4O6,Ba2Pb2O6,11.23,Oxide,True,Ba20Bi6Pb14O60,Ba-Bi-Pb-O,4,Supercon,Ba1Pb0.7Bi0.3O3,MP-mp-22230,Ba2Pb2O6,Ba-Pb-O,Ba20Pb20O60,I m m a,orthorhombic,6.133862002250079,6.155866510000001,6.155866509646406,data/final/MP/cifs/Ba1Bi0.3Pb0.7O3-MP-mp-22230-synth_doped.cif,data/source/MP/raw/cifs/mp-22230.cif,mp-22230,0.2093999999999996,,2014-02-21 02:34:22,7.878976238337828,10.17188/1197446,"@misc{osti_1197446,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BaPbO3 (SG:74) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197446"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677620'}},0.0,2.99294363,520.0,-57.91751158,-5.791751158,"{'tags': ['Barium plumbate(IV)', 'Barium lead oxide', 'Barium plumbate', 'Barium lead(IV) oxide']}",-57.91751158,-5.791751158,-2.1088509750000006,"['xas', 'bandstructure']",True,"[252031, 94313, 154038, 245600, 51657, 94312, 245601, 78681, 154039, 15933, 67811, 245602]",True,2021-05-12 10:56:59.077000,NM,10,7,mp-22230,oxide,BaPbO3,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Pb_d', 'O'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Pb': 1.0, 'O': 3.0}",GGA,mp-22230,"['mp-547522', 'mp-22230', 'mp-1078282', 'mp-1437547', 'mp-1677620', 'mp-1828697', 'mp-1589590']",5.66e-05,"{'Ba': 2.0, 'Pb': 2.0, 'O': 6.0}",165.45383803885784,[],NM,False,74,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.841787494431788e-07,5.66e-05,0,0.0001132,MP,data/source/MP/cleaned/cifs/MP-mp-22230.cif,True,,data/final/MP/graphs/Ba1Bi0.3Pb0.7O3-MP-mp-22230-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,0,1,0,0.5,False
Ce0.85Co1In5Yb0.15,2,0.0428571428571428,1.0,True,Ce0.85Co1In5Yb0.15,Ce1Co1In5,1.19,Heavy_fermion,True,Ce12.143Co14.286In71.429Yb2.143,Ce-Co-In-Yb,4,Supercon,Ce0.85Yb0.15Co1In5,MP-mp-19961,Ce1In5Co1,Ce-Co-In,Ce14.286Co14.286In71.429,P 4/m m m,tetragonal,4.635989,4.635989,7.564124,data/final/MP/cifs/Ce0.85Co1In5Yb0.15-MP-mp-19961-synth_doped.cif,data/source/MP/raw/cifs/mp-19961.cif,mp-19961,0.0,,2014-02-21 14:08:25,7.897022127398995,10.17188/1195145,"@misc{osti_1195145,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeIn5Co (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195145"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701944'}},0.0,7.80626318,520.0,-28.52795357,-4.075421938571429,{'tags': ['Cerium cobalt indium (1/1/5)']},-28.52795357,-4.075421938571429,-0.2468754242857146,"['xas', 'bandstructure']",True,[102108],True,2021-05-12 10:56:57.051000,FM,7,8,mp-19961,,CeIn5Co,"{'functional': 'PBE', 'labels': ['Ce', 'In_d', 'Co'], 'pot_type': 'paw'}","{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",GGA,mp-19961,"['mp-928775', 'mp-912209', 'mp-928270', 'mp-19961', 'mp-1504062', 'mp-1701944', 'mp-1785253', 'mp-1593180']",0.9310323,"{'Ce': 1.0, 'In': 5.0, 'Co': 1.0}",162.57113333428427,[],FM,True,123,1,"[0.7, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0057269226147644,0.9310323,1,0.9310323,MP,data/source/MP/cleaned/cifs/MP-mp-19961.cif,True,,data/final/MP/graphs/Ce0.85Co1In5Yb0.15-MP-mp-19961-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Si2Sr1,1,0.0,2.0,False,Si4Sr2,Si4Sr2,1.55,Other,True,Si66.667Sr33.333,Si-Sr,2,Supercon,Si2Sr1,MP-mp-1727,Sr2Si4,Si-Sr,Si66.667Sr33.333,I 41/a m d,tetragonal,4.437676001403473,4.437676001403473,7.655674089999999,data/final/MP/cifs/Si2Sr1-MP-mp-1727.cif,data/source/MP/raw/cifs/mp-1727.cif,mp-1727,0.0,,2011-05-12 21:45:19,3.472602102241727,10.17188/1192424,"@misc{osti_1192424,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SrSi2 (SG:141) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1192424"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697760'}},0.0,5.17909165,520.0,-27.27432404,-4.545720673333333,"{'tags': ['Strontium silicide (1/2)', 'Strontium silicide (1/2) - HP', 'Strontium silicide (1/2) - beta']}",-27.27432404,-4.545720673333333,-0.318346842222222,"['xas', 'elasticity', 'bandstructure']",True,"[659992, 99238, 37185, 1455, 154436]",True,2021-05-12 10:56:14.760000,NM,6,10,mp-1727,,SrSi2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Si'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Si': 2.0}",GGA,mp-1727,"['mp-919769', 'mp-918777', 'mp-905802', 'mp-1727', 'mp-1125152', 'mp-1146522', 'mp-1441695', 'mp-1697760', 'mp-1778624', 'mp-1588369']",0.0014147,"{'Sr': 2.0, 'Si': 4.0}",137.5168049177549,[],NM,False,141,0,"[0, 0, 0, 0, 0, 0]",2.057493992601259e-05,0.0014147,0,0.0028294,MP,data/source/MP/cleaned/cifs/MP-mp-1727.cif,False,,data/final/MP/graphs/Si2Sr1-MP-mp-1727.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
C1Mg1Ni2.7Ru0.3,3,0.1199999999999999,1.0,True,C1Mg1Ni2.7Ru0.3,C1Mg1Ni3,2.8,Other,True,C20Mg20Ni54Ru6,C-Mg-Ni-Ru,4,Supercon,Mg1C1Ni2.7Ru0.3,MP-mp-10700,Mg1Ni3C1,C-Mg-Ni,C20Mg20Ni60,P m -3 m,cubic,3.810209,3.810209,3.810209,data/final/MP/cifs/C1Mg1Ni2.7Ru0.3-MP-mp-10700-synth_doped.cif,data/source/MP/raw/cifs/mp-10700.cif,mp-10700,0.0,,2011-05-28 10:04:44,6.376007671789427,10.17188/1187303,"@misc{osti_1187303,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MgNi3C (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187303"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678621'}},0.0,6.64260176,520.0,-28.85099542,-5.770199084,{'tags': ['Magnesium nickel carbide (1/3/1)']},-28.85099542,-5.770199084,-0.1367049259999994,"['xas', 'elasticity', 'bandstructure']",True,[77152],True,2021-05-12 10:56:10.715000,NM,5,8,mp-10700,,MgNi3C,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Ni_pv', 'C'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",GGA,mp-10700,"['mp-927245', 'mp-927653', 'mp-911184', 'mp-10700', 'mp-1438083', 'mp-1678621', 'mp-1791467', 'mp-1591421']",0.0387875,"{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",55.31544309398296,[],NM,False,221,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",0.0007012056277683,0.0387875,0,0.0387875,MP,data/source/MP/cleaned/cifs/MP-mp-10700.cif,True,,data/final/MP/graphs/C1Mg1Ni2.7Ru0.3-MP-mp-10700-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
C6Ca1,1,0.0,1.0,True,C6Ca1,C6Ca1,11.303,Carbon,True,C85.714Ca14.286,C-Ca,2,Supercon,C6Ca1,MP-mp-1206211,Ca1C6,C-Ca,C85.714Ca14.286,P -1,triclinic,3.57941212,5.073450840795241,7.76714882,data/final/MP/cifs/C6Ca1-MP-mp-1206211.cif,data/source/MP/raw/cifs/mp-1206211.cif,mp-1206211,0.0,,2019-01-12 09:34:05.558000,1.3355105167033985,,,,0.7545302271428582,-0.37379578,520.0,-52.08457249,-7.440653212857143,{'tags': []},-52.08457249,-7.440653212857143,0.7545302271428582,[],False,[],True,2021-05-12 11:00:17.126000,NM,7,2,mp-1206211,,CaC6,"{'functional': 'PBE', 'labels': ['Ca_sv', 'C'], 'pot_type': 'paw'}","{'Ca': 1.0, 'C': 6.0}",GGA,mp-1206211,"['mp-1206211', 'mp-1876672']",6e-07,"{'Ca': 1.0, 'C': 6.0}",139.43469690836366,[],NM,False,2,0,"[0, 0, 0, 0, 0, 0, 0]",4.3030896419871686e-09,6e-07,0,6e-07,MP,data/source/MP/cleaned/cifs/MP-mp-1206211.cif,False,,data/final/MP/graphs/C6Ca1-MP-mp-1206211.json,0,True,-1,0,0,0,0,0,2,0,1,0,0,0,1.0,False
As1Ce1Co0.15Fe0.85O1,3,0.075,2.0,False,As2Ce2Co0.3Fe1.7O2,As2Ce2Fe2O2,5.0,Ferrite,True,As25Ce25Co3.75Fe21.25O25,As-Ce-Co-Fe-O,5,Supercon,Ce1Fe0.85Co0.15As1O1,MP-mp-605060,Ce2Fe2As2O2,As-Ce-Fe-O,As25Ce25Fe25O25,P 4 m m,tetragonal,3.992256,3.992256,9.041971,data/final/MP/cifs/As1Ce1Co0.15Fe0.85O1-MP-mp-605060-synth_doped.cif,data/source/MP/raw/cifs/mp-605060.cif,mp-605060,0.0,,2014-02-14 20:12:08,6.611233843492404,10.17188/1277425,"@misc{osti_1277425,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeFeAsO (SG:99) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277425"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-1751604'}},0.2072581873958352,6.30288445,520.0,-55.74271596,-6.967839495,{'tags': []},-55.74271596,-6.967839495,-1.7010452412499992,['bandstructure'],True,[],True,2021-05-12 10:58:51.532000,FiM,8,10,mp-605060,oxide,CeFeAsO,"{'functional': 'PBE', 'labels': ['Ce', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-605060,"['mp-605060', 'mp-917114', 'mp-918266', 'mp-919274', 'mp-1443189', 'mp-1751604', 'mp-1770633', 'mp-1779614', 'mp-1873964', 'mp-1622328']",2.99945325,"{'Ce': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",144.11191005541338,[],FiM,True,99,3,"[-0.5, -0.5, 3.5, 3.5, 0.0, 0.0, 0.0, 0.0]",0.0416267225775671,2.99945325,4,5.9989065,MP,data/source/MP/cleaned/cifs/MP-mp-605060.cif,True,,data/final/MP/graphs/As1Ce1Co0.15Fe0.85O1-MP-mp-605060-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
K1Os2O6,1,0.0,2.0,False,K2Os4O12,K2Os4O12,9.60375,Oxide,True,K11.111Os22.222O66.66666666666666,K-Os-O,3,Supercon,K1Os2O6,MP-mp-554461,K2Os4O12,K-Os-O,K11.111Os22.222O66.66666666666666,P -1,triclinic,5.686261,6.5227987,7.35605874,data/final/MP/cifs/K1Os2O6-MP-mp-554461.cif,data/source/MP/raw/cifs/mp-554461.cif,mp-554461,0.0,,2014-03-21 21:47:42,7.374993487213946,,,{'GGA': {'task_id': 'mp-1668074'}},0.0,3.02021999,520.0,-128.11069824,-7.117261013333334,{'tags': ['Potassium osmo(V)osmate']},-128.11069824,-7.117261013333334,-1.6582724036666672,"['xas', 'bandstructure']",True,[419880],True,2021-05-12 10:57:15.388000,NM,18,7,mp-554461,oxide,K(OsO3)2,"{'functional': 'PBE', 'labels': ['K_sv', 'Os_pv', 'O'], 'pot_type': 'paw'}","{'K': 1.0, 'Os': 2.0, 'O': 6.0}",GGA,mp-554461,"['mp-914252', 'mp-977814', 'mp-554461', 'mp-1420368', 'mp-1668074', 'mp-1922977', 'mp-1605137']",0.0001255,"{'K': 2.0, 'Os': 4.0, 'O': 12.0}",232.16256985269595,[],NM,False,2,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.0811389629226457e-06,0.0001255,0,0.000251,MP,data/source/MP/cleaned/cifs/MP-mp-554461.cif,False,,data/final/MP/graphs/K1Os2O6-MP-mp-554461.json,0,True,-1,0,0,0,0,0,2,0,1,0,0,0,1.0,False
Pb2Rh1,1,0.0,2.0,False,Pb4Rh2,Pb4Rh2,2.66,Other,True,Pb66.667Rh33.333,Pb-Rh,2,Supercon,Pb2Rh1,MP-mp-321,Rh2Pb4,Pb-Rh,Pb66.667Rh33.333,I 4/m c m,tetragonal,5.661480260328252,5.66148026,5.66148026,data/final/MP/cifs/Pb2Rh1-MP-mp-321.cif,data/source/MP/raw/cifs/mp-321.cif,mp-321,0.0,,2011-05-14 03:01:40,12.445655994001733,10.17188/1206104,"@misc{osti_1206104,
    author = ""Persson, Kristin"",
    title = ""Materials Data on RhPb2 (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1206104"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698331'}},0.0,7.88880446,520.0,-30.0014006,-5.000233433333333,"{'tags': ['Rhodium lead (1/2)', 'Lead rhodium (2/1)', 'Rhodium plumbide (1/2)']}",-30.0014006,-5.000233433333333,-0.0703660966666668,"['xas', 'elasticity', 'bandstructure']",True,"[105608, 648423, 648419, 102802]",True,2021-05-12 10:56:20.740000,NM,6,9,mp-321,,RhPb2,"{'functional': 'PBE', 'labels': ['Rh_pv', 'Pb_d'], 'pot_type': 'paw'}","{'Rh': 1.0, 'Pb': 2.0}",GGA,mp-321,"['mp-934782', 'mp-941254', 'mp-321', 'mp-941562', 'mp-1077010', 'mp-1441918', 'mp-1698331', 'mp-1933275', 'mp-1587870']",0.0001739,"{'Rh': 2.0, 'Pb': 4.0}",138.04109522729053,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0]",2.519539557602992e-06,0.0001739,0,0.0003478,MP,data/source/MP/cleaned/cifs/MP-mp-321.cif,False,,data/final/MP/graphs/Pb2Rh1-MP-mp-321.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Hf1P1Ru1,1,0.0,3.0,False,Hf3P3Ru3,Hf3P3Ru3,11.79666667,Other,True,Hf33.333P33.333Ru33.333,Hf-P-Ru,3,Supercon,Hf1Ru1P1,MP-mp-15963,Hf3P3Ru3,Hf-P-Ru,Hf33.333P33.333Ru33.333,P -6 2 m,hexagonal,3.79275,6.435765995410763,6.43576526,data/final/MP/cifs/Hf1P1Ru1-MP-mp-15963.cif,data/source/MP/raw/cifs/mp-15963.cif,mp-15963,0.0,,2011-05-30 00:27:44,11.370875491218811,10.17188/1191475,"@misc{osti_1191475,
    author = ""Persson, Kristin"",
    title = ""Materials Data on HfPRu (SG:189) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191475"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696692'}},0.0,8.54603485,520.0,-83.62396794,-9.291551993333334,{'tags': ['Hafnium ruthenium phosphide (1/1/1) - HT']},-83.62396794,-9.291551993333334,-1.0765916561111115,"['xas', 'elasticity', 'bandstructure']",True,[53035],True,2021-05-12 10:56:12.755000,NM,9,9,mp-15963,,HfPRu,"{'functional': 'PBE', 'labels': ['Hf_pv', 'P', 'Ru_pv'], 'pot_type': 'paw'}","{'Hf': 1.0, 'P': 1.0, 'Ru': 1.0}",GGA,mp-15963,"['mp-1008048', 'mp-1001540', 'mp-15963', 'mp-1115841', 'mp-1437088', 'mp-1696692', 'mp-1932326', 'mp-1012371', 'mp-1588720']",0.0065358666666666,"{'Hf': 3.0, 'P': 3.0, 'Ru': 3.0}",136.04584194879664,[],NM,False,189,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001441249487608,0.0065358666666666,0,0.0196076,MP,data/source/MP/cleaned/cifs/MP-mp-15963.cif,False,,data/final/MP/graphs/Hf1P1Ru1-MP-mp-15963.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Hf1,1,0.0,2.0,False,Hf2,Hf2,0.064,Other,True,Hf100,Hf,1,Supercon,Hf1,MP-mp-103,Hf2,Hf,Hf100,P 63/m m c,hexagonal,3.1984860021606263,3.1984858900000006,5.075185,data/final/MP/cifs/Hf1-MP-mp-103.cif,data/source/MP/raw/cifs/mp-103.cif,mp-103,0.0,,2011-05-12 18:36:38,13.183222602971489,10.17188/1186884,"@misc{osti_1186884,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Hf (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1186884"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668773'}},0.0,4.91075768,520.0,-19.9143777,-9.95718885,"{'tags': ['Hafnium - hcp', 'Hafnium nitride (1/0.33)', 'Hafnium', 'Hafnium oxide (1/0.25)']}",-19.9143777,-9.95718885,0.0,"['surfaces', 'eos', 'bandstructure', 'xas', 'elasticity']",True,"[638559, 53786, 181757, 426944, 638741, 638561, 76142, 76411, 53022, 638653, 183411]",True,2021-05-12 10:56:10.715000,NM,2,25,mp-103,,Hf,"{'functional': 'PBE', 'labels': ['Hf_pv'], 'pot_type': 'paw'}",{'Hf': 1.0},GGA,mp-103,"['mp-910185', 'mp-926074', 'mp-925608', 'mp-103', 'mp-1059369', 'mp-1059418', 'mp-1059395', 'mp-1059519', 'mp-1059547', 'mp-1059587', 'mp-1060833', 'mp-1060743', 'mp-1060785', 'mp-1061297', 'mp-1061365', 'mp-1061247', 'mp-1440946', 'mp-1668773', 'mp-1794712', 'mp-1588777', 'mp-1587288', 'mp-1060818', 'mp-1059570', 'mp-1061333', 'mp-1059416']",0.00013635,{'Hf': 2.0},44.9646686434056,[],NM,False,194,0,"[0, 0]",6.064761694624286e-06,0.00013635,0,0.0002727,MP,data/source/MP/cleaned/cifs/MP-mp-103.cif,False,,data/final/MP/graphs/Hf1-MP-mp-103.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Cu1Hg0.9O4,2,0.0221518987341771,1.0,True,Ba2Cu1Hg0.9O4,Ba2Cu1Hg1O4,73.0,Cuprate,True,Ba25.316Cu12.658Hg11.392O50.63291139240506,Ba-Cu-Hg-O,4,Supercon,Hg0.9Ba2Cu1O4,MP-mp-6562,Ba2Cu1Hg1O4,Ba-Cu-Hg-O,Ba25Cu12.5Hg12.5O50,P 4/m m m,tetragonal,3.933714,3.933714,9.827602,data/final/MP/cifs/Ba2Cu1Hg0.9O4-MP-mp-6562-synth_doped.cif,data/source/MP/raw/cifs/mp-6562.cif,mp-6562,0.0,,2011-05-13 18:18:06,6.582036471328142,10.17188/1281336,"@misc{osti_1281336,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2CuHgO4 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281336"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697135'}},0.0234340381250053,2.58068675,520.0,-40.91481298,-5.1143516225,"{'tags': ['Mercury dibarium copper oxide', 'High pressure experimental phase']}",-40.91481298,-5.1143516225,-1.953767533125,"['xas', 'bandstructure']",True,"[75722, 75720, 75724, 75721, 75723]",True,2021-05-12 10:57:32.679000,NM,8,8,mp-6562,oxide,Ba2CuHgO4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Cu_pv', 'Hg', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",GGA,mp-6562,"['mp-6562', 'mp-990899', 'mp-992892', 'mp-1435690', 'mp-1697135', 'mp-1878488', 'mp-994198', 'mp-1592659']",0.0003984,"{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",152.07335344042525,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0, 0, 0]",2.619788352047311e-06,0.0003984,0,0.0003984,MP,data/source/MP/cleaned/cifs/MP-mp-6562.cif,True,,data/final/MP/graphs/Ba2Cu1Hg0.9O4-MP-mp-6562-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Eu1,1,0.0,2.0,False,Eu2,Eu2,1.375,Other,True,Eu100,Eu,1,Supercon,Eu1,MP-mp-1057315,Eu2,Eu,Eu100,C m c m,orthorhombic,3.822912004201403,3.88193069,6.419474,data/final/MP/cifs/Eu1-MP-mp-1057315.cif,data/source/MP/raw/cifs/mp-1057315.cif,mp-1057315,0.0,,2018-03-20 06:10:33,6.086594594234831,,,{'GGA': {'task_id': 'mp-1672826'}},0.0,2.2486835,520.0,-20.58408695,-10.292043475,"{'tags': ['Europium hydride (1/1.9)', 'Europium(II) deuteride']}",-20.58408695,-10.292043475,0.0,['bandstructure'],True,"[90296, 61424]",True,2021-05-12 10:58:12.772000,FM,2,14,mp-1057315,,Eu,"{'functional': 'PBE', 'labels': ['Eu'], 'pot_type': 'paw'}",{'Eu': 1.0},GGA,mp-1057315,"['mp-1057315', 'mp-1057393', 'mp-1057675', 'mp-1057660', 'mp-1057781', 'mp-1058135', 'mp-1181433', 'mp-1439642', 'mp-1672826', 'mp-1784296', 'mp-1922167', 'mp-1586143', 'mp-1057926', 'mp-1057514']",7.52971555,{'Eu': 2.0},82.91735380431568,[],FM,True,63,1,"[7.0, 7.0]",0.181619774499077,7.52971555,2,15.0594311,MP,data/source/MP/cleaned/cifs/MP-mp-1057315.cif,False,,data/final/MP/graphs/Eu1-MP-mp-1057315.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
B4Er0.16Ho0.84Rh4,3,0.0355555555555555,2.0,False,B8Er0.32Ho1.68Rh8,B8Ho2Rh8,5.95,Other,True,B44.444Er1.778Ho9.333Rh44.444,B-Er-Ho-Rh,4,Supercon,Er0.16Ho0.84Rh4B4,MP-mp-1189784,Ho2B8Rh8,B-Ho-Rh,B44.444Ho11.111Rh44.444,P 42/n m c,tetragonal,5.334437,5.334437,7.442515,data/final/MP/cifs/B4Er0.16Ho0.84Rh4-MP-mp-1189784-synth_doped.cif,data/source/MP/raw/cifs/mp-1189784.cif,mp-1189784,0.0,,2019-01-11 20:27:24.618000,9.719214946416653,,,{'GGA': {'task_id': 'mp-1671459'}},0.0130335600000011,6.87149626,520.0,-131.93964083,-7.329980046111111,{'tags': ['Holmium rhodium boride (1/4/4)']},-131.93964083,-7.329980046111111,-0.5791792201851851,['bandstructure'],True,[601533],True,2021-05-12 10:58:33.577000,NM,18,5,mp-1189784,,Ho(BRh)4,"{'functional': 'PBE', 'labels': ['Ho_3', 'B', 'Rh_pv'], 'pot_type': 'paw'}","{'Ho': 1.0, 'B': 4.0, 'Rh': 4.0}",GGA,mp-1189784,"['mp-1189784', 'mp-1430146', 'mp-1671459', 'mp-1786743', 'mp-1604112']",0.00025395,"{'Ho': 2.0, 'B': 8.0, 'Rh': 8.0}",211.7858301043884,[],NM,False,137,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.39817744062319e-06,0.00025395,0,0.0005079,MP,data/source/MP/cleaned/cifs/MP-mp-1189784.cif,True,,data/final/MP/graphs/B4Er0.16Ho0.84Rh4-MP-mp-1189784-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ru1Si1Zr1,1,0.0,3.0,False,Ru3Si3Zr3,Ru3Si3Zr3,9.733333333,Other,True,Ru33.333Si33.333Zr33.333,Ru-Si-Zr,3,Supercon,Zr1Ru1Si1,MP-mp-7544,Zr3Si3Ru3,Ru-Si-Zr,Ru33.333Si33.333Zr33.333,P -6 2 m,hexagonal,3.728055,6.7106119984895285,6.71061246,data/final/MP/cifs/Ru1Si1Zr1-MP-mp-7544.cif,data/source/MP/raw/cifs/mp-7544.cif,mp-7544,0.0,,2011-05-30 04:17:49,7.550997125152835,10.17188/1289411,"@misc{osti_1289411,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrSiRu (SG:189) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1289411"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696970'}},0.0,7.37452386,520.0,-78.20639313,-8.689599236666666,"{'tags': ['Zirconium ruthenium silicide (1/1/1)', 'Ruthenium zirconium silicide (1/1/1)']}",-78.20639313,-8.689599236666666,-0.9167978016666672,"['bandstructure', 'elasticity']",True,"[600432, 16306]",True,2021-05-12 10:56:29.056000,NM,9,9,mp-7544,,ZrSiRu,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Si', 'Ru_pv'], 'pot_type': 'paw'}","{'Zr': 1.0, 'Si': 1.0, 'Ru': 1.0}",GGA,mp-7544,"['mp-909156', 'mp-925000', 'mp-7544', 'mp-924194', 'mp-1143617', 'mp-1426519', 'mp-1696970', 'mp-1926678', 'mp-1588049']",0.0005629666666666,"{'Zr': 3.0, 'Si': 3.0, 'Ru': 3.0}",145.3909052655219,[],NM,False,189,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0]",1.1616269923594091e-05,0.0005629666666666,0,0.0016889,MP,data/source/MP/cleaned/cifs/MP-mp-7544.cif,False,,data/final/MP/graphs/Ru1Si1Zr1-MP-mp-7544.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
La3Sn1,1,0.0,1.0,True,La3Sn1,La3Sn1,6.2,Other,True,La75Sn25,La-Sn,2,Supercon,La3Sn1,MP-mp-1681,La3Sn1,La-Sn,La75Sn25,P m -3 m,cubic,5.043232,5.043232,5.043232,data/final/MP/cifs/La3Sn1-MP-mp-1681.cif,data/source/MP/raw/cifs/mp-1681.cif,mp-1681,0.0,,2011-05-13 01:38:34,6.931417285864698,10.17188/1192184,"@misc{osti_1192184,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La3Sn (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1192184"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697894'}},0.0,8.62401454,520.0,-20.72829082,-5.182072705,{'tags': ['Lanthanum tin (3/1)']},-20.72829082,-5.182072705,-0.4776744125000007,"['xas', 'elasticity', 'bandstructure']",True,"[104722, 603209]",True,2021-05-12 10:56:14.760000,NM,4,6,mp-1681,,La3Sn,"{'functional': 'PBE', 'labels': ['La', 'Sn_d'], 'pot_type': 'paw'}","{'La': 3.0, 'Sn': 1.0}",GGA,mp-1681,"['mp-991590', 'mp-1681', 'mp-1438079', 'mp-1697894', 'mp-1929941', 'mp-1596187']",0.5107327,"{'La': 3.0, 'Sn': 1.0}",128.27051588821976,[],NM,False,221,0,"[0, 0, 0, 0]",0.0039816843057298,0.5107327,0,0.5107327,MP,data/source/MP/cleaned/cifs/MP-mp-1681.cif,False,,data/final/MP/graphs/La3Sn1-MP-mp-1681.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Si2V1,1,0.0,3.0,False,Si6V3,Si6V3,0.0,Other,True,Si66.667V33.333,Si-V,2,Supercon,Si2V1,MP-mp-10711,V3Si6,Si-V,Si66.667V33.333,P 62 2 2,hexagonal,4.564700002788177,4.56470073,6.371755,data/final/MP/cifs/Si2V1-MP-mp-10711.cif,data/source/MP/raw/cifs/mp-10711.cif,mp-10711,0.0,,2011-05-28 08:28:57,4.640836148154336,10.17188/1187307,"@misc{osti_1187307,
    author = ""Persson, Kristin"",
    title = ""Materials Data on VSi2 (SG:180) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187307"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699992'}},0.0,9.865534,520.0,-64.16011253,-7.128901392222223,{'tags': ['Vanadium silicide (1/2)']},-64.16011253,-7.128901392222223,-0.4367233555555564,"['xas', 'elasticity', 'bandstructure']",True,"[652524, 603134, 652504, 77371, 652528, 652492]",True,2021-05-12 10:56:10.715000,FM,9,12,mp-10711,,VSi2,"{'functional': 'PBE', 'labels': ['V_pv', 'Si'], 'pot_type': 'paw'}","{'V': 1.0, 'Si': 2.0}",GGA,mp-10711,"['mp-10711', 'mp-1000930', 'mp-1007376', 'mp-1138735', 'mp-1146156', 'mp-1115646', 'mp-1440523', 'mp-1699992', 'mp-1803892', 'mp-1928673', 'mp-1012142', 'mp-1596624']",0.1137630333333333,"{'V': 3.0, 'Si': 6.0}",114.97787365877764,[],FM,True,180,1,"[0.1, 0.1, 0.1, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0029683024145397,0.1137630333333333,3,0.3412891,MP,data/source/MP/cleaned/cifs/MP-mp-10711.cif,False,,data/final/MP/graphs/Si2V1-MP-mp-10711.json,0,True,622,0,4,0,0,0,0,0,1,0,0,0,0.5,False
Co0.004Fe1.996K0.8Se2,3,0.0666666666666666,1.0,True,Co0.004Fe1.996K0.8Se2,Fe2K1Se2,22.0,Ferrite,True,Co0.083Fe41.583K16.667Se41.667,Co-Fe-K-Se,4,Supercon,K0.8Fe1.996Co0.004Se2,MP-mp-1070735,K1Fe2Se2,Fe-K-Se,Fe40K20Se40,I 4/m m m,tetragonal,3.783558000712664,3.783558000712664,7.91886339,data/final/MP/cifs/Co0.004Fe1.996K0.8Se2-MP-mp-1070735-synth_doped.cif,data/source/MP/raw/cifs/mp-1070735.cif,mp-1070735,0.0,,2018-03-22 03:52:22,4.804538531009527,,,{'GGA': {'task_id': 'mp-1761650'}},0.0327827750000011,3.42423866,520.0,-27.50456218,-5.500912436,{'tags': ['Potassium iron selenide (1/2/2)']},-27.50456218,-5.500912436,-0.6812646755374999,['bandstructure'],True,[186573],True,2021-05-12 10:58:14.654000,FM,5,8,mp-1070735,,K(FeSe)2,"{'functional': 'PBE', 'labels': ['K_sv', 'Fe_pv', 'Se'], 'pot_type': 'paw'}","{'K': 1.0, 'Fe': 2.0, 'Se': 2.0}",GGA,mp-1070735,"['mp-1070735', 'mp-1070765', 'mp-1070841', 'mp-1416829', 'mp-1761650', 'mp-1797161', 'mp-1585994', 'mp-1070830']",6.0503851,"{'K': 1.0, 'Fe': 2.0, 'Se': 2.0}",106.69540665041993,[],FM,True,139,1,"[0.0, 2.8, 2.8, 0.0, 0.0]",0.0567070813069176,6.0503851,2,6.0503851,MP,data/source/MP/cleaned/cifs/MP-mp-1070735.cif,True,,data/final/MP/graphs/Co0.004Fe1.996K0.8Se2-MP-mp-1070735-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Al2Gd0.001La0.999,2,0.0006666666666666,2.0,False,Al4Gd0.002La1.998,Al4La2,2.78,Other,True,Al66.667Gd0.033La33.3,Al-Gd-La,3,Supercon,La0.999Gd0.001Al2,MP-mp-2694,La2Al4,Al-La,Al66.667La33.333,F d -3 m,cubic,5.75810346,5.75810346,5.75810346,data/final/MP/cifs/Al2Gd0.001La0.999-MP-mp-2694-synth_doped.cif,data/source/MP/raw/cifs/mp-2694.cif,mp-2694,0.0,,2011-05-12 21:07:48,4.744791242841679,10.17188/1201263,"@misc{osti_1201263,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaAl2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201263"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686658'}},0.0,8.10972418,520.0,-27.8605497,-4.64342495,{'tags': ['Aluminium lanthanum (2/1)']},-27.8605497,-4.64342495,-0.5010386950000001,"['xas', 'elasticity', 'bandstructure']",True,"[608275, 608277, 608265, 608290, 608288, 57933, 608270, 608269, 603920, 608272, 608286, 608273, 608289, 604450, 608266]",True,2021-05-12 10:56:18.721000,NM,6,10,mp-2694,,LaAl2,"{'functional': 'PBE', 'labels': ['La', 'Al'], 'pot_type': 'paw'}","{'La': 1.0, 'Al': 2.0}",GGA,mp-2694,"['mp-940230', 'mp-925817', 'mp-940644', 'mp-2694', 'mp-1258643', 'mp-1440554', 'mp-1686658', 'mp-1787219', 'mp-1596037', 'mp-1594760']",0.0008869,"{'La': 2.0, 'Al': 4.0}",134.99677475891534,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",1.3139573172527638e-05,0.0008869,0,0.0017738,MP,data/source/MP/cleaned/cifs/MP-mp-2694.cif,True,,data/final/MP/graphs/Al2Gd0.001La0.999-MP-mp-2694-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Bi3In5,3,0.0833333333333333,0.3333666666666667,False,Bi1In1.667,Bi1In2,4.189,Other,True,Bi37.5In62.5,Bi-In,2,Supercon,Bi3In5,MP-mp-1223979,In2Bi1,Bi-In,Bi33.333In66.667,F m m m,orthorhombic,3.342860125832212,3.34286013,8.479954760000002,data/final/MP/cifs/Bi3In5-MP-mp-1223979-synth_doped.cif,data/source/MP/raw/cifs/mp-1223979.cif,mp-1223979,0.0,,2019-01-13 00:17:45.608000,8.030227006356316,,,{'GGA': {'task_id': 'mp-1766619'}},0.0472082416666652,6.385481,520.0,-9.25410649,-3.084702163333333,{'tags': []},-9.25410649,-3.084702163333333,0.0464317600000002,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,3,5,mp-1223979,,In2Bi,"{'functional': 'PBE', 'labels': ['In_d', 'Bi'], 'pot_type': 'paw'}","{'In': 2.0, 'Bi': 1.0}",GGA,mp-1223979,"['mp-1223979', 'mp-1427688', 'mp-1766619', 'mp-1797001', 'mp-1616846']",0.0199292,"{'In': 2.0, 'Bi': 1.0}",90.69976065121642,[],NM,False,69,0,"[0, 0, 0]",0.0002197271509528,0.0199292,0,0.0199292,MP,data/source/MP/cleaned/cifs/MP-mp-1223979.cif,True,,data/final/MP/graphs/Bi3In5-MP-mp-1223979-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,0,0,1,1.0,False
Rh2Si2Th1,1,0.0,1.0,True,Rh2Si2Th1,Rh2Si2Th1,1.1,Other,True,Rh40Si40Th20,Rh-Si-Th,3,Supercon,Th1Rh2Si2,MP-mp-4413,Th1Si2Rh2,Rh-Si-Th,Rh40Si40Th20,I 4/m m m,tetragonal,4.1235999999618125,4.1235999999618125,5.8674482,data/final/MP/cifs/Rh2Si2Th1-MP-mp-4413.cif,data/source/MP/raw/cifs/mp-4413.cif,mp-4413,0.0,,2015-02-15 05:02:48,9.475060500989771,10.17188/1208136,"@misc{osti_1208136,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Th(SiRh)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208136"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678164'}},0.0,8.46739761,520.0,-38.47562448,-7.695124896,"{'tags': ['Rhodium thorium silicide (2/1/2)', 'Rhodium silicon thorium(2/2/1)']}",-38.47562448,-7.695124896,-1.0965044899999996,"['xas', 'bandstructure']",True,"[650332, 650337, 650333]",True,2021-05-12 10:57:08.928000,NM,5,10,mp-4413,,Th(SiRh)2,"{'functional': 'PBE', 'labels': ['Th', 'Si', 'Rh_pv'], 'pot_type': 'paw'}","{'Th': 1.0, 'Si': 2.0, 'Rh': 2.0}",GGA,mp-4413,"['mp-943902', 'mp-944574', 'mp-933804', 'mp-1144350', 'mp-4413', 'mp-1264645', 'mp-1441529', 'mp-1678164', 'mp-1802088', 'mp-1589911']",1.17e-05,"{'Th': 1.0, 'Si': 2.0, 'Rh': 2.0}",86.57882545746095,[],NM,False,139,0,"[0, 0, 0, 0, 0]",1.3513696840053114e-07,1.17e-05,0,1.17e-05,MP,data/source/MP/cleaned/cifs/MP-mp-4413.cif,False,,data/final/MP/graphs/Rh2Si2Th1-MP-mp-4413.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B2C1Dy0.9Ni2Tm0.1,2,0.0333333333333333,1.0,True,B2C1Dy0.9Ni2Tm0.1,B2C1Dy1Ni2,4.55,Other,True,B33.333C16.667Dy15Ni33.333Tm1.667,B-C-Dy-Ni-Tm,5,Supercon,Dy0.9Tm0.1Ni2B2C1,MP-mp-6223,Dy1Ni2B2C1,B-C-Dy-Ni,B33.333C16.667Dy16.667Ni33.333,I 4/m m m,tetragonal,3.5485979995620824,3.548597999562083,5.74460959,data/final/MP/cifs/B2C1Dy0.9Ni2Tm0.1-MP-mp-6223-synth_doped.cif,data/source/MP/raw/cifs/mp-6223.cif,mp-6223,0.0,,2011-05-13 04:15:09,8.00036369104547,10.17188/1278123,"@misc{osti_1278123,
    author = ""Persson, Kristin"",
    title = ""Materials Data on DyNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1278123"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687390'}},0.0,6.75219219,520.0,-41.84976027,-6.974960045,{'tags': []},-41.84976027,-6.974960045,-0.5161893047222215,"['xas', 'elasticity', 'bandstructure']",True,"[56596, 56593, 56595, 79573, 56649, 56594]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-6223,,DyNi2B2C,"{'functional': 'PBE', 'labels': ['Dy_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Dy': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6223,"['mp-1007344', 'mp-1000899', 'mp-6223', 'mp-1439353', 'mp-1687390', 'mp-1795426', 'mp-1012086', 'mp-1593735']",0.004911,"{'Dy': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.07346390684725,[],NM,False,139,0,"[0.0, -0.0, -0.0, 0.0, 0.0, 0.0]",7.546855054512086e-05,0.004911,0,0.004911,MP,data/source/MP/cleaned/cifs/MP-mp-6223.cif,True,,data/final/MP/graphs/B2C1Dy0.9Ni2Tm0.1-MP-mp-6223-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Mo2N1,1,0.0,2.0,False,Mo4N2,Mo4N2,5.1,Other,True,Mo66.667N33.333,Mo-N,2,Supercon,Mo2N1,MP-mp-27953,Mo4N2,Mo-N,Mo66.667N33.333,I 41/a m d,tetragonal,4.262717999722134,4.262717999722134,5.04359459,data/final/MP/cifs/Mo2N1-MP-mp-27953.cif,data/source/MP/raw/cifs/mp-27953.cif,mp-27953,0.0,,2014-02-24 01:11:27,9.305561399905502,10.17188/1202105,"@misc{osti_1202105,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Mo2N (SG:141) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1202105"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688569'}},0.0040611758333319,9.32016567,520.0,-61.49765639,-10.249609398333334,{'tags': ['Molybdenum nitride (2/1) - beta']},-61.49765639,-10.249609398333334,-0.3606824033333342,"['xas', 'elasticity', 'bandstructure']",True,[30593],True,2021-05-12 10:56:18.721000,NM,6,8,mp-27953,,Mo2N,"{'functional': 'PBE', 'labels': ['Mo_pv', 'N'], 'pot_type': 'paw'}","{'Mo': 2.0, 'N': 1.0}",GGA,mp-27953,"['mp-920683', 'mp-921700', 'mp-907223', 'mp-27953', 'mp-1300753', 'mp-1688569', 'mp-1798890', 'mp-1595403']",9.2e-06,"{'Mo': 4.0, 'N': 2.0}",73.47926555980298,[],NM,False,141,0,"[0, 0, 0, 0, 0, 0]",2.504107772419784e-07,9.2e-06,0,1.84e-05,MP,data/source/MP/cleaned/cifs/MP-mp-27953.cif,False,,data/final/MP/graphs/Mo2N1-MP-mp-27953.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
C1Fe3,1,0.0,2.0,False,C2Fe6,C2Fe6,0.65,Other,True,C25Fe75,C-Fe,2,Supercon,C1Fe3,MP-mp-13154,Fe6C2,C-Fe,C25Fe75,P 63 2 2,hexagonal,4.320303,4.661709996616013,4.66170975,data/final/MP/cifs/C1Fe3-MP-mp-13154.cif,data/source/MP/raw/cifs/mp-13154.cif,mp-13154,0.0,,2011-06-01 13:23:25,7.333626503732596,10.17188/1189421,"@misc{osti_1189421,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Fe3C (SG:182) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189421"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687585'}},0.055299538749999,5.96443993,520.0,-68.83121579,-8.60390197375,"{'tags': ['Bainite (upper)', 'Iron carbide (3/1)']}",-68.83121579,-8.60390197375,0.055299538749999,"['xas', 'elasticity', 'bandstructure']",True,"[184959, 42542, 163151]",True,2021-05-12 10:56:12.755000,FM,8,9,mp-13154,,Fe3C,"{'functional': 'PBE', 'labels': ['Fe_pv', 'C'], 'pot_type': 'paw'}","{'Fe': 3.0, 'C': 1.0}",GGA,mp-13154,"['mp-919103', 'mp-920127', 'mp-906349', 'mp-13154', 'mp-1079658', 'mp-1300475', 'mp-1687585', 'mp-1799812', 'mp-1591959']",5.91423235,"{'Fe': 6.0, 'C': 2.0}",81.30838104130281,[],FM,True,182,1,"[2.0, 2.0, 2.0, 2.0, 2.0, 2.0, 0.0, 0.0]",0.145476573860097,5.91423235,6,11.8284647,MP,data/source/MP/cleaned/cifs/MP-mp-13154.cif,False,,data/final/MP/graphs/C1Fe3-MP-mp-13154.json,0,True,622,0,4,0,0,0,0,0,1,0,0,0,1.0,False
Ir45Nb55,3,0.1,0.0181797979797979,False,Ir0.818Nb1,Ir1Nb1,4.88,Other,True,Ir45Nb55,Ir-Nb,2,Supercon,Ir45Nb55,MP-mp-1359,Nb1Ir1,Ir-Nb,Ir50Nb50,P 4/m m m,tetragonal,2.884095,2.884095,3.897234,data/final/MP/cifs/Ir45Nb55-MP-mp-1359-synth_doped.cif,data/source/MP/raw/cifs/mp-1359.cif,mp-1359,0.0,,2011-05-12 22:45:42,14.60516010633782,10.17188/1189675,"@misc{osti_1189675,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbIr (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189675"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688420'}},0.0,7.1614056,520.0,-19.97897518,-9.98948759,{'tags': ['Iridium niobium (1/1)']},-19.97897518,-9.98948759,-0.5196198599999988,"['xas', 'elasticity', 'bandstructure']",True,"[640846, 104509, 640836, 104510, 640829]",True,2021-05-12 10:56:12.755000,NM,2,8,mp-1359,,NbIr,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Ir'], 'pot_type': 'paw'}","{'Nb': 1.0, 'Ir': 1.0}",GGA,mp-1359,"['mp-929389', 'mp-912591', 'mp-929015', 'mp-1359', 'mp-1476237', 'mp-1688420', 'mp-1790803', 'mp-1587899']",2e-06,"{'Nb': 1.0, 'Ir': 1.0}",32.41720788021917,[],NM,False,123,0,"[0, 0]",6.169562805624574e-08,2e-06,0,2e-06,MP,data/source/MP/cleaned/cifs/MP-mp-1359.cif,True,,data/final/MP/graphs/Ir45Nb55-MP-mp-1359-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
As1Co0.025Fe0.975Na1,2,0.0166666666666666,2.0,False,As2Co0.05Fe1.95Na2,As2Fe2Na2,21.05,Ferrite,True,As33.333Co0.833Fe32.5Na33.333,As-Co-Fe-Na,4,Supercon,Na1Fe0.975Co0.025As1,MP-mp-22152,Na2Fe2As2,As-Fe-Na,As33.333Fe33.333Na33.333,P 4/n m m,tetragonal,3.923688,3.923688,6.918844,data/final/MP/cifs/As1Co0.025Fe0.975Na1-MP-mp-22152-synth_doped.cif,data/source/MP/raw/cifs/mp-22152.cif,mp-22152,0.0,,2014-02-21 10:51:39,4.793908463406792,10.17188/1197381,"@misc{osti_1197381,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NaFeAs (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197381"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704688'}},0.0,4.10723066,520.0,-30.57538864,-5.095898106666667,{'tags': ['Sodium iron arsenide']},-30.57538864,-5.095898106666667,-0.2786807238505749,"['xas', 'elasticity', 'bandstructure']",True,"[163144, 163143]",True,2021-05-12 10:56:16.728000,FM,6,8,mp-22152,,NaFeAs,"{'functional': 'PBE', 'labels': ['Na_pv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Na': 1.0, 'Fe': 1.0, 'As': 1.0}",GGA,mp-22152,"['mp-906352', 'mp-920130', 'mp-919102', 'mp-22152', 'mp-1413190', 'mp-1704688', 'mp-1797758', 'mp-1594769']",0.0693226,"{'Na': 2.0, 'Fe': 2.0, 'As': 2.0}",106.5178694490858,[],FM,True,129,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.0]",0.0013016144682303,0.0693226,2,0.1386452,MP,data/source/MP/cleaned/cifs/MP-mp-22152.cif,True,,data/final/MP/graphs/As1Co0.025Fe0.975Na1-MP-mp-22152-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ba2Cu3Tb0.1Y0.9O7,2,0.0153846153846153,1.0,True,Ba2Cu3Tb0.1Y0.9O7,Ba2Cu3Y1O7,91.0,Cuprate,True,Ba15.385Cu23.077Tb0.769Y6.923O53.84615384615385,Ba-Cu-Tb-Y-O,5,Supercon,Y0.9Tb0.1Ba2Cu3O7,MP-mp-20674,Ba2Y1Cu3O7,Ba-Cu-Y-O,Ba15.385Cu23.077Y7.692O53.84615384615385,P m m m,orthorhombic,3.844668,3.926152,11.823664,data/final/MP/cifs/Ba2Cu3Tb0.1Y0.9O7-MP-mp-20674-synth_doped.cif,data/source/MP/raw/cifs/mp-20674.cif,mp-20674,0.0,,2014-02-22 18:23:22,6.198285186087997,10.17188/1195834,"@misc{osti_1195834,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2YCu3O7 (SG:47) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195834"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686609'}},0.0313759126602519,3.28295453,520.0,-80.7708035,-6.213138730769231,"{'tags': ['Yttrium barium copper oxide (1/2/3/7)', 'Dibarium yttrium dicopper copper(III) oxide', 'Yttrium barium copper oxide (1/2/3/6.93)', 'Dibarium yttrium copper(III) dicopper oxide', 'High pressure experimental phase', 'Yttrium dibarium dicopper copper(III) oxide']}",-80.7708035,-6.213138730769231,-2.180157206282052,"['xas', 'elasticity', 'bandstructure']",True,"[196266, 196264, 196265, 71423, 66620, 63483, 66621, 164530, 56507, 63487, 66602, 66601, 68394, 63486, 63485, 202774, 62466, 62465, 41646, 65224, 202773, 66600, 63335, 66611, 78598, 66617, 81175, 66610, 66619, 66615, 63484, 86958, 262809, 66609, 184677, 202775, 66616, 63488, 66618, 66623, 202771, 66622, 202772, 77737, 202770, 62928, 77745]",True,2021-05-12 10:56:14.760000,NM,13,14,mp-20674,oxide,Ba2YCu3O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Cu': 3.0, 'O': 7.0}",GGA,mp-20674,"['mp-923155', 'mp-917354', 'mp-922372', 'mp-20674', 'mp-1103385', 'mp-1103741', 'mp-1103748', 'mp-1104329', 'mp-1104589', 'mp-1440689', 'mp-1686609', 'mp-1832558', 'mp-1596594', 'mp-1592890']",0.0001806,"{'Ba': 2.0, 'Y': 1.0, 'Cu': 3.0, 'O': 7.0}",178.47526348558395,[],NM,False,47,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.0119049355799813e-06,0.0001806,0,0.0001806,MP,data/source/MP/cleaned/cifs/MP-mp-20674.cif,True,,data/final/MP/graphs/Ba2Cu3Tb0.1Y0.9O7-MP-mp-20674-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Nb0.26U0.74,2,0.02,8.0,False,Nb2.08U5.92,Nb2U6,1.85,Heavy_fermion,True,Nb26U74,Nb-U,2,Supercon,Nb0.26U0.74,MP-mp-972551,U6Nb2,Nb-U,Nb25U75,P 63/m m c,hexagonal,5.47549,5.930717999946023,5.930717609999999,data/final/MP/cifs/Nb0.26U0.74-MP-mp-972551-synth_doped.cif,data/source/MP/raw/cifs/mp-972551.cif,mp-972551,0.0,,2015-09-16 01:37:32,16.068701668754734,10.17188/1313878,"@misc{osti_1313878,
    author = ""Persson, Kristin"",
    title = ""Materials Data on U3Nb (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1313878"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1752359'}},0.3415145425000006,12.07866299,520.0,-85.2189538,-10.652369225,{'tags': []},-85.2189538,-10.652369225,0.3415145425000006,"['xas', 'bandstructure']",True,[],True,2021-05-12 10:57:55.580000,NM,8,8,mp-972551,,U3Nb,"{'functional': 'PBE', 'labels': ['U', 'Nb_pv'], 'pot_type': 'paw'}","{'U': 3.0, 'Nb': 1.0}",GGA,mp-972551,"['mp-972719', 'mp-972786', 'mp-972551', 'mp-1386707', 'mp-1752359', 'mp-1827596', 'mp-1655008', 'mp-972844']",0.14362885,"{'U': 6.0, 'Nb': 2.0}",166.789279340187,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0017222791604855,0.14362885,0,0.2872577,MP,data/source/MP/cleaned/cifs/MP-mp-972551.cif,True,,data/final/MP/graphs/Nb0.26U0.74-MP-mp-972551-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
As2Ba0.818Fe2Na0.182,3,0.0605333333333333,3.0,False,As6Ba2.454Fe6Na0.546,As6Ba2Fe6Na1,6.4,Ferrite,True,As40Ba16.36Fe40Na3.64,As-Ba-Fe-Na,4,Supercon,Ba0.818Na0.182Fe2As2,MP-mp-1228583,Ba2Na1Fe6As6,As-Ba-Fe-Na,As40Ba13.333Fe40Na6.667,C 1 2/m 1,monoclinic,5.502160002138175,6.99761027,8.802836470000003,data/final/MP/cifs/As2Ba0.818Fe2Na0.182-MP-mp-1228583-synth_doped.cif,data/source/MP/raw/cifs/mp-1228583.cif,mp-1228583,0.0,,2019-01-13 04:16:43.045000,6.084135795710686,,,,0.0238926390000022,4.38666976,520.0,-90.45798907,-6.030532604666666,{'tags': []},-90.45798907,-6.030532604666666,-0.4348507324367821,[],False,[],True,2021-05-12 11:00:59.151000,FM,15,3,mp-1228583,,Ba2Na(FeAs)6,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Na_pv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Na': 1.0, 'Fe': 6.0, 'As': 6.0}",GGA,mp-1228583,"['mp-1228583', 'mp-1329033', 'mp-1656554']",1.3754397,"{'Ba': 2.0, 'Na': 1.0, 'Fe': 6.0, 'As': 6.0}",295.37595060340544,[],FM,True,12,2,"[0.0, 0.0, 0.0, 0.3, 0.2, 0.2, 0.2, 0.2, 0.3, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0046565730797994,1.3754397,6,1.3754397,MP,data/source/MP/cleaned/cifs/MP-mp-1228583.cif,True,,data/final/MP/graphs/As2Ba0.818Fe2Na0.182-MP-mp-1228583-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
Mo1Te2,1,0.0,4.0,False,Mo4Te8,Mo4Te8,0.3,Chevrel,True,Mo33.333Te66.667,Mo-Te,2,Supercon,Mo1Te2,MP-mp-1030319,Te8Mo4,Mo-Te,Mo33.333Te66.667,P -3 m 1,trigonal,3.558710003127654,3.55871064,40.69329,data/final/MP/cifs/Mo1Te2-MP-mp-1030319.cif,data/source/MP/raw/cifs/mp-1030319.cif,mp-1030319,1.861,,2017-05-21 10:04:54,5.225774405192369,,,{'GGA': {'task_id': 'mp-1030328'}},0.0,3.88841534,520.0,-71.83350652,-5.986125543333333,{'tags': []},-71.83350652,-5.986125543333333,-0.5567105800000007,['bandstructure'],True,[],True,2021-05-12 10:58:10.934000,NM,12,6,mp-1030319,,Te2Mo,"{'functional': 'PBE', 'labels': ['Te', 'Mo_pv'], 'pot_type': 'paw'}","{'Te': 2.0, 'Mo': 1.0}",GGA,mp-1030319,"['mp-1030328', 'mp-1030336', 'mp-1030322', 'mp-1030319', 'mp-1345486', 'mp-1822972']",4.7375e-05,"{'Te': 8.0, 'Mo': 4.0}",446.3121770174921,[],NM,False,164,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.245907007654264e-07,4.7375e-05,0,0.0001895,MP,data/source/MP/cleaned/cifs/MP-mp-1030319.cif,False,,data/final/MP/graphs/Mo1Te2-MP-mp-1030319.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ir0.98Pt0.02Te2,2,0.0133333333333333,4.0,False,Ir3.92Pt0.08Te8,Ir4Te8,1.4275,Other,True,Ir32.667Pt0.667Te66.667,Ir-Pt-Te,3,Supercon,Ir0.98Pt0.02Te2,MP-mp-569322,Te8Ir4,Ir-Te,Ir33.333Te66.667,P n m a,orthorhombic,4.049805,5.441863,13.587474,data/final/MP/cifs/Ir0.98Pt0.02Te2-MP-mp-569322-synth_doped.cif,data/source/MP/raw/cifs/mp-569322.cif,mp-569322,0.0,,2014-02-16 04:48:25,9.924328423353325,10.17188/1275037,"@misc{osti_1275037,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Te2Ir (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1275037"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1746248'}},0.0123894575000003,7.60847828,520.0,-63.94410921,-5.3286757675,{'tags': ['Iridium telluride (1/2)']},-63.94410921,-5.3286757675,-0.5683316741666667,"['xas', 'bandstructure']",True,[93894],True,2021-05-12 10:57:24.969000,NM,12,7,mp-569322,,Te2Ir,"{'functional': 'PBE', 'labels': ['Te', 'Ir'], 'pot_type': 'paw'}","{'Te': 2.0, 'Ir': 1.0}",GGA,mp-569322,"['mp-927873', 'mp-927408', 'mp-569322', 'mp-911451', 'mp-1392626', 'mp-1746248', 'mp-1810340']",0.000153075,"{'Te': 8.0, 'Ir': 4.0}",299.44732816890644,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.0447669503153013e-06,0.000153075,0,0.0006123,MP,data/source/MP/cleaned/cifs/MP-mp-569322.cif,True,,data/final/MP/graphs/Ir0.98Pt0.02Te2-MP-mp-569322-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Pd0.012Pt2.988U1,2,0.006,2.0,False,Pd0.024Pt5.976U2,Pt6U2,0.24,Heavy_fermion,True,Pd0.3Pt74.7U25,Pd-Pt-U,3,Supercon,U1Pt2.988Pd0.012,MP-mp-30855,U2Pt6,Pt-U,Pt75U25,P 63/m m c,hexagonal,4.997603,5.777009996166576,5.7770105,data/final/MP/cifs/Pd0.012Pt2.988U1-MP-mp-30855-synth_doped.cif,data/source/MP/raw/cifs/mp-30855.cif,mp-30855,0.0,,2014-02-19 21:36:23,18.929034548497903,10.17188/1205211,"@misc{osti_1205211,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UPt3 (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1205211"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687777'}},0.0,9.26919984,520.0,-64.84444661,-8.10555582625,"{'tags': ['Platinum uranium (3/1)', 'Uranium platinum boride (1/3/0.11)', 'Uranium platinum (1/3)']}",-64.84444661,-8.10555582625,-0.7295225412500006,"['xas', 'bandstructure']",True,"[615213, 649804, 105833, 191938]",True,2021-05-12 10:57:04.957000,FM,8,11,mp-30855,,UPt3,"{'functional': 'PBE', 'labels': ['U', 'Pt'], 'pot_type': 'paw'}","{'U': 1.0, 'Pt': 3.0}",GGA,mp-30855,"['mp-943077', 'mp-932790', 'mp-942062', 'mp-30855', 'mp-1078485', 'mp-1079639', 'mp-1092253', 'mp-1299942', 'mp-1687777', 'mp-1924669', 'mp-1595664']",0.6726182,"{'U': 2.0, 'Pt': 6.0}",144.44372324836635,[],FM,True,187,1,"[0.0, 1.4, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0093132215768691,0.6726182,1,1.3452364,MP,data/source/MP/cleaned/cifs/MP-mp-30855.cif,True,,data/final/MP/graphs/Pd0.012Pt2.988U1-MP-mp-30855-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
B2C1Rh2U1,1,0.0,1.0,True,B2C1Rh2U1,B2C1Rh2U1,0.0,Heavy_fermion,True,B33.333C16.667Rh33.333U16.667,B-C-Rh-U,4,Supercon,U1Rh2B2C1,MP-mp-1025127,U1B2Rh2C1,B-C-Rh-U,B33.333C16.667Rh33.333U16.667,I 4/m m m,tetragonal,3.796086001135432,3.796086001135432,5.80080957,data/final/MP/cifs/B2C1Rh2U1-MP-mp-1025127.cif,data/source/MP/raw/cifs/mp-1025127.cif,mp-1025127,0.0,,2016-10-01 12:32:55,10.699408998032869,10.17188/1355342,"@article{osti_1355342,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UB2Rh2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1355342"",
    place = ""United States"",
    year = ""2017"",
    month = ""5""
}
",{'GGA': {'task_id': 'mp-1697137'}},0.041297929464287,8.6922054,520.0,-51.20003627,-8.533339378333332,"{'tags': ['LuNi2B2C', 'Uranium rhodium boride carbide (1/2/2/1)', 'URh2B2C']}",-51.20003627,-8.533339378333332,-0.4324077130555548,"['bandstructure', 'elasticity']",True,[659008],True,2021-05-12 10:56:10.715000,FM,6,6,mp-1025127,,UB2Rh2C,"{'functional': 'PBE', 'labels': ['U', 'B', 'Rh_pv', 'C'], 'pot_type': 'paw'}","{'U': 1.0, 'B': 2.0, 'Rh': 2.0, 'C': 1.0}",GGA,mp-1025127,"['mp-1025127', 'mp-1077758', 'mp-1414907', 'mp-1697137', 'mp-1800871', 'mp-1596482']",1.9562114,"{'U': 1.0, 'B': 2.0, 'Rh': 2.0, 'C': 1.0}",74.10333807056415,[],FM,True,139,1,"[2.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0263984248339422,1.9562114,1,1.9562114,MP,data/source/MP/cleaned/cifs/MP-mp-1025127.cif,False,,data/final/MP/graphs/B2C1Rh2U1-MP-mp-1025127.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
La1Se1,1,0.0,1.0,True,La1Se1,La1Se1,1.02,Other,True,La50Se50,La-Se,2,Supercon,La1Se1,MP-mp-1161,La1Se1,La-Se,La50Se50,F m -3 m,cubic,4.31451102,4.314511019999999,4.31451102,data/final/MP/cifs/La1Se1-MP-mp-1161.cif,data/source/MP/raw/cifs/mp-1161.cif,mp-1161,0.0,,2011-05-12 18:01:53,6.370268690982408,10.17188/1188105,"@misc{osti_1188105,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaSe (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188105"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668729'}},0.0,7.8532263,520.0,-12.42054673,-6.210273365,"{'tags': ['Lanthanum(II) selenide', 'Lanthanum selenide (1/1)']}",-12.42054673,-6.210273365,-2.2303140736718747,"['xas', 'bandstructure']",True,"[183943, 641921, 29395, 641924, 641930, 641926, 27104]",True,2021-05-12 10:56:51.169000,NM,2,13,mp-1161,,LaSe,"{'functional': 'PBE', 'labels': ['La', 'Se'], 'pot_type': 'paw'}","{'La': 1.0, 'Se': 1.0}",GGA,mp-1161,"['mp-1000461', 'mp-1006939', 'mp-1161', 'mp-1056965', 'mp-1056977', 'mp-1056998', 'mp-1442026', 'mp-1668729', 'mp-1792555', 'mp-1011660', 'mp-1591521', 'mp-1595264', 'mp-1057003']",0.0004867,"{'La': 1.0, 'Se': 1.0}",56.79103060602274,[],NM,False,225,0,"[0, 0]",8.570015278933591e-06,0.0004867,0,0.0004867,MP,data/source/MP/cleaned/cifs/MP-mp-1161.cif,False,,data/final/MP/graphs/La1Se1-MP-mp-1161.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Nb0.48Rh0.52,2,0.04,2.0,False,Nb0.96Rh1.04,Nb1Rh1,3.76,Other,True,Nb48Rh52,Nb-Rh,2,Supercon,Nb0.48Rh0.52,MP-mp-1963,Nb1Rh1,Nb-Rh,Nb50Rh50,P 4/m m m,tetragonal,2.879837,2.879837,3.877267,data/final/MP/cifs/Nb0.48Rh0.52-MP-mp-1963-synth_doped.cif,data/source/MP/raw/cifs/mp-1963.cif,mp-1963,0.0,,2011-05-13 04:08:05,10.111756697385587,10.17188/1194846,"@misc{osti_1194846,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbRh (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1194846"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687603'}},0.0,6.00208314,520.0,-18.26823899,-9.134119495,{'tags': ['Niobium rhodium (1/1)']},-18.26823899,-9.134119495,-0.4013130399999998,"['xas', 'elasticity', 'bandstructure']",True,"[645280, 105213]",True,2021-05-12 10:56:14.760000,NM,2,8,mp-1963,,NbRh,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Rh_pv'], 'pot_type': 'paw'}","{'Nb': 1.0, 'Rh': 1.0}",GGA,mp-1963,"['mp-929427', 'mp-912669', 'mp-929028', 'mp-1963', 'mp-1439069', 'mp-1687603', 'mp-1790574', 'mp-1591985']",0.0050183,"{'Nb': 1.0, 'Rh': 1.0}",32.15596321937415,[],NM,False,123,0,"[0, 0]",0.0001560612557541,0.0050183,0,0.0050183,MP,data/source/MP/cleaned/cifs/MP-mp-1963.cif,True,,data/final/MP/graphs/Nb0.48Rh0.52-MP-mp-1963-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
As1.74Eu1Fe2P0.26,3,0.104,1.0,True,As1.74Eu1Fe2P0.26,As2Eu1Fe2,0.0,Ferrite,True,As34.8Eu20Fe40P5.2,As-Eu-Fe-P,4,Supercon,Eu1Fe2As1.74P0.26,MP-mp-20890,Eu1Fe2As2,As-Eu-Fe,As40Eu20Fe40,I 4/m m m,tetragonal,3.9736679999368567,3.9736679999368567,6.07120609,data/final/MP/cifs/As1.74Eu1Fe2P0.26-MP-mp-20890-synth_doped.cif,data/source/MP/raw/cifs/mp-20890.cif,mp-20890,0.0,,2014-02-21 09:03:25,8.079887417044961,10.17188/1196086,"@misc{osti_1196086,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Eu(FeAs)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196086"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687595'}},0.0,5.69045342,520.0,-39.43180547,-7.886361094,"{'tags': ['High pressure experimental phase', 'Europium diiron diarsenide - HP', 'Europium diiron diarsenide', 'Europium iron arsenide (1/2/2)']}",-39.43180547,-7.886361094,-0.5763016570000005,"['xas', 'bandstructure']",True,"[169689, 169687, 185355, 169691, 163211, 185356, 610431, 169690, 169688, 163210]",True,2021-05-12 10:56:57.051000,FM,5,16,mp-20890,,Eu(FeAs)2,"{'functional': 'PBE', 'labels': ['Eu', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Eu': 1.0, 'Fe': 2.0, 'As': 2.0}",GGA,mp-20890,"['mp-991161', 'mp-993140', 'mp-20890', 'mp-1069324', 'mp-1069480', 'mp-1069596', 'mp-1069907', 'mp-1070115', 'mp-1069978', 'mp-1442076', 'mp-1687595', 'mp-1782260', 'mp-994461', 'mp-1594012', 'mp-1069557', 'mp-1070074']",6.9579645,"{'Eu': 1.0, 'Fe': 2.0, 'As': 2.0}",84.97992844321493,[],FM,True,139,1,"[6.7, -0.0, -0.0, 0.0, 0.0]",0.0818777401613068,6.9579645,1,6.9579645,MP,data/source/MP/cleaned/cifs/MP-mp-20890.cif,True,,data/final/MP/graphs/As1.74Eu1Fe2P0.26-MP-mp-20890-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B2Co0.02Mg0.98,2,0.0133333333333333,1.0,True,B2Co0.02Mg0.98,B2Mg1,37.4,Other,True,B66.667Co0.667Mg32.667,B-Co-Mg,3,Supercon,Mg0.98Co0.02B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/B2Co0.02Mg0.98-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/B2Co0.02Mg0.98-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Tl1Zr4,3,0.1,0.75,False,Tl0.75Zr3,Tl1Zr3,0.0,Other,True,Tl20Zr80,Tl-Zr,2,Supercon,Tl1Zr4,MP-mp-977585,Zr3Tl1,Tl-Zr,Tl25Zr75,P m -3 m,cubic,4.491154,4.491154,4.491154,data/final/MP/cifs/Tl1Zr4-MP-mp-977585-synth_doped.cif,data/source/MP/raw/cifs/mp-977585.cif,mp-977585,0.0,,2014-12-22 15:49:51,8.763011739851516,10.17188/1315799,"@misc{osti_1315799,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Zr3Tl (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1315799"",
    place = ""United States"",
    year = ""2016"",
    month = ""9"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1760332'}},0.0,5.632566,520.0,-28.48349796,-7.12087449,{'tags': []},-28.48349796,-7.12087449,-0.1194382308333343,"['xas', 'elasticity', 'bandstructure']",True,[],True,2021-05-12 10:56:37.246000,NM,4,8,mp-977585,,Zr3Tl,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Tl_d'], 'pot_type': 'paw'}","{'Zr': 3.0, 'Tl': 1.0}",GGA,mp-977585,"['mp-1005436', 'mp-977585', 'mp-1005897', 'mp-1408441', 'mp-1760332', 'mp-1783515', 'mp-1011117', 'mp-1615210']",0.0013266,"{'Zr': 3.0, 'Tl': 1.0}",90.58866120595133,[],NM,False,221,0,"[0, 0, 0, 0]",1.4644216862682232e-05,0.0013266,0,0.0013266,MP,data/source/MP/cleaned/cifs/MP-mp-977585.cif,True,,data/final/MP/graphs/Tl1Zr4-MP-mp-977585-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Al13Ru4,1,0.0,3.0,False,Al39Ru12,Al39Ru12,0.0,Other,True,Al76.471Ru23.529,Al-Ru,2,Supercon,Al13Ru4,MP-mp-17880,Al39Ru12,Al-Ru,Al76.471Ru23.529,C 1 2/m 1,monoclinic,8.2182460028978,8.97068582,12.79902233,data/final/MP/cifs/Al13Ru4-MP-mp-17880.cif,data/source/MP/raw/cifs/mp-17880.cif,mp-17880,0.0,,2014-02-14 22:56:18,4.708846115989373,10.17188/1192749,"@misc{osti_1192749,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Al13Ru4 (SG:12) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1192749"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1008063'}},0.0,7.95647162,520.0,-284.73784285,-5.583094957843137,{'tags': ['Aluminium ruthenium (13/4)']},-284.73784285,-5.583094957843137,-0.5366217572549025,"['xas', 'bandstructure']",True,"[58158, 188006]",True,2021-05-12 10:56:55.092000,NM,51,8,mp-17880,,Al13Ru4,"{'functional': 'PBE', 'labels': ['Al', 'Ru_pv'], 'pot_type': 'paw'}","{'Al': 13.0, 'Ru': 4.0}",GGA,mp-17880,"['mp-1008063', 'mp-1001557', 'mp-17880', 'mp-1203381', 'mp-1254539', 'mp-1345087', 'mp-1895326', 'mp-1012393']",7.086666666666666e-05,"{'Al': 39.0, 'Ru': 12.0}",798.777485365672,[],NM,False,12,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.661567256151116e-07,7.086666666666666e-05,0,0.0002126,MP,data/source/MP/cleaned/cifs/MP-mp-17880.cif,False,,data/final/MP/graphs/Al13Ru4-MP-mp-17880.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,1.0,False
Al0.61Mg0.39,3,0.1133333333333333,3.0,False,Al1.83Mg1.17,Al2Mg1,0.85,Other,True,Al61Mg39,Al-Mg,2,Supercon,Al0.61Mg0.39,MP-mp-1222013,Mg1Al2,Al-Mg,Al66.667Mg33.333,P -3 m 1,trigonal,3.025555998685988,3.02555569,7.035691,data/final/MP/cifs/Al0.61Mg0.39-MP-mp-1222013-synth_doped.cif,data/source/MP/raw/cifs/mp-1222013.cif,mp-1222013,0.0,,2019-01-12 22:36:55.486000,2.3301615984815167,,,,0.0658194083333332,6.20317385,520.0,-8.95984036,-2.9866134533333333,{'tags': []},-8.95984036,-2.9866134533333333,0.0438637833333335,[],False,[],True,2021-05-12 11:00:49.659000,NM,3,3,mp-1222013,,MgAl2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Al'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Al': 2.0}",GGA,mp-1222013,"['mp-1222013', 'mp-1424906', 'mp-1794299']",0.0012407,"{'Mg': 1.0, 'Al': 2.0}",55.7760457227343,[],NM,False,164,0,"[0, 0, 0]",2.2244316245859123e-05,0.0012407,0,0.0012407,MP,data/source/MP/cleaned/cifs/MP-mp-1222013.cif,True,,data/final/MP/graphs/Al0.61Mg0.39-MP-mp-1222013-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Nb3S4,1,0.0,2.0,False,Nb6S8,Nb6S8,3.81,Chevrel,True,Nb42.857S57.143,Nb-S,2,Supercon,Nb3S4,MP-mp-12627,Nb6S8,Nb-S,Nb42.857S57.143,P 63/m,hexagonal,3.408545,9.66783199644529,9.6678319,data/final/MP/cifs/Nb3S4-MP-mp-12627.cif,data/source/MP/raw/cifs/mp-12627.cif,mp-12627,0.0,,2011-06-03 03:57:28,4.89884157624701,10.17188/1189092,"@misc{osti_1189092,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3S4 (SG:176) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189092"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1670010'}},0.0,5.11898129,520.0,-109.09905315,-7.792789510714286,{'tags': ['Niobium sulfide (3/4)']},-109.09905315,-7.792789510714286,-1.3874017124999998,"['xas', 'bandstructure']",True,"[76567, 645317]",True,2021-05-12 10:56:53.126000,NM,14,9,mp-12627,,Nb3S4,"{'functional': 'PBE', 'labels': ['Nb_pv', 'S'], 'pot_type': 'paw'}","{'Nb': 3.0, 'S': 4.0}",GGA,mp-12627,"['mp-914351', 'mp-1001378', 'mp-12627', 'mp-1104927', 'mp-1425978', 'mp-1670010', 'mp-1926848', 'mp-1007808', 'mp-1597249']",0.05867355,"{'Nb': 6.0, 'S': 8.0}",275.90390533878127,[],NM,False,176,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.000425318734999,0.05867355,0,0.1173471,MP,data/source/MP/cleaned/cifs/MP-mp-12627.cif,False,,data/final/MP/graphs/Nb3S4-MP-mp-12627.json,0,True,6/m,0,3,0,0,0,0,0,1,0,0,0,1.0,False
Al4U1,1,0.0,2.0,False,Al8U2,Al8U2,0.0,Heavy_fermion,True,Al80U20,Al-U,2,Supercon,U1Al4,MP-mp-574122,U2Al8,Al-U,Al80U20,I m m a,orthorhombic,4.3500239991045495,6.241575999019761,7.88678303,data/final/MP/cifs/Al4U1-MP-mp-574122.cif,data/source/MP/raw/cifs/mp-574122.cif,mp-574122,0.0,,2014-02-23 18:02:34,6.125069251485443,,,{'GGA': {'task_id': 'mp-1672292'}},0.0163857245000018,8.40552279,520.0,-53.57785211,-5.357785211,"{'tags': ['Uranium aluminium (1/4)', 'Aluminium uranium (4/1)', 'Aluminum uranium (4/1)', 'Uranium aluminide (1/4)']}",-53.57785211,-5.357785211,-0.1030425450000002,"['xas', 'bandstructure']",True,"[609580, 240127, 609603, 107243, 150933, 107252]",True,2021-05-12 10:57:26.891000,FM,10,9,mp-574122,,UAl4,"{'functional': 'PBE', 'labels': ['U', 'Al'], 'pot_type': 'paw'}","{'U': 1.0, 'Al': 4.0}",GGA,mp-574122,"['mp-905466', 'mp-918610', 'mp-919595', 'mp-574122', 'mp-1251296', 'mp-1300067', 'mp-1672292', 'mp-1830998', 'mp-1595612']",2.61129005,"{'U': 2.0, 'Al': 8.0}",187.5805402804217,[],FM,True,74,1,"[2.2, 2.2, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0278418011388204,2.61129005,2,5.2225801,MP,data/source/MP/cleaned/cifs/MP-mp-574122.cif,False,,data/final/MP/graphs/Al4U1-MP-mp-574122.json,0,True,mmm,0,0,0,7,0,0,0,0,0,1,0,1.0,False
B2Er0.15Lu0.85Ru1,3,0.075,4.0,False,B8Er0.6Lu3.4Ru4,B8Lu4Ru4,8.86,Other,True,B50Er3.75Lu21.25Ru25,B-Er-Lu-Ru,4,Supercon,Lu0.85Er0.15Ru1B2,MP-mp-29239,Lu4B8Ru4,B-Lu-Ru,B50Lu25Ru25,P n m a,orthorhombic,5.262881,5.829858,6.288542,data/final/MP/cifs/B2Er0.15Lu0.85Ru1-MP-mp-29239-synth_doped.cif,data/source/MP/raw/cifs/mp-29239.cif,mp-29239,0.0,,2014-02-24 06:45:28,10.246997128776938,10.17188/1203618,"@misc{osti_1203618,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LuB2Ru (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1203618"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677301'}},0.0,6.02142224,520.0,-119.30016105,-7.456260065625,"{'tags': ['Lutetium ruthenium(III) boride', 'Lutetium ruthenium boride (1/1/2)']}",-119.30016105,-7.456260065625,-0.6677291364583331,"['xas', 'bandstructure']",True,"[614715, 100774]",True,2021-05-12 10:57:03.017000,NM,16,8,mp-29239,,LuB2Ru,"{'functional': 'PBE', 'labels': ['Lu_3', 'B', 'Ru_pv'], 'pot_type': 'paw'}","{'Lu': 1.0, 'B': 2.0, 'Ru': 1.0}",GGA,mp-29239,"['mp-909473', 'mp-925177', 'mp-924466', 'mp-29239', 'mp-1381674', 'mp-1677301', 'mp-1784701', 'mp-1603819']",4.565e-05,"{'Lu': 4.0, 'B': 8.0, 'Ru': 4.0}",192.9440954509509,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",9.4638812124945e-07,4.565e-05,0,0.0001826,MP,data/source/MP/cleaned/cifs/MP-mp-29239.cif,True,,data/final/MP/graphs/B2Er0.15Lu0.85Ru1-MP-mp-29239-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ba1Ga1Ge1,1,0.0,4.0,False,Ba4Ga4Ge4,Ba4Ga4Ge4,2.4,Other,True,Ba33.333Ga33.333Ge33.333,Ba-Ga-Ge,3,Supercon,Ba1Ga1Ge1,MP-mp-1102026,Ba4Ga4Ge4,Ba-Ga-Ge,Ba33.333Ga33.333Ge33.333,P 63/m m c,hexagonal,4.401409999564698,4.40141011,20.471637,data/final/MP/cifs/Ba1Ga1Ge1-MP-mp-1102026.cif,data/source/MP/raw/cifs/mp-1102026.cif,mp-1102026,0.0,,2018-07-18 13:16:52,5.409027105158489,,,{'GGA': {'task_id': 'mp-1673705'}},0.0,2.87864409,520.0,-44.80586727,-3.7338222725,"{'tags': ['BaGaGe hex2', 'AlB2 family', 'Barium gallium germanide (1/1/1)', 'YPtAs']}",-44.80586727,-3.7338222725,-0.543790703333333,['bandstructure'],True,[615870],True,2021-05-12 10:58:18.470000,NM,12,5,mp-1102026,,BaGaGe,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ga_d', 'Ge_d'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Ga': 1.0, 'Ge': 1.0}",GGA,mp-1102026,"['mp-1102026', 'mp-1435340', 'mp-1673705', 'mp-1842725', 'mp-1603691']",6.75e-07,"{'Ba': 4.0, 'Ga': 4.0, 'Ge': 4.0}",343.4526486986392,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",7.861345691263255e-09,6.75e-07,0,2.7e-06,MP,data/source/MP/cleaned/cifs/MP-mp-1102026.cif,False,,data/final/MP/graphs/Ba1Ga1Ge1-MP-mp-1102026.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Zn2Zr1,1,0.0,2.0,False,Zn4Zr2,Zn4Zr2,0.296666667,Other,True,Zn66.667Zr33.333,Zn-Zr,2,Supercon,Zn2Zr1,MP-mp-1401,Zr2Zn4,Zn-Zr,Zn66.667Zr33.333,F d -3 m,cubic,5.24442432,5.24442432,5.24442432,data/final/MP/cifs/Zn2Zr1-MP-mp-1401.cif,data/source/MP/raw/cifs/mp-1401.cif,mp-1401,0.0,,2011-05-13 16:25:44,7.229957651117005,10.17188/1189877,"@misc{osti_1189877,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrZn2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189877"",
    place = ""United States"",
    year = ""2015"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688694'}},0.0,3.5477293,520.0,-23.94969111,-3.991615185,{'tags': ['Zinc zirconium (2/1)']},-23.94969111,-3.991615185,-0.3025525683333334,"['xas', 'elasticity', 'bandstructure']",True,"[653508, 106237, 106236, 653517, 653523, 653507, 653510]",True,2021-05-12 10:56:12.755000,FM,6,8,mp-1401,,ZrZn2,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Zn'], 'pot_type': 'paw'}","{'Zr': 1.0, 'Zn': 2.0}",GGA,mp-1401,"['mp-942124', 'mp-932864', 'mp-943152', 'mp-1401', 'mp-1476076', 'mp-1688694', 'mp-1797360', 'mp-1587513']",0.9105588,"{'Zr': 2.0, 'Zn': 4.0}",101.99490321192484,[],FM,True,227,1,"[0.6, 0.6, 0.0, 0.0, 0.0, 0.0]",0.0178549863047184,0.9105588,2,1.8211176,MP,data/source/MP/cleaned/cifs/MP-mp-1401.cif,False,,data/final/MP/graphs/Zn2Zr1-MP-mp-1401.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ba2Cu3Pr0.8Y0.2O7,3,0.0461538461538461,2.0,False,Ba4Cu6Pr1.6Y0.4O14,Ba4Cu6Pr1Y1O14,0.0,Cuprate,True,Ba15.385Cu23.077Pr6.154Y1.538O53.84615384615385,Ba-Cu-Pr-Y-O,5,Supercon,Y0.2Pr0.8Ba2Cu3O7,MP-mp-1228182,Ba4Pr1Y1Cu6O14,Ba-Cu-Pr-Y-O,Ba15.385Cu23.077Pr3.846Y3.846O53.84615384615385,C m m m,orthorhombic,3.949929,7.74232199751255,12.49432076,data/final/MP/cifs/Ba2Cu3Pr0.8Y0.2O7-MP-mp-1228182-synth_doped.cif,data/source/MP/raw/cifs/mp-1228182.cif,mp-1228182,0.0,,2019-01-13 03:55:31.194000,6.327747434820984,,,,0.0237480683814448,3.26863064,520.0,-159.60355051,-6.138598096538461,{'tags': []},-159.60355051,-6.138598096538461,-2.1704462631410246,[],False,[],True,2021-05-12 11:00:59.151000,NM,26,3,mp-1228182,oxide,Ba4PrY(Cu3O7)2,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Pr_3', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 4.0, 'Pr': 1.0, 'Y': 1.0, 'Cu': 6.0, 'O': 14.0}",GGA,mp-1228182,"['mp-1228182', 'mp-1368338', 'mp-1838576']",0.0118757,"{'Ba': 4.0, 'Pr': 1.0, 'Y': 1.0, 'Cu': 6.0, 'O': 14.0}",363.293922142809,[],NM,False,65,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",3.268895865351615e-05,0.0118757,0,0.0118757,MP,data/source/MP/cleaned/cifs/MP-mp-1228182.cif,True,,data/final/MP/graphs/Ba2Cu3Pr0.8Y0.2O7-MP-mp-1228182-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ba1Sb1.8Sn0.2Ti2O1,3,0.0666666666666666,1.0,True,Ba1Sb1.8Sn0.2Ti2O1,Ba1Sb2Ti2O1,2.2,Oxide,True,Ba16.667Sb30Sn3.333Ti33.333O16.666666666666668,Ba-Sb-Sn-Ti-O,5,Supercon,Ba1Ti2Sb1.8Sn0.2O1,MP-mp-1070806,Ba1Ti2Sb2O1,Ba-Sb-Ti-O,Ba16.667Sb33.333Ti33.333O16.666666666666668,P 4/m m m,tetragonal,4.113474,4.113474,8.312382,data/final/MP/cifs/Ba1Sb1.8Sn0.2Ti2O1-MP-mp-1070806-synth_doped.cif,data/source/MP/raw/cifs/mp-1070806.cif,mp-1070806,0.0,,2018-03-22 04:02:04,5.8154485533321445,,,{'GGA': {'task_id': 'mp-1702174'}},0.0,5.89751533,520.0,-39.14932631,-6.524887718333333,{'tags': []},-39.14932631,-6.524887718333333,-1.5507346602777776,['bandstructure'],True,"[430061, 237789, 430060]",True,2021-05-12 10:58:14.654000,NM,6,16,mp-1070806,oxide,BaTi2Sb2O,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ti_pv', 'Sb', 'O'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Ti': 2.0, 'Sb': 2.0, 'O': 1.0}",GGA,mp-1070806,"['mp-1071055', 'mp-1071068', 'mp-1071083', 'mp-1071088', 'mp-1070806', 'mp-1071124', 'mp-1070846', 'mp-1070900', 'mp-1071137', 'mp-1423542', 'mp-1702174', 'mp-1785425', 'mp-1588663', 'mp-1070899', 'mp-1071129', 'mp-1071119']",0.001055,"{'Ba': 1.0, 'Ti': 2.0, 'Sb': 2.0, 'O': 1.0}",140.65105900950408,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0]",7.500832254158225e-06,0.001055,0,0.001055,MP,data/source/MP/cleaned/cifs/MP-mp-1070806.cif,True,,data/final/MP/graphs/Ba1Sb1.8Sn0.2Ti2O1-MP-mp-1070806-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Pb2S1Se1,1,0.0,1.0,True,Pb2S1Se1,Pb2S1Se1,4.59,Other,True,Pb50S25Se25,Pb-S-Se,3,Supercon,Pb1S1Pb1Se1,MP-mp-1219926,Pb2Se1S1,Pb-S-Se,Pb50S25Se25,R -3 m,trigonal,4.328538371786003,4.328538371786003,7.49414695,data/final/MP/cifs/Pb2S1Se1-MP-mp-1219926.cif,data/source/MP/raw/cifs/mp-1219926.cif,mp-1219926,0.5411999999999999,,2019-01-12 20:51:17.840000,7.610675892273693,,,{'GGA': {'task_id': 'mp-1759129'}},0.0042483199999985,4.83410041,520.0,-17.22799201,-4.3069980025,{'tags': []},-17.22799201,-4.3069980025,-0.7863341313671883,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,4,5,mp-1219926,,Pb2SeS,"{'functional': 'PBE', 'labels': ['Pb_d', 'Se', 'S'], 'pot_type': 'paw'}","{'Pb': 2.0, 'Se': 1.0, 'S': 1.0}",GGA,mp-1219926,"['mp-1219926', 'mp-1405805', 'mp-1759129', 'mp-1804381', 'mp-1585622']",0.0019541,"{'Pb': 2.0, 'Se': 1.0, 'S': 1.0}",114.64011231302725,[],NM,False,166,0,"[0, 0, 0, 0]",1.7045517145554502e-05,0.0019541,0,0.0019541,MP,data/source/MP/cleaned/cifs/MP-mp-1219926.cif,False,,data/final/MP/graphs/Pb2S1Se1-MP-mp-1219926.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Bi1Cu1Mg1,1,0.0,1.0,True,Bi1Cu1Mg1,Bi1Cu1Mg1,0.0,Other,True,Bi33.333Cu33.333Mg33.333,Bi-Cu-Mg,3,Supercon,Bi1Cu1Mg1,MP-mp-30449,Mg1Cu1Bi1,Bi-Cu-Mg,Bi33.333Cu33.333Mg33.333,F -4 3 m,cubic,4.54838942,4.54838942,4.54838942,data/final/MP/cifs/Bi1Cu1Mg1-MP-mp-30449.cif,data/source/MP/raw/cifs/mp-30449.cif,mp-30449,0.0,,2014-02-19 17:15:07,7.40800070028541,10.17188/1204856,"@misc{osti_1204856,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MgCuBi (SG:216) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1204856"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678609'}},0.0163858447222211,5.30462386,520.0,-9.91645526,-3.3054850866666663,{'tags': ['Bismuth copper magnesium (1/1/1)']},-9.91645526,-3.3054850866666663,-0.1089780766666663,"['xas', 'elasticity', 'bandstructure']",True,[58774],True,2021-05-12 10:56:18.721000,NM,3,8,mp-30449,,MgCuBi,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Cu_pv', 'Bi'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Cu': 1.0, 'Bi': 1.0}",GGA,mp-30449,"['mp-928253', 'mp-912124', 'mp-928728', 'mp-30449', 'mp-1437590', 'mp-1678609', 'mp-1784336', 'mp-1589190']",0.0009904,"{'Mg': 1.0, 'Cu': 1.0, 'Bi': 1.0}",66.53618916026576,[],NM,False,216,0,"[0, 0, 0]",1.488513262480998e-05,0.0009904,0,0.0009904,MP,data/source/MP/cleaned/cifs/MP-mp-30449.cif,False,,data/final/MP/graphs/Bi1Cu1Mg1-MP-mp-30449.json,0,True,-43m,5,0,0,0,0,0,0,0,0,0,1,1.0,False
Al1Hf0.15Nb2.85,3,0.0749999999999999,2.0,False,Al2Hf0.3Nb5.7,Al2Nb6,14.4,Other,True,Al25Hf3.75Nb71.25,Al-Hf-Nb,3,Supercon,Nb2.85Hf0.15Al1,MP-mp-796,Nb6Al2,Al-Nb,Al25Nb75,P m -3 n,cubic,5.215254,5.215254,5.215254,data/final/MP/cifs/Al1Hf0.15Nb2.85-MP-mp-796-synth_doped.cif,data/source/MP/raw/cifs/mp-796.cif,mp-796,0.0,,2011-05-13 16:07:37,7.157298025966356,,,{'GGA': {'task_id': 'mp-1686893'}},0.0460773865000003,5.52947534,520.0,-69.48918494,-8.6861481175,"{'tags': ['Aluminium niobium (1/3)', 'Niobium aluminide (3/1)', 'Aluminum niobium (1/3)']}",-69.48918494,-8.6861481175,-0.1737753800000003,"['bandstructure', 'elasticity']",True,"[608675, 608654, 608688, 608668, 608669, 608685, 608676, 608683, 58014, 608657, 107856, 608655, 608666, 608691, 608656, 608665, 608673, 608653, 608661]",True,2021-05-12 10:56:31.128000,NM,8,10,mp-796,,Nb3Al,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Al': 1.0}",GGA,mp-796,"['mp-911586', 'mp-927906', 'mp-796', 'mp-927472', 'mp-1260512', 'mp-1440919', 'mp-1686893', 'mp-1927652', 'mp-1591599', 'mp-1587739']",0.16323955,"{'Nb': 6.0, 'Al': 2.0}",141.8490379078192,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0023015954483396,0.16323955,0,0.3264791,MP,data/source/MP/cleaned/cifs/MP-mp-796.cif,True,,data/final/MP/graphs/Al1Hf0.15Nb2.85-MP-mp-796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
B2C1Gd0.12Lu0.88Ni2,2,0.04,1.0,True,B2C1Gd0.12Lu0.88Ni2,B2C1Lu1Ni2,7.3,Other,True,B33.333C16.667Gd2Lu14.667Ni33.333,B-C-Gd-Lu-Ni,5,Supercon,Lu0.88Gd0.12Ni2B2C1,MP-mp-6544,Lu1Ni2B2C1,B-C-Lu-Ni,B33.333C16.667Lu16.667Ni33.333,I 4/m m m,tetragonal,3.4660159989239463,3.4660159989239463,5.81490896,data/final/MP/cifs/B2C1Gd0.12Lu0.88Ni2-MP-mp-6544-synth_doped.cif,data/source/MP/raw/cifs/mp-6544.cif,mp-6544,0.0,,2011-05-13 04:17:06,8.54504130524706,10.17188/1281287,"@misc{osti_1281287,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LuNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281287"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702891'}},0.0,6.71335166,520.0,-41.78223818,-6.963706363333333,{'tags': []},-41.78223818,-6.963706363333333,-0.5192416763888884,"['xas', 'bandstructure']",True,"[75609, 83230, 79564]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6544,,LuNi2B2C,"{'functional': 'PBE', 'labels': ['Lu_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Lu': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6544,"['mp-1000584', 'mp-1007055', 'mp-6544', 'mp-1441469', 'mp-1702891', 'mp-1783160', 'mp-1011794', 'mp-1588498']",0.0023161,"{'Lu': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",63.34823894903922,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",3.656139520884231e-05,0.0023161,0,0.0023161,MP,data/source/MP/cleaned/cifs/MP-mp-6544.cif,True,,data/final/MP/graphs/B2C1Gd0.12Lu0.88Ni2-MP-mp-6544-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Nb5Si3,1,0.0,2.0,False,Nb10Si6,Nb10Si6,0.345,Other,True,Nb62.5Si37.5,Nb-Si,2,Supercon,Nb5Si3,MP-mp-13686,Nb10Si6,Nb-Si,Nb62.5Si37.5,I 4/m c m,tetragonal,6.615034000079805,7.590299149999999,6.615034000079805,data/final/MP/cifs/Nb5Si3-MP-mp-13686.cif,data/source/MP/raw/cifs/mp-13686.cif,mp-13686,0.0,,2011-06-04 21:52:44,6.967600937206338,10.17188/1189719,"@misc{osti_1189719,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb5Si3 (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189719"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702050'}},0.0,7.04955697,520.0,-144.43245307,-9.027028316875,"{'tags': ['Niobium silicide (5/3) - alpha', 'Niobium silicide (5/3)', 'Niobium silicide (20/12)']}",-144.43245307,-9.027028316875,-0.6525949093750008,"['xas', 'elasticity', 'bandstructure']",True,"[423763, 645429, 16774, 645441, 601660]",True,2021-05-12 10:56:12.755000,NM,16,13,mp-13686,,Nb5Si3,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Si'], 'pot_type': 'paw'}","{'Nb': 5.0, 'Si': 3.0}",GGA,mp-13686,"['mp-909419', 'mp-924408', 'mp-925145', 'mp-13686', 'mp-1105679', 'mp-1105924', 'mp-1125229', 'mp-1146005', 'mp-1190280', 'mp-1428118', 'mp-1702050', 'mp-1775233', 'mp-1598009']",6.785e-05,"{'Nb': 10.0, 'Si': 6.0}",261.5777182733681,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.187750734111972e-07,6.785e-05,0,0.0001357,MP,data/source/MP/cleaned/cifs/MP-mp-13686.cif,False,,data/final/MP/graphs/Nb5Si3-MP-mp-13686.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ge0.27Nb3Sn0.73,3,0.135,2.0,False,Ge0.54Nb6Sn1.46,Nb6Sn2,8.2,Other,True,Ge6.75Nb75Sn18.25,Ge-Nb-Sn,3,Supercon,Nb3Sn0.73Ge0.27,MP-mp-1326,Nb6Sn2,Nb-Sn,Nb75Sn25,P m -3 n,cubic,5.334611,5.334611,5.334611,data/final/MP/cifs/Ge0.27Nb3Sn0.73-MP-mp-1326-synth_doped.cif,data/source/MP/raw/cifs/mp-1326.cif,mp-1326,0.0,,2011-05-14 09:51:48,8.694218121896231,10.17188/1189484,"@misc{osti_1189484,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Sn (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189484"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668415'}},0.0,6.59372491,520.0,-69.93787048,-8.74223381,{'tags': ['Niobium tin (3/1)']},-69.93787048,-8.74223381,-0.163862066250001,"['xas', 'elasticity', 'bandstructure']",True,"[105230, 645503, 645489, 105231, 645498, 645485, 645474, 645496, 645480, 645488, 645482, 645487, 645500, 645493, 645477, 645484, 645502, 645483, 150878, 645479, 645481, 645486, 645473]",True,2021-05-12 10:56:12.755000,NM,8,9,mp-1326,,Nb3Sn,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Sn_d'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Sn': 1.0}",GGA,mp-1326,"['mp-930046', 'mp-913770', 'mp-930577', 'mp-1326', 'mp-1440651', 'mp-1668415', 'mp-1880085', 'mp-1594093', 'mp-1594507']",0.62023085,"{'Nb': 6.0, 'Sn': 2.0}",151.81275738025872,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0081709977567491,0.62023085,0,1.2404617,MP,data/source/MP/cleaned/cifs/MP-mp-1326.cif,True,,data/final/MP/graphs/Ge0.27Nb3Sn0.73-MP-mp-1326-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Cr0.004Fe1.996K0.8Se2,3,0.0666666666666666,1.0,True,Cr0.004Fe1.996K0.8Se2,Fe2K1Se2,20.0,Ferrite,True,Cr0.083Fe41.583K16.667Se41.667,Cr-Fe-K-Se,4,Supercon,K0.8Fe1.996Cr0.004Se2,MP-mp-1070735,K1Fe2Se2,Fe-K-Se,Fe40K20Se40,I 4/m m m,tetragonal,3.783558000712664,3.783558000712664,7.91886339,data/final/MP/cifs/Cr0.004Fe1.996K0.8Se2-MP-mp-1070735-synth_doped.cif,data/source/MP/raw/cifs/mp-1070735.cif,mp-1070735,0.0,,2018-03-22 03:52:22,4.804538531009527,,,{'GGA': {'task_id': 'mp-1761650'}},0.0327827750000011,3.42423866,520.0,-27.50456218,-5.500912436,{'tags': ['Potassium iron selenide (1/2/2)']},-27.50456218,-5.500912436,-0.6812646755374999,['bandstructure'],True,[186573],True,2021-05-12 10:58:14.654000,FM,5,8,mp-1070735,,K(FeSe)2,"{'functional': 'PBE', 'labels': ['K_sv', 'Fe_pv', 'Se'], 'pot_type': 'paw'}","{'K': 1.0, 'Fe': 2.0, 'Se': 2.0}",GGA,mp-1070735,"['mp-1070735', 'mp-1070765', 'mp-1070841', 'mp-1416829', 'mp-1761650', 'mp-1797161', 'mp-1585994', 'mp-1070830']",6.0503851,"{'K': 1.0, 'Fe': 2.0, 'Se': 2.0}",106.69540665041993,[],FM,True,139,1,"[0.0, 2.8, 2.8, 0.0, 0.0]",0.0567070813069176,6.0503851,2,6.0503851,MP,data/source/MP/cleaned/cifs/MP-mp-1070735.cif,True,,data/final/MP/graphs/Cr0.004Fe1.996K0.8Se2-MP-mp-1070735-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Rh4Sn13Th3,1,0.0,2.0,False,Rh8Sn26Th6,Rh8Sn26Th6,1.9,Other,True,Rh20Sn65Th15,Rh-Sn-Th,3,Supercon,Th3Rh4Sn13,MP-mp-30516,Th6Sn26Rh8,Rh-Sn-Th,Rh20Sn65Th15,P m -3 n,cubic,9.816188,9.816188,9.816188,data/final/MP/cifs/Rh4Sn13Th3-MP-mp-30516.cif,data/source/MP/raw/cifs/mp-30516.cif,mp-30516,0.0,,2014-02-18 14:50:17,9.307963638899992,10.17188/1204916,"@misc{osti_1204916,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Th3Sn13Rh4 (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1204916"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-941160'}},0.0,8.90747503,520.0,-228.59896658,-5.7149741645,"{'tags': ['Thorium rhodium tin (3/4/13)', 'Thorium rhodium stannide (3/4/13)']}",-228.59896658,-5.7149741645,-0.5238121472499998,"['xas', 'bandstructure']",True,"[102356, 650397, 650396]",True,2021-05-12 10:57:04.957000,NM,40,7,mp-30516,,Th3Sn13Rh4,"{'functional': 'PBE', 'labels': ['Th', 'Sn_d', 'Rh_pv'], 'pot_type': 'paw'}","{'Th': 3.0, 'Sn': 13.0, 'Rh': 4.0}",GGA,mp-30516,"['mp-934663', 'mp-941531', 'mp-941160', 'mp-30516', 'mp-1197666', 'mp-1201521', 'mp-1377119']",0.00197815,"{'Th': 6.0, 'Sn': 26.0, 'Rh': 8.0}",945.8637951116008,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.182737536257219e-06,0.00197815,0,0.0039563,MP,data/source/MP/cleaned/cifs/MP-mp-30516.cif,False,,data/final/MP/graphs/Rh4Sn13Th3-MP-mp-30516.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
B2Lu1Ru1,1,0.0,4.0,False,B8Lu4Ru4,B8Lu4Ru4,10.054,Other,True,B50Lu25Ru25,B-Lu-Ru,3,Supercon,Lu1Ru1B2,MP-mp-29239,Lu4B8Ru4,B-Lu-Ru,B50Lu25Ru25,P n m a,orthorhombic,5.262881,5.829858,6.288542,data/final/MP/cifs/B2Lu1Ru1-MP-mp-29239.cif,data/source/MP/raw/cifs/mp-29239.cif,mp-29239,0.0,,2014-02-24 06:45:28,10.246997128776938,10.17188/1203618,"@misc{osti_1203618,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LuB2Ru (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1203618"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677301'}},0.0,6.02142224,520.0,-119.30016105,-7.456260065625,"{'tags': ['Lutetium ruthenium(III) boride', 'Lutetium ruthenium boride (1/1/2)']}",-119.30016105,-7.456260065625,-0.6677291364583331,"['xas', 'bandstructure']",True,"[614715, 100774]",True,2021-05-12 10:57:03.017000,NM,16,8,mp-29239,,LuB2Ru,"{'functional': 'PBE', 'labels': ['Lu_3', 'B', 'Ru_pv'], 'pot_type': 'paw'}","{'Lu': 1.0, 'B': 2.0, 'Ru': 1.0}",GGA,mp-29239,"['mp-909473', 'mp-925177', 'mp-924466', 'mp-29239', 'mp-1381674', 'mp-1677301', 'mp-1784701', 'mp-1603819']",4.565e-05,"{'Lu': 4.0, 'B': 8.0, 'Ru': 4.0}",192.9440954509509,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",9.4638812124945e-07,4.565e-05,0,0.0001826,MP,data/source/MP/cleaned/cifs/MP-mp-29239.cif,False,,data/final/MP/graphs/B2Lu1Ru1-MP-mp-29239.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Co1Na0.35O2,3,0.0767590618336886,2.0,False,Co2Na0.7O4,Co2Na1O4,0.0,Oxide,True,Co29.851Na10.448O59.701492537313435,Co-Na-O,3,Supercon,Na0.35Co1O2,MP-mp-1221448,Na1Co2O4,Co-Na-O,Co28.571Na14.286O57.142857142857146,P 1,triclinic,2.9849854300000005,5.09287276,5.94013391,data/final/MP/cifs/Co1Na0.35O2-MP-mp-1221448-synth_doped.cif,data/source/MP/raw/cifs/mp-1221448.cif,mp-1221448,0.2873000000000001,,2019-01-12 22:08:20.814000,4.000981726770425,,,,0.1671404889285517,1.0776051,520.0,-38.30170286,-5.471671837142857,{'tags': []},-38.30170286,-5.471671837142857,-1.2849568509359608,[],False,[],True,2021-05-12 11:00:47.244000,FM,7,2,mp-1221448,oxide,Na(CoO2)2,"{'functional': 'PBE', 'labels': ['Na_pv', 'Co', 'O'], 'pot_type': 'paw'}","{'Na': 1.0, 'Co': 2.0, 'O': 4.0}",GGA+U,mp-1221448,"['mp-1221448', 'mp-1931840']",3.000056,"{'Na': 1.0, 'Co': 2.0, 'O': 4.0}",85.02105069569866,[],FM,True,1,6,"[0.0, 2.4, -0.0, 0.2, 0.0, 0.3, 0.0]",0.0352860376983294,3.000056,3,3.000056,MP,data/source/MP/cleaned/cifs/MP-mp-1221448.cif,True,,data/final/MP/graphs/Co1Na0.35O2-MP-mp-1221448-synth_doped.json,0,True,1,0,0,0,0,0,1,0,1,0,0,0,1.0,False
Bi1F1La0.25S2Sr0.75,3,0.1,2.0,False,Bi2F2La0.5S4Sr1.5,Bi2F2S4Sr2,0.0,Other,True,Bi20F20La5S40Sr15,Bi-F-La-S-Sr,5,Supercon,Sr0.75La0.25Bi1S2F1,MP-mp-1078631,Sr2Bi2S4F2,Bi-F-S-Sr,Bi20F20S40Sr20,P 4/n m m,tetragonal,4.065045,4.065045,14.253333,data/final/MP/cifs/Bi1F1La0.25S2Sr0.75-MP-mp-1078631-synth_doped.cif,data/source/MP/raw/cifs/mp-1078631.cif,mp-1078631,1.1263,,2018-04-12 08:40:38,5.3543343461732364,,,{'GGA': {'task_id': 'mp-1697653'}},0.0086549810833327,2.85728461,520.0,-49.28112103,-4.928112103,{'tags': ['Strontium bismuth fluorosulfide']},-49.28112103,-4.928112103,-2.0689308100833337,['bandstructure'],True,[250892],True,2021-05-12 10:58:16.596000,NM,10,5,mp-1078631,,SrBiS2F,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Bi', 'S', 'F'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Bi': 1.0, 'S': 2.0, 'F': 1.0}",GGA,mp-1078631,"['mp-1078631', 'mp-1413953', 'mp-1697653', 'mp-1776134', 'mp-1598033']",0.0001368,"{'Sr': 2.0, 'Bi': 2.0, 'S': 4.0, 'F': 2.0}",235.530496102666,[],NM,False,129,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.1616330136745426e-06,0.0001368,0,0.0002736,MP,data/source/MP/cleaned/cifs/MP-mp-1078631.cif,True,,data/final/MP/graphs/Bi1F1La0.25S2Sr0.75-MP-mp-1078631-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B1Mo1Re1,1,0.0,2.0,False,B2Mo2Re2,B2Mo2Re2,5.09,Other,True,B33.333Mo33.333Re33.333,B-Mo-Re,3,Supercon,B1Mo1Re1,MP-mp-1219525,Re2B2Mo2,B-Mo-Re,B33.333Mo33.333Re33.333,F m m m,orthorhombic,4.5385430200000005,4.53854302,4.596317785920274,data/final/MP/cifs/B1Mo1Re1-MP-mp-1219525.cif,data/source/MP/raw/cifs/mp-1219525.cif,mp-1219525,0.0,,2019-01-12 20:30:59.442000,13.500459203280675,,,,0.0512555283333355,8.69754097,520.0,-61.63994493,-10.273324155,{'tags': []},-61.63994493,-10.273324155,-0.283470159722223,[],False,[],True,2021-05-12 11:00:44.908000,NM,6,2,mp-1219525,,ReBMo,"{'functional': 'PBE', 'labels': ['Re_pv', 'B', 'Mo_pv'], 'pot_type': 'paw'}","{'Re': 1.0, 'B': 1.0, 'Mo': 1.0}",GGA,mp-1219525,"['mp-1219525', 'mp-1921991']",0.00021685,"{'Re': 2.0, 'B': 2.0, 'Mo': 2.0}",72.06691217655597,[],NM,False,69,0,"[0, 0, 0, 0, 0, 0]",6.018018351299456e-06,0.00021685,0,0.0004337,MP,data/source/MP/cleaned/cifs/MP-mp-1219525.cif,False,,data/final/MP/graphs/B1Mo1Re1-MP-mp-1219525.json,0,True,mmm,0,0,0,7,0,0,0,0,0,0,1,1.0,False
Rb1S8V6,1,0.0,1.0,True,Rb1S8V6,Rb1S8V6,0.65,Chevrel,True,Rb6.667S53.333V40,Rb-S-V,3,Supercon,Rb1V6S8,MP-mp-1219696,Rb1V6S8,Rb-S-V,Rb6.667S53.333V40,P -3,trigonal,3.24303704,9.2789596,9.28095236,data/final/MP/cifs/Rb1S8V6-MP-mp-1219696.cif,data/source/MP/raw/cifs/mp-1219696.cif,mp-1219696,0.0,,2019-01-12 20:39:37.898000,4.44530562995636,,,,0.0,6.75800566,520.0,-103.92044076,-6.928029384,{'tags': []},-103.92044076,-6.928029384,-1.2912580888333338,[],False,[],True,2021-05-12 11:00:44.908000,NM,15,2,mp-1219696,,Rb(V3S4)2,"{'functional': 'PBE', 'labels': ['Rb_sv', 'V_pv', 'S'], 'pot_type': 'paw'}","{'Rb': 1.0, 'V': 6.0, 'S': 8.0}",GGA,mp-1219696,"['mp-1219696', 'mp-1927129']",0.0022264,"{'Rb': 1.0, 'V': 6.0, 'S': 8.0}",241.92401982906367,[],NM,False,147,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",9.202889409547296e-06,0.0022264,0,0.0022264,MP,data/source/MP/cleaned/cifs/MP-mp-1219696.cif,False,,data/final/MP/graphs/Rb1S8V6-MP-mp-1219696.json,0,True,-3,0,0,0,0,0,0,2,1,0,0,0,1.0,False
Bi3Rh1,3,0.1,12.0,False,Bi36Rh12,Bi48Rh12,3.175,Other,True,Bi75Rh25,Bi-Rh,2,Supercon,Bi3Rh1,MP-mp-30467,Bi48Rh12,Bi-Rh,Bi80Rh20,I a -3 d,cubic,13.157196602916748,13.157196600000002,13.1571966,data/final/MP/cifs/Bi3Rh1-MP-mp-30467-synth_doped.cif,data/source/MP/raw/cifs/mp-30467.cif,mp-30467,0.0,,2014-02-18 02:19:11,10.669590685107751,10.17188/1204874,"@misc{osti_1204874,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Bi4Rh (SG:230) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1204874"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-941121'}},0.0,6.1029162,520.0,-283.61817085,-4.726969514166667,{'tags': ['Bismuth rhodium (4/1)']},-283.61817085,-4.726969514166667,-0.1420804921666672,"['xas', 'bandstructure']",True,[58854],True,2021-05-12 10:57:04.957000,NM,60,5,mp-30467,,Bi4Rh,"{'functional': 'PBE', 'labels': ['Bi', 'Rh_pv'], 'pot_type': 'paw'}","{'Bi': 4.0, 'Rh': 1.0}",GGA,mp-30467,"['mp-934600', 'mp-941121', 'mp-941501', 'mp-30467', 'mp-1325245']",0.0046802166666666,"{'Bi': 48.0, 'Rh': 12.0}",1753.348321234545,[],NM,False,230,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.20316273268825e-05,0.0046802166666666,0,0.0561626,MP,data/source/MP/cleaned/cifs/MP-mp-30467.cif,True,,data/final/MP/graphs/Bi3Rh1-MP-mp-30467-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,1,0,1.0,False
Al3Nb1,1,0.0,1.0,True,Al3Nb1,Al3Nb1,0.0,Other,True,Al75Nb25,Al-Nb,2,Supercon,Al3Nb1,MP-mp-1842,Nb1Al3,Al-Nb,Al75Nb25,I 4/m m m,tetragonal,3.85304400310499,3.8530440031049897,5.10691484,data/final/MP/cifs/Al3Nb1-MP-mp-1842.cif,data/source/MP/raw/cifs/mp-1842.cif,mp-1842,0.0,,2011-05-12 18:46:15,4.501843513933614,10.17188/1193097,"@misc{osti_1193097,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbAl3 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1193097"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686700'}},0.0,7.56201156,520.0,-23.05261714,-5.763154285,"{'tags': ['Niobium aluminide (1/3)', 'Aluminum niobium (3/1)', 'Aluminium niobium (3/1)']}",-23.05261714,-5.763154285,-0.4286461524999998,"['xas', 'elasticity', 'bandstructure']",True,"[608686, 608658, 608690, 186000, 608663, 107857, 608670, 608682, 58015, 608672]",True,2021-05-12 10:56:14.760000,NM,4,18,mp-1842,,NbAl3,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al'], 'pot_type': 'paw'}","{'Nb': 1.0, 'Al': 3.0}",GGA,mp-1842,"['mp-927912', 'mp-927464', 'mp-911575', 'mp-1842', 'mp-1064538', 'mp-1064560', 'mp-1064590', 'mp-1065093', 'mp-1065164', 'mp-1065129', 'mp-1252159', 'mp-1440788', 'mp-1686700', 'mp-1793429', 'mp-1595557', 'mp-1590116', 'mp-1064577', 'mp-1065151']",0.0011716,"{'Nb': 1.0, 'Al': 3.0}",64.12625614366692,[],NM,False,139,0,"[0, 0, 0, 0]",1.827020740732432e-05,0.0011716,0,0.0011716,MP,data/source/MP/cleaned/cifs/MP-mp-1842.cif,False,,data/final/MP/graphs/Al3Nb1-MP-mp-1842.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B2C1Er1Fe0.2Ni1.8,3,0.0666666666666666,1.0,True,B2C1Er1Fe0.2Ni1.8,B2C1Er1Ni2,0.0,Other,True,B33.333C16.667Er16.667Fe3.333Ni30,B-C-Er-Fe-Ni,5,Supercon,Er1Ni1.8Fe0.2B2C1,MP-mp-6098,Er1Ni2B2C1,B-C-Er-Ni,B33.333C16.667Er16.667Ni33.333,I 4/m m m,tetragonal,3.5122880026935177,3.5122880026935173,5.77805085,data/final/MP/cifs/B2C1Er1Fe0.2Ni1.8-MP-mp-6098-synth_doped.cif,data/source/MP/raw/cifs/mp-6098.cif,mp-6098,0.0,,2011-05-13 04:24:02,8.212015229638553,10.17188/1277667,"@misc{osti_1277667,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ErNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277667"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700042'}},0.0,6.72687579,520.0,-41.84324782,-6.973874636666667,{'tags': []},-41.84324782,-6.973874636666667,-0.5216152347222227,"['xas', 'elasticity', 'bandstructure']",True,"[246431, 79576, 56651]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-6098,,ErNi2B2C,"{'functional': 'PBE', 'labels': ['Er_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Er': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6098,"['mp-1006980', 'mp-1000513', 'mp-6098', 'mp-1441533', 'mp-1700042', 'mp-1793903', 'mp-1011723', 'mp-1589040']",0.0020747,"{'Er': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",64.35860973581151,[],NM,False,139,0,"[0.0, -0.0, -0.0, 0.0, 0.0, 0.0]",3.2236557136900987e-05,0.0020747,0,0.0020747,MP,data/source/MP/cleaned/cifs/MP-mp-6098.cif,True,,data/final/MP/graphs/B2C1Er1Fe0.2Ni1.8-MP-mp-6098-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Hf0.33W0.67,2,0.0066666666666667,6.0,False,Hf1.98W4.02,Hf2W4,0.0,Other,True,Hf33W67,Hf-W,2,Supercon,Hf0.33W0.67,MP-mp-1400,Hf2W4,Hf-W,Hf33.333W66.667,F d -3 m,cubic,5.39304968,5.39304968,5.39304968,data/final/MP/cifs/Hf0.33W0.67-MP-mp-1400-synth_doped.cif,data/source/MP/raw/cifs/mp-1400.cif,mp-1400,0.0,,2011-05-13 13:13:36,16.35379952578737,10.17188/1189871,"@misc{osti_1189871,
    author = ""Persson, Kristin"",
    title = ""Materials Data on HfW2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189871"",
    place = ""United States"",
    year = ""2015"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703110'}},0.0,5.64595398,520.0,-72.78108055,-12.130180091666666,"{'tags': ['Hafnium tungsten (1/2)', 'Hafnium tungsten (1/2) - HT']}",-72.78108055,-12.130180091666666,-0.172366161666666,"['xas', 'elasticity', 'bandstructure']",True,"[639005, 104289, 639010, 639012, 639011]",True,2021-05-12 10:56:12.755000,NM,6,8,mp-1400,,HfW2,"{'functional': 'PBE', 'labels': ['Hf_pv', 'W_pv'], 'pot_type': 'paw'}","{'Hf': 1.0, 'W': 2.0}",GGA,mp-1400,"['mp-941688', 'mp-934980', 'mp-941850', 'mp-1400', 'mp-1413029', 'mp-1703110', 'mp-1788056', 'mp-1593963']",0.00030585,"{'Hf': 2.0, 'W': 4.0}",110.91448449943704,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",5.515059667460336e-06,0.00030585,0,0.0006117,MP,data/source/MP/cleaned/cifs/MP-mp-1400.cif,True,,data/final/MP/graphs/Hf0.33W0.67-MP-mp-1400-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ce0.13Cu1Nd1.87O4,2,0.0371428571428571,1.0,True,Ce0.13Cu1Nd1.87O4,Cu1Nd2O4,0.0,Cuprate,True,Ce1.857Cu14.286Nd26.714O57.142857142857146,Ce-Cu-Nd-O,4,Supercon,Nd1.87Ce0.13Cu1O4,MP-mp-4158,Nd2Cu1O4,Cu-Nd-O,Cu14.286Nd28.571O57.142857142857146,I 4/m m m,tetragonal,3.973854000245551,3.973854000245551,6.78296857,data/final/MP/cifs/Ce0.13Cu1Nd1.87O4-MP-mp-4158-synth_doped.cif,data/source/MP/raw/cifs/mp-4158.cif,mp-4158,0.0,,2011-05-13 10:19:33,7.086167303782593,10.17188/1207899,"@misc{osti_1207899,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nd2CuO4 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207899"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-670050'}},0.0009497997619085,3.16510927,520.0,-51.48091453,-7.354416361428571,"{'tags': ['Dineodymium copper tetraoxide', 'Dineodymium copper oxide', 'Dineodymium cuprate', 'High pressure experimental phase']}",-51.48091453,-7.354416361428571,-2.971653917142857,"['xas', 'elasticity', 'bandstructure']",True,"[261376, 203228, 160629, 261375, 69479, 186590, 4203, 75830, 75825, 202885, 203229, 71181, 82067, 75828, 69886, 75826, 75829, 75824, 75827, 69482, 86752]",True,2021-05-12 10:56:20.740000,NM,7,11,mp-4158,oxide,Nd2CuO4,"{'functional': 'PBE', 'labels': ['Nd_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Nd': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-4158,"['mp-670050', 'mp-660368', 'mp-4158', 'mp-1078016', 'mp-1173374', 'mp-1440751', 'mp-1668619', 'mp-1797319', 'mp-1588086', 'mp-1590518', 'mp-688505']",0.0084899,"{'Nd': 2.0, 'Cu': 1.0, 'O': 4.0}",97.4899480873212,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",8.708487558528232e-05,0.0084899,0,0.0084899,MP,data/source/MP/cleaned/cifs/MP-mp-4158.cif,True,,data/final/MP/graphs/Ce0.13Cu1Nd1.87O4-MP-mp-4158-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ba1Bi0.1Pb0.9O3,2,0.0399999999999999,2.0,False,Ba2Bi0.2Pb1.8O6,Ba2Pb2O6,2.91,Oxide,True,Ba20Bi2Pb18O60,Ba-Bi-Pb-O,4,Supercon,Ba1Pb0.9Bi0.1O3,MP-mp-20461,Ba2Pb2O6,Ba-Pb-O,Ba20Pb20O60,C 1 2/m 1,monoclinic,6.13110795,6.15036645,6.15036645,data/final/MP/cifs/Ba1Bi0.1Pb0.9O3-MP-mp-20461-synth_doped.cif,data/source/MP/raw/cifs/mp-20461.cif,mp-20461,0.2051999999999996,,2014-02-21 12:57:54,7.877180851020856,10.17188/1195591,"@misc{osti_1195591,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BaPbO3 (SG:12) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195591"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688120'}},0.0,2.99844765,520.0,-57.91699323,-5.7916993230000005,"{'tags': ['Barium plumbate', 'Barium lead(IV) oxide']}",-57.91699323,-5.7916993230000005,-2.108799140000001,"['diel', 'xas', 'bandstructure']",True,"[67299, 51656]",True,2021-05-12 10:56:45.290000,NM,10,10,mp-20461,oxide,BaPbO3,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Pb_d', 'O'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Pb': 1.0, 'O': 3.0}",GGA,mp-20461,"['mp-919763', 'mp-918765', 'mp-905786', 'mp-551164', 'mp-20461', 'mp-1141988', 'mp-1439228', 'mp-1688120', 'mp-1833847', 'mp-1588870']",5.695e-05,"{'Ba': 2.0, 'Pb': 2.0, 'O': 6.0}",165.49154870311418,[],NM,False,12,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.882526684449154e-07,5.695e-05,0,0.0001139,MP,data/source/MP/cleaned/cifs/MP-mp-20461.cif,True,,data/final/MP/graphs/Ba1Bi0.1Pb0.9O3-MP-mp-20461-synth_doped.json,0,True,2/m,0,0,3,0,0,0,0,0,1,0,0,0.5,False
B2C1Gd0.75Ni2Y0.25,3,0.0833333333333333,1.0,True,B2C1Gd0.75Ni2Y0.25,B2C1Gd1Ni2,0.0,Other,True,B33.333C16.667Gd12.5Ni33.333Y4.167,B-C-Gd-Ni-Y,5,Supercon,Y0.25Gd0.75Ni2B2C1,MP-mp-20728,Gd1Ni2B2C1,B-C-Gd-Ni,B33.333C16.667Gd16.667Ni33.333,I 4/m m m,tetragonal,3.585321997303853,3.585321997303853,5.73680392,data/final/MP/cifs/B2C1Gd0.75Ni2Y0.25-MP-mp-20728-synth_doped.cif,data/source/MP/raw/cifs/mp-20728.cif,mp-20728,0.0,,2014-02-21 09:39:31,7.738100830211668,10.17188/1195889,"@misc{osti_1195889,
    author = ""Persson, Kristin"",
    title = ""Materials Data on GdNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195889"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671216'}},0.0,6.43293366,520.0,-51.21064634,-8.535107723333333,{'tags': []},-51.21064634,-8.535107723333333,-0.4981144163888882,"['xas', 'bandstructure']",True,[79563],True,2021-05-12 10:56:57.051000,FM,6,5,mp-20728,,GdNi2B2C,"{'functional': 'PBE', 'labels': ['Gd', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Gd': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-20728,"['mp-20728', 'mp-1300449', 'mp-1671216', 'mp-1879352', 'mp-1593615']",7.0502106,"{'Gd': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",66.15234913878038,[],FM,True,139,1,"[6.9, 0.0, 0.0, 0.0, 0.0, 0.0]",0.1065753626558208,7.0502106,1,7.0502106,MP,data/source/MP/cleaned/cifs/MP-mp-20728.cif,True,,data/final/MP/graphs/B2C1Gd0.75Ni2Y0.25-MP-mp-20728-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B2Lu0.8Ru1Tm0.2,3,0.0999999999999999,4.0,False,B8Lu3.2Ru4Tm0.8,B8Lu4Ru4,7.295,Other,True,B50Lu20Ru25Tm5,B-Lu-Ru-Tm,4,Supercon,Lu0.8Tm0.2Ru1B2,MP-mp-29239,Lu4B8Ru4,B-Lu-Ru,B50Lu25Ru25,P n m a,orthorhombic,5.262881,5.829858,6.288542,data/final/MP/cifs/B2Lu0.8Ru1Tm0.2-MP-mp-29239-synth_doped.cif,data/source/MP/raw/cifs/mp-29239.cif,mp-29239,0.0,,2014-02-24 06:45:28,10.246997128776938,10.17188/1203618,"@misc{osti_1203618,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LuB2Ru (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1203618"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677301'}},0.0,6.02142224,520.0,-119.30016105,-7.456260065625,"{'tags': ['Lutetium ruthenium(III) boride', 'Lutetium ruthenium boride (1/1/2)']}",-119.30016105,-7.456260065625,-0.6677291364583331,"['xas', 'bandstructure']",True,"[614715, 100774]",True,2021-05-12 10:57:03.017000,NM,16,8,mp-29239,,LuB2Ru,"{'functional': 'PBE', 'labels': ['Lu_3', 'B', 'Ru_pv'], 'pot_type': 'paw'}","{'Lu': 1.0, 'B': 2.0, 'Ru': 1.0}",GGA,mp-29239,"['mp-909473', 'mp-925177', 'mp-924466', 'mp-29239', 'mp-1381674', 'mp-1677301', 'mp-1784701', 'mp-1603819']",4.565e-05,"{'Lu': 4.0, 'B': 8.0, 'Ru': 4.0}",192.9440954509509,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",9.4638812124945e-07,4.565e-05,0,0.0001826,MP,data/source/MP/cleaned/cifs/MP-mp-29239.cif,True,,data/final/MP/graphs/B2Lu0.8Ru1Tm0.2-MP-mp-29239-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ag0.02Ge2Pd1.98Sr1,2,0.008,1.0,True,Ag0.02Ge2Pd1.98Sr1,Ge2Pd2Sr1,2.64,Other,True,Ag0.4Ge40Pd39.6Sr20,Ag-Ge-Pd-Sr,4,Supercon,Sr1Pd1.98Ag0.02Ge2,MP-mp-978986,Sr1Ge2Pd2,Ge-Pd-Sr,Ge40Pd40Sr20,I 4/m m m,tetragonal,4.438671999438209,4.438671999438209,6.03054834,data/final/MP/cifs/Ag0.02Ge2Pd1.98Sr1-MP-mp-978986-synth_doped.cif,data/source/MP/raw/cifs/mp-978986.cif,mp-978986,0.0,,2015-10-09 03:56:43,7.295677176868866,10.17188/1316057,"@misc{osti_1316057,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr(GePd)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1316057"",
    place = ""United States"",
    year = ""2016"",
    month = ""9"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688092'}},0.0,4.0155429,520.0,-24.8627221,-4.97254442,"{'tags': ['Strontium palladium germanide (1/2/2)', 'Strontium palladium germanium (1/2/2)', 'High pressure experimental phase']}",-24.8627221,-4.97254442,-0.7134818633333324,"['xas', 'elasticity', 'bandstructure']",True,"[165985, 181157, 181155, 181156, 168133]",True,2021-05-12 10:56:37.246000,NM,5,9,mp-978986,,Sr(GePd)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ge_d', 'Pd'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Ge': 2.0, 'Pd': 2.0}",GGA,mp-978986,"['mp-1005776', 'mp-978986', 'mp-1005866', 'mp-979737', 'mp-1438850', 'mp-1688092', 'mp-1782349', 'mp-1011093', 'mp-1589601']",0.0012593,"{'Sr': 1.0, 'Ge': 2.0, 'Pd': 2.0}",101.45304755163892,[],NM,False,139,0,"[0, 0, 0, 0, 0]",1.2412638460752248e-05,0.0012593,0,0.0012593,MP,data/source/MP/cleaned/cifs/MP-mp-978986.cif,True,,data/final/MP/graphs/Ag0.02Ge2Pd1.98Sr1-MP-mp-978986-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
La7Pd3,1,0.0,2.0,False,La14Pd6,La14Pd6,1.48,Other,True,La70Pd30,La-Pd,2,Supercon,La7Pd3,MP-mp-1105925,La14Pd6,La-Pd,La70Pd30,P 63 m c,hexagonal,6.630586,10.388519997848253,10.3885198,data/final/MP/cifs/La7Pd3-MP-mp-1105925.cif,data/source/MP/raw/cifs/mp-1105925.cif,mp-1105925,0.0,,2018-07-19 06:55:11,6.921761979821336,,,{'GGA': {'task_id': 'mp-1731104'}},0.0,7.45007579,520.0,-110.60123548,-5.530061774,"{'tags': ['Lanthanum palladium (7/3)', 'Th7Fe3', 'La7Pd3']}",-110.60123548,-5.530061774,-0.5208922575000002,['bandstructure'],True,[641661],True,2021-05-12 10:58:22.271000,NM,20,5,mp-1105925,,La7Pd3,"{'functional': 'PBE', 'labels': ['La', 'Pd'], 'pot_type': 'paw'}","{'La': 7.0, 'Pd': 3.0}",GGA,mp-1105925,"['mp-1105925', 'mp-1402027', 'mp-1731104', 'mp-1874762', 'mp-1618199']",0.00013145,"{'La': 14.0, 'Pd': 6.0}",619.711982339536,[],NM,False,186,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.242293315154246e-07,0.00013145,0,0.0002629,MP,data/source/MP/cleaned/cifs/MP-mp-1105925.cif,False,,data/final/MP/graphs/La7Pd3-MP-mp-1105925.json,0,True,6mm,0,5,0,0,0,0,0,1,0,0,0,1.0,False
Ir1Y4,3,0.1,3.0,False,Ir3Y12,Ir4Y12,0.0,Other,True,Ir20Y80,Ir-Y,2,Supercon,Ir1Y4,MP-mp-1207785,Y12Ir4,Ir-Y,Ir25Y75,P n m a,orthorhombic,6.431889,7.286326,9.272045,data/final/MP/cifs/Ir1Y4-MP-mp-1207785-synth_doped.cif,data/source/MP/raw/cifs/mp-1207785.cif,mp-1207785,0.0,,2019-01-12 10:49:36.626000,7.0151534119589725,,,{'GGA': {'task_id': 'mp-1672734'}},0.0,4.12558155,520.0,-122.05250967,-7.628281854375,"{'tags': ['Yttrium iridium (3/1)', 'Y3Ir', 'Fe3C']}",-122.05250967,-7.628281854375,-0.5688209143750012,['bandstructure'],True,[641173],True,2021-05-12 10:58:39.488000,NM,16,5,mp-1207785,,Y3Ir,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ir'], 'pot_type': 'paw'}","{'Y': 3.0, 'Ir': 1.0}",GGA,mp-1207785,"['mp-1207785', 'mp-1416573', 'mp-1672734', 'mp-1817806', 'mp-1607473']",5.8175e-05,"{'Y': 12.0, 'Ir': 4.0}",434.53290585967767,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.355175565809625e-07,5.8175e-05,0,0.0002327,MP,data/source/MP/cleaned/cifs/MP-mp-1207785.cif,True,,data/final/MP/graphs/Ir1Y4-MP-mp-1207785-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
C1Fe0.001Mg1Ni2.999,2,0.0003999999999999,1.0,True,C1Fe0.001Mg1Ni2.999,C1Mg1Ni3,6.93,Other,True,C20Fe0.02Mg20Ni59.98,C-Fe-Mg-Ni,4,Supercon,Mg1C1Ni2.999Fe0.001,MP-mp-10700,Mg1Ni3C1,C-Mg-Ni,C20Mg20Ni60,P m -3 m,cubic,3.810209,3.810209,3.810209,data/final/MP/cifs/C1Fe0.001Mg1Ni2.999-MP-mp-10700-synth_doped.cif,data/source/MP/raw/cifs/mp-10700.cif,mp-10700,0.0,,2011-05-28 10:04:44,6.376007671789427,10.17188/1187303,"@misc{osti_1187303,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MgNi3C (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187303"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678621'}},0.0,6.64260176,520.0,-28.85099542,-5.770199084,{'tags': ['Magnesium nickel carbide (1/3/1)']},-28.85099542,-5.770199084,-0.1367049259999994,"['xas', 'elasticity', 'bandstructure']",True,[77152],True,2021-05-12 10:56:10.715000,NM,5,8,mp-10700,,MgNi3C,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Ni_pv', 'C'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",GGA,mp-10700,"['mp-927245', 'mp-927653', 'mp-911184', 'mp-10700', 'mp-1438083', 'mp-1678621', 'mp-1791467', 'mp-1591421']",0.0387875,"{'Mg': 1.0, 'Ni': 3.0, 'C': 1.0}",55.31544309398296,[],NM,False,221,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",0.0007012056277683,0.0387875,0,0.0387875,MP,data/source/MP/cleaned/cifs/MP-mp-10700.cif,True,,data/final/MP/graphs/C1Fe0.001Mg1Ni2.999-MP-mp-10700-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Nb2.7Sn1Zr0.3,3,0.1499999999999999,2.0,False,Nb5.4Sn2Zr0.6,Nb6Sn2,18.1,Other,True,Nb67.5Sn25Zr7.5,Nb-Sn-Zr,3,Supercon,Nb2.7Zr0.3Sn1,MP-mp-1326,Nb6Sn2,Nb-Sn,Nb75Sn25,P m -3 n,cubic,5.334611,5.334611,5.334611,data/final/MP/cifs/Nb2.7Sn1Zr0.3-MP-mp-1326-synth_doped.cif,data/source/MP/raw/cifs/mp-1326.cif,mp-1326,0.0,,2011-05-14 09:51:48,8.694218121896231,10.17188/1189484,"@misc{osti_1189484,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Sn (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189484"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668415'}},0.0,6.59372491,520.0,-69.93787048,-8.74223381,{'tags': ['Niobium tin (3/1)']},-69.93787048,-8.74223381,-0.163862066250001,"['xas', 'elasticity', 'bandstructure']",True,"[105230, 645503, 645489, 105231, 645498, 645485, 645474, 645496, 645480, 645488, 645482, 645487, 645500, 645493, 645477, 645484, 645502, 645483, 150878, 645479, 645481, 645486, 645473]",True,2021-05-12 10:56:12.755000,NM,8,9,mp-1326,,Nb3Sn,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Sn_d'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Sn': 1.0}",GGA,mp-1326,"['mp-930046', 'mp-913770', 'mp-930577', 'mp-1326', 'mp-1440651', 'mp-1668415', 'mp-1880085', 'mp-1594093', 'mp-1594507']",0.62023085,"{'Nb': 6.0, 'Sn': 2.0}",151.81275738025872,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0081709977567491,0.62023085,0,1.2404617,MP,data/source/MP/cleaned/cifs/MP-mp-1326.cif,True,,data/final/MP/graphs/Nb2.7Sn1Zr0.3-MP-mp-1326-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
C1Hf0.15Mo0.85,3,0.15,1.0,True,C1Hf0.15Mo0.85,C1Mo1,9.0,Other,True,C50Hf7.5Mo42.5,C-Hf-Mo,3,Supercon,C1Hf0.15Mo0.85,MP-mp-2305,Mo1C1,C-Mo,C50Mo50,P -6 m 2,hexagonal,2.835086,2.92410600478411,2.92410507,data/final/MP/cifs/C1Hf0.15Mo0.85-MP-mp-2305-synth_doped.cif,data/source/MP/raw/cifs/mp-2305.cif,mp-2305,0.0,,2011-05-12 17:49:42,8.538697979393088,10.17188/1199194,"@misc{osti_1199194,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MoC (SG:187) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199194"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668222'}},0.0010243049999996,8.62658168,520.0,-20.24014809,-10.120074045,{'tags': ['Molybdenum carbide (1/1)']},-20.24014809,-10.120074045,-0.0838621800000005,"['xas', 'elasticity', 'bandstructure']",True,"[77156, 618300]",True,2021-05-12 10:56:16.728000,NM,2,9,mp-2305,,MoC,"{'functional': 'PBE', 'labels': ['Mo_pv', 'C'], 'pot_type': 'paw'}","{'Mo': 1.0, 'C': 1.0}",GGA,mp-2305,"['mp-927633', 'mp-927239', 'mp-911174', 'mp-2305', 'mp-1116092', 'mp-1440368', 'mp-1668222', 'mp-1791400', 'mp-1638434']",0.0001977,"{'Mo': 1.0, 'C': 1.0}",20.99340614335182,[],NM,False,187,0,"[0, 0]",9.417242664197564e-06,0.0001977,0,0.0001977,MP,data/source/MP/cleaned/cifs/MP-mp-2305.cif,True,,data/final/MP/graphs/C1Hf0.15Mo0.85-MP-mp-2305-synth_doped.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Cu2Ho1Ru1Sr2O8,1,0.0,1.0,True,Cu2Ho1Ru1Sr2O8,Cu2Ho1Ru1Sr2O8,0.0,Cuprate,True,Cu14.286Ho7.143Ru7.143Sr14.286O57.142857142857146,Cu-Ho-Ru-Sr-O,5,Supercon,Ru1Sr2Ho1Cu2O8,MP-mp-1218811,Sr2Ho1Cu2Ru1O8,Cu-Ho-Ru-Sr-O,Cu14.286Ho7.143Ru7.143Sr14.286O57.142857142857146,A m m 2,orthorhombic,3.83601705,3.83601705,11.869725,data/final/MP/cifs/Cu2Ho1Ru1Sr2O8-MP-mp-1218811.cif,data/source/MP/raw/cifs/mp-1218811.cif,mp-1218811,0.0,,2019-01-12 19:55:07.184000,6.620051537945952,,,{'GGA': {'task_id': 'mp-1738714'}},0.0560648560714289,4.0958192,520.0,-91.19911425,-6.514222446428571,{'tags': []},-91.19911425,-6.514222446428571,-2.2626591027380942,[],False,[],True,2021-05-12 11:00:42.526000,NM,14,4,mp-1218811,oxide,Sr2HoCu2RuO8,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ho_3', 'Cu_pv', 'Ru_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ho': 1.0, 'Cu': 2.0, 'Ru': 1.0, 'O': 8.0}",GGA,mp-1218811,"['mp-1218811', 'mp-1396251', 'mp-1738714', 'mp-1828511']",0.0144784,"{'Sr': 2.0, 'Ho': 1.0, 'Cu': 2.0, 'Ru': 1.0, 'O': 8.0}",174.6631492943723,[],NM,False,38,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",8.289327232728707e-05,0.0144784,0,0.0144784,MP,data/source/MP/cleaned/cifs/MP-mp-1218811.cif,False,,data/final/MP/graphs/Cu2Ho1Ru1Sr2O8-MP-mp-1218811.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Bi2Ca1Cu2Sr2O8.212,2,0.0130072749583661,1.948373648319532,False,Bi3.897Ca1.948Cu3.897Sr3.897O16,Bi4Ca2Cu4Sr4O16,73.0,Cuprate,True,Bi13.148Ca6.574Cu13.148Sr13.148O53.98369708125164,Bi-Ca-Cu-Sr-O,5,Supercon,Bi2Sr2Ca1Cu2O8.212,MP-mp-1218930,Sr4Ca2Cu4Bi4O16,Bi-Ca-Cu-Sr-O,Bi13.333Ca6.667Cu13.333Sr13.333O53.333333333333336,C c c 2,orthorhombic,5.417115,5.472898000129128,16.11398919,data/final/MP/cifs/Bi2Ca1Cu2Sr2O8.212-MP-mp-1218930-synth_doped.cif,data/source/MP/raw/cifs/mp-1218930.cif,mp-1218930,0.0,,2019-01-12 20:01:06.544000,6.266668983881059,,,,0.039252223722225,4.51768334,520.0,-173.15021002,-5.771673667333333,{'tags': []},-173.15021002,-5.771673667333333,-2.074956548222222,[],False,[],True,2021-05-12 11:00:42.526000,NM,30,3,mp-1218930,oxide,Sr2CaCu2(BiO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",GGA,mp-1218930,"['mp-1218930', 'mp-1359698', 'mp-1817714']",0.00011165,"{'Sr': 4.0, 'Ca': 2.0, 'Cu': 4.0, 'Bi': 4.0, 'O': 16.0}",470.7976286073367,[],NM,False,37,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.743014544498498e-07,0.00011165,0,0.0002233,MP,data/source/MP/cleaned/cifs/MP-mp-1218930.cif,True,,data/final/MP/graphs/Bi2Ca1Cu2Sr2O8.212-MP-mp-1218930-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Be5Pt1,1,0.0,1.0,True,Be5Pt1,Be5Pt1,2.3,Other,True,Be83.333Pt16.667,Be-Pt,2,Supercon,Be5Pt1,MP-mp-1072399,Be5Pt1,Be-Pt,Be83.333Pt16.667,F -4 3 m,cubic,4.22654977,4.22654977,4.22654977,data/final/MP/cifs/Be5Pt1-MP-mp-1072399.cif,data/source/MP/raw/cifs/mp-1072399.cif,mp-1072399,0.1513,,2018-03-22 09:16:18,7.469293422588032,,,{'GGA': {'task_id': 'mp-1704236'}},0.0,6.15917746,520.0,-27.53775217,-4.589625361666667,"{'tags': ['Friauf-Laves phase', 'Beryllium platinum (5/1)', 'Be5Au', 'Be5Pt']}",-27.53775217,-4.589625361666667,-0.4616300225000002,['bandstructure'],True,[616395],True,2021-05-12 10:58:14.654000,NM,6,8,mp-1072399,,Be5Pt,"{'functional': 'PBE', 'labels': ['Be_sv', 'Pt'], 'pot_type': 'paw'}","{'Be': 5.0, 'Pt': 1.0}",GGA,mp-1072399,"['mp-1072399', 'mp-1072410', 'mp-1072404', 'mp-1422081', 'mp-1704236', 'mp-1794953', 'mp-1591363', 'mp-1072412']",7.92e-05,"{'Be': 5.0, 'Pt': 1.0}",53.387915313945626,[],NM,False,216,0,"[0, 0, 0, 0, 0, 0]",1.4834817867352075e-06,7.92e-05,0,7.92e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1072399.cif,False,,data/final/MP/graphs/Be5Pt1-MP-mp-1072399.json,0,True,-43m,5,0,0,0,0,0,0,0,0,0,1,1.0,False
Mo4P3,3,0.1428571428571428,0.25,False,Mo1P0.75,Mo1P1,2.75,Other,True,Mo57.143P42.857,Mo-P,2,Supercon,Mo4P3,MP-mp-219,Mo1P1,Mo-P,Mo50P50,P -6 m 2,hexagonal,3.200517,3.244642004770467,3.24464166,data/final/MP/cifs/Mo4P3-MP-mp-219-synth_doped.cif,data/source/MP/raw/cifs/mp-219.cif,mp-219,0.0,,2011-05-12 17:49:56,7.222266928861905,10.17188/1197238,"@misc{osti_1197238,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MoP (SG:187) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197238"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688424'}},0.0,9.54140608,520.0,-17.57021422,-8.78510711,"{'tags': ['Molybdenum phosphide (1/1)', 'Molybdenum(III) phosphide', 'Molydenum phosphide (1/1)']}",-17.57021422,-8.78510711,-0.6556343416666675,"['xas', 'elasticity', 'bandstructure']",True,"[186874, 644086, 644084, 76367, 644091]",True,2021-05-12 10:56:16.728000,NM,2,13,mp-219,,MoP,"{'functional': 'PBE', 'labels': ['Mo_pv', 'P'], 'pot_type': 'paw'}","{'Mo': 1.0, 'P': 1.0}",GGA,mp-219,"['mp-1000839', 'mp-1007287', 'mp-219', 'mp-1057752', 'mp-1057775', 'mp-1057809', 'mp-1116060', 'mp-1476253', 'mp-1688424', 'mp-1871531', 'mp-1012028', 'mp-1596193', 'mp-1057788']",0.0040538,"{'Mo': 1.0, 'P': 1.0}",29.179932279709305,[],NM,False,187,0,"[0.0, 0.0]",0.0001389242429057,0.0040538,0,0.0040538,MP,data/source/MP/cleaned/cifs/MP-mp-219.cif,True,,data/final/MP/graphs/Mo4P3-MP-mp-219-synth_doped.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
B2Rh3Yb1,1,0.0,1.0,True,B2Rh3Yb1,B2Rh3Yb1,0.0,Heavy_fermion,True,B33.333Rh50Yb16.667,B-Rh-Yb,3,Supercon,Yb1Rh3B2,MP-mp-1025051,Yb1B2Rh3,B-Rh-Yb,B33.333Rh50Yb16.667,P 6/m m m,hexagonal,2.930684,5.571085998173345,5.57108513,data/final/MP/cifs/B2Rh3Yb1-MP-mp-1025051.cif,data/source/MP/raw/cifs/mp-1025051.cif,mp-1025051,0.0,,2016-09-27 21:03:07,10.611199987867485,10.17188/1355204,"@article{osti_1355204,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YbB2Rh3 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1355204"",
    place = ""United States"",
    year = ""2017"",
    month = ""5""
}
",{'GGA': {'task_id': 'mp-1696889'}},0.0,5.95958112,520.0,-41.24452663,-6.874087771666667,"{'tags': ['Ytterbium rhodium boride (1/3/2)', 'YbRh3B2', 'ErIr3B2']}",-41.24452663,-6.874087771666667,-0.7088685330555565,['bandstructure'],True,[615348],True,2021-05-12 10:58:09.072000,NM,6,5,mp-1025051,,YbB2Rh3,"{'functional': 'PBE', 'labels': ['Yb_2', 'B', 'Rh_pv'], 'pot_type': 'paw'}","{'Yb': 1.0, 'B': 2.0, 'Rh': 3.0}",GGA,mp-1025051,"['mp-1025051', 'mp-1430379', 'mp-1696889', 'mp-1801591', 'mp-1597018']",7.13e-05,"{'Yb': 1.0, 'B': 2.0, 'Rh': 3.0}",78.77334000793755,[],NM,False,191,0,"[0, 0, 0, 0, 0, 0]",9.051285624402304e-07,7.13e-05,0,7.13e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1025051.cif,False,,data/final/MP/graphs/B2Rh3Yb1-MP-mp-1025051.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Al0.06Nb3Sn0.94,2,0.03,2.0,False,Al0.12Nb6Sn1.88,Nb6Sn2,18.0,Other,True,Al1.5Nb75Sn23.5,Al-Nb-Sn,3,Supercon,Nb3Sn0.94Al0.06,MP-mp-1326,Nb6Sn2,Nb-Sn,Nb75Sn25,P m -3 n,cubic,5.334611,5.334611,5.334611,data/final/MP/cifs/Al0.06Nb3Sn0.94-MP-mp-1326-synth_doped.cif,data/source/MP/raw/cifs/mp-1326.cif,mp-1326,0.0,,2011-05-14 09:51:48,8.694218121896231,10.17188/1189484,"@misc{osti_1189484,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Sn (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189484"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668415'}},0.0,6.59372491,520.0,-69.93787048,-8.74223381,{'tags': ['Niobium tin (3/1)']},-69.93787048,-8.74223381,-0.163862066250001,"['xas', 'elasticity', 'bandstructure']",True,"[105230, 645503, 645489, 105231, 645498, 645485, 645474, 645496, 645480, 645488, 645482, 645487, 645500, 645493, 645477, 645484, 645502, 645483, 150878, 645479, 645481, 645486, 645473]",True,2021-05-12 10:56:12.755000,NM,8,9,mp-1326,,Nb3Sn,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Sn_d'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Sn': 1.0}",GGA,mp-1326,"['mp-930046', 'mp-913770', 'mp-930577', 'mp-1326', 'mp-1440651', 'mp-1668415', 'mp-1880085', 'mp-1594093', 'mp-1594507']",0.62023085,"{'Nb': 6.0, 'Sn': 2.0}",151.81275738025872,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0081709977567491,0.62023085,0,1.2404617,MP,data/source/MP/cleaned/cifs/MP-mp-1326.cif,True,,data/final/MP/graphs/Al0.06Nb3Sn0.94-MP-mp-1326-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
As1Fe0.875Ir0.125Sm1O1,3,0.0625,2.0,False,As2Fe1.75Ir0.25Sm2O2,As2Fe2Sm2O2,16.5,Ferrite,True,As25Fe21.875Ir3.125Sm25O25,As-Fe-Ir-Sm-O,5,Supercon,Sm1Fe0.875Ir0.125As1O1,MP-mp-20349,Sm2Fe2As2O2,As-Fe-Sm-O,As25Fe25Sm25O25,P 4/n m m,tetragonal,4.026492,4.026492,9.046755,data/final/MP/cifs/As1Fe0.875Ir0.125Sm1O1-MP-mp-20349-synth_doped.cif,data/source/MP/raw/cifs/mp-20349.cif,mp-20349,0.0,,2014-02-19 11:24:42,6.727802583283198,,,{'GGA+U': {'task_id': 'mp-1695938'}},0.3015723809374986,3.77685593,520.0,-52.73407138,-6.5917589225,{'tags': ['Samarium iron arsenic oxide (1/1/1/1)']},-52.73407138,-6.5917589225,-1.6285904237499995,"['xas', 'elasticity', 'bandstructure']",True,"[236652, 236653, 422002, 163457, 163458]",True,2021-05-12 10:56:16.728000,FM,8,10,mp-20349,oxide,SmFeAsO,"{'functional': 'PBE', 'labels': ['Sm_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Sm': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-20349,"['mp-24944', 'mp-1078897', 'mp-1079866', 'mp-1173321', 'mp-20349', 'mp-1425472', 'mp-1695938', 'mp-1772503', 'mp-1789694', 'mp-1588381']",3.75729895,"{'Sm': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",146.67176231613362,[],FM,True,129,1,"[0.0, 0.0, 3.5, 3.5, -0.0, -0.0, -0.0, -0.0]",0.0512341147425717,3.75729895,2,7.5145979,MP,data/source/MP/cleaned/cifs/MP-mp-20349.cif,True,,data/final/MP/graphs/As1Fe0.875Ir0.125Sm1O1-MP-mp-20349-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
C0.97Ta1,2,0.0152284263959391,1.0,True,C0.97Ta1,C1Ta1,11.84,Other,True,C49.239Ta50.761,C-Ta,2,Supercon,C0.97Ta1,MP-mp-1086,Ta1C1,C-Ta,C50Ta50,F m -3 m,cubic,3.16930633,3.1693063299999995,3.1693063299999995,data/final/MP/cifs/C0.97Ta1-MP-mp-1086-synth_doped.cif,data/source/MP/raw/cifs/mp-1086.cif,mp-1086,0.0,,2011-05-12 17:28:32,14.234280973849424,10.17188/1187404,"@misc{osti_1187404,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TaC (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187404"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686613'}},0.0,8.2505789,520.0,-22.23710222,-11.11855111,"{'tags': ['Tantalum carbide (1/1)', 'Tantalum(IV) carbide']}",-22.23710222,-11.11855111,-0.5762719450000002,"['xas', 'elasticity', 'bandstructure']",True,"[618845, 618833, 53974, 618820, 618830, 159875, 618843, 618846, 618823, 618841, 77406, 618844, 618825, 159878, 159877, 618828, 618831, 618848, 44497, 618838, 26956, 155163, 43525, 618839, 618835, 185979, 38239, 618829, 618837, 618832, 159879, 159876, 180601, 601144, 618847, 618818, 618836]",True,2021-05-12 10:56:10.715000,NM,2,14,mp-1086,,TaC,"{'functional': 'PBE', 'labels': ['Ta_pv', 'C'], 'pot_type': 'paw'}","{'Ta': 1.0, 'C': 1.0}",GGA,mp-1086,"['mp-992237', 'mp-990522', 'mp-1086', 'mp-1059363', 'mp-1059373', 'mp-1059393', 'mp-1237232', 'mp-1440573', 'mp-1686613', 'mp-1792077', 'mp-993854', 'mp-1596236', 'mp-1595188', 'mp-1059385']",0.0001919,"{'Ta': 1.0, 'C': 1.0}",22.51011209588414,[],NM,False,225,0,"[0, 0]",8.525057502271965e-06,0.0001919,0,0.0001919,MP,data/source/MP/cleaned/cifs/MP-mp-1086.cif,True,,data/final/MP/graphs/C0.97Ta1-MP-mp-1086-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Pb0.57Sn0.43,3,0.1399999999999999,2.0,False,Pb1.14Sn0.86,Pb1Sn1,7.45,Other,True,Pb57Sn43,Pb-Sn,2,Supercon,Pb0.57Sn0.43,MP-mp-972692,Sn1Pb1,Pb-Sn,Pb50Sn50,P -6 m 2,hexagonal,3.478459998819645,3.4784593699999995,5.717853,data/final/MP/cifs/Pb0.57Sn0.43-MP-mp-972692-synth_doped.cif,data/source/MP/raw/cifs/mp-972692.cif,mp-972692,0.0,,2015-09-16 02:30:24,9.032526482523004,10.17188/1313905,"@misc{osti_1313905,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SnPb (SG:187) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1313905"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1674576'}},0.0546233824999995,7.21913467,520.0,-7.61297216,-3.80648608,{'tags': []},-7.61297216,-3.80648608,0.0546233824999999,"['xas', 'elasticity', 'bandstructure']",True,[],True,2021-05-12 10:56:35.166000,NM,2,8,mp-972692,,SnPb,"{'functional': 'PBE', 'labels': ['Sn_d', 'Pb_d'], 'pot_type': 'paw'}","{'Sn': 1.0, 'Pb': 1.0}",GGA,mp-972692,"['mp-972778', 'mp-972762', 'mp-972692', 'mp-1435669', 'mp-1674576', 'mp-1782410', 'mp-972788', 'mp-1612286']",0.0060958,"{'Sn': 1.0, 'Pb': 1.0}",59.915272680655285,[],NM,False,187,0,"[0, 0]",0.0001017403364329,0.0060958,0,0.0060958,MP,data/source/MP/cleaned/cifs/MP-mp-972692.cif,True,,data/final/MP/graphs/Pb0.57Sn0.43-MP-mp-972692-synth_doped.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
La0.1Ru2Th0.9,3,0.0666666666666666,2.0,False,La0.2Ru4Th1.8,Ru4Th2,4.73,Other,True,La3.333Ru66.667Th30,La-Ru-Th,3,Supercon,Th0.9La0.1Ru2,MP-mp-574438,Th2Ru4,Ru-Th,Ru66.667Th33.333,F d -3 m,cubic,5.433971360000001,5.43397136,5.43397136,data/final/MP/cifs/La0.1Ru2Th0.9-MP-mp-574438-synth_doped.cif,data/source/MP/raw/cifs/mp-574438.cif,mp-574438,0.0,,2014-02-28 05:45:15,12.708957533514832,10.17188/1276579,"@misc{osti_1276579,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ThRu2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1276579"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-918592'}},0.0384871966666633,8.28589698,520.0,-53.8389712,-8.973161866666667,"{'tags': ['Ruthenium thorium (2/1)', 'Thorium ruthenium (1/2)']}",-53.8389712,-8.973161866666667,-0.3189493466666668,"['xas', 'elasticity', 'bandstructure']",True,"[650730, 150740, 106002, 650723, 650729, 650731, 106003]",True,2021-05-12 10:56:27.046000,NM,6,7,mp-574438,,ThRu2,"{'functional': 'PBE', 'labels': ['Th', 'Ru_pv'], 'pot_type': 'paw'}","{'Th': 1.0, 'Ru': 2.0}",GGA,mp-574438,"['mp-919588', 'mp-905408', 'mp-918592', 'mp-574438', 'mp-1439663', 'mp-1802924', 'mp-1592175']",0.00057545,"{'Th': 2.0, 'Ru': 4.0}",113.45850020968712,[],NM,False,166,0,"[0.0, 0.0, 0.0, 0.0, 0.0, -0.0]",1.0143797052428654e-05,0.00057545,0,0.0011509,MP,data/source/MP/cleaned/cifs/MP-mp-574438.cif,True,,data/final/MP/graphs/La0.1Ru2Th0.9-MP-mp-574438-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Cu1,1,0.0,4.0,False,Cu4,Cu4,0.0,Other,True,Cu100,Cu,1,Supercon,Cu1,MP-mp-989695,Cu4,Cu,Cu100,P 63/m m c,hexagonal,2.5576279953658547,2.55762815,8.343082,data/final/MP/cifs/Cu1-MP-mp-989695.cif,data/source/MP/raw/cifs/mp-989695.cif,mp-989695,0.0,,2015-12-16 13:02:51,8.930286104733547,10.17188/1282187,"@misc{osti_1282187,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Cu (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1282187"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1767134'}},0.0057660850000003,6.91547012,520.0,-16.37376234,-4.093440585,{'tags': []},-16.37376234,-4.093440585,0.0057660850000003,"['xas', 'elasticity', 'bandstructure', 'surfaces']",True,[],True,2021-05-12 10:56:37.246000,NM,4,8,mp-989695,,Cu,"{'functional': 'PBE', 'labels': ['Cu_pv'], 'pot_type': 'paw'}",{'Cu': 1.0},GGA,mp-989695,"['mp-989717', 'mp-989720', 'mp-989695', 'mp-1401204', 'mp-1767134', 'mp-1794252', 'mp-989726', 'mp-1611818']",5e-06,{'Cu': 4.0},47.26415897032988,[],NM,False,194,0,"[0, 0, 0, 0]",4.23153620750028e-07,5e-06,0,2e-05,MP,data/source/MP/cleaned/cifs/MP-mp-989695.cif,False,,data/final/MP/graphs/Cu1-MP-mp-989695.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ga9Ir2,1,0.0,2.0,False,Ga18Ir4,Ga18Ir4,2.225,Other,True,Ga81.818Ir18.182,Ga-Ir,2,Supercon,Ga9Ir2,MP-mp-31311,Ga18Ir4,Ga-Ir,Ga81.818Ir18.182,P 1 c 1,monoclinic,6.452535,6.513419000000001,8.92349534,data/final/MP/cifs/Ga9Ir2-MP-mp-31311.cif,data/source/MP/raw/cifs/mp-31311.cif,mp-31311,0.0,,2014-02-20 08:09:35,8.975272863617917,10.17188/1205582,"@misc{osti_1205582,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ga9Ir2 (SG:7) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1205582"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671640'}},0.0,4.78943609,520.0,-96.70005967,-4.395457257727273,{'tags': ['Gallium iridium (9/2)']},-96.70005967,-4.395457257727273,-0.3109367993181816,"['xas', 'bandstructure']",True,[414303],True,2021-05-12 10:57:04.957000,NM,22,8,mp-31311,,Ga9Ir2,"{'functional': 'PBE', 'labels': ['Ga_d', 'Ir'], 'pot_type': 'paw'}","{'Ga': 9.0, 'Ir': 2.0}",GGA,mp-31311,"['mp-930030', 'mp-913458', 'mp-31311', 'mp-930434', 'mp-1420455', 'mp-1671640', 'mp-1837212', 'mp-1606140']",0.00159255,"{'Ga': 18.0, 'Ir': 4.0}",374.44378329839816,[],NM,False,7,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",8.506216799603695e-06,0.00159255,0,0.0031851,MP,data/source/MP/cleaned/cifs/MP-mp-31311.cif,False,,data/final/MP/graphs/Ga9Ir2-MP-mp-31311.json,0,True,m,0,0,5,0,0,0,0,1,0,0,0,1.0,False
Li1Pb1,1,0.0,1.0,True,Li1Pb1,Li1Pb1,7.2,Other,True,Li50Pb50,Li-Pb,2,Supercon,Li1Pb1,MP-mp-2314,Li1Pb1,Li-Pb,Li50Pb50,P m -3 m,cubic,3.567851,3.567851,3.567851,data/final/MP/cifs/Li1Pb1-MP-mp-2314.cif,data/source/MP/raw/cifs/mp-2314.cif,mp-2314,0.0,,2011-05-12 18:04:49,7.8294056774664575,10.17188/1199260,"@misc{osti_1199260,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LiPb (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1199260"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686556'}},0.0,4.96953509,520.0,-6.16532746,-3.08266373,"{'tags': ['Lithium lead (1/1) - HT', 'Lithium lead (1/1)']}",-6.16532746,-3.08266373,-0.2718787616666667,['xas'],False,"[104762, 104763, 642249]",True,2021-05-12 10:56:59.077000,NM,2,6,mp-2314,,LiPb,"{'functional': 'PBE', 'labels': ['Li_sv', 'Pb_d'], 'pot_type': 'paw'}","{'Li': 1.0, 'Pb': 1.0}",GGA,mp-2314,"['mp-991586', 'mp-2314', 'mp-1142257', 'mp-1439978', 'mp-1686556', 'mp-1791084']",0.0009445,"{'Li': 1.0, 'Pb': 1.0}",45.4171760807082,[],NM,False,221,0,"[0, 0]",2.0796097016723023e-05,0.0009445,0,0.0009445,MP,data/source/MP/cleaned/cifs/MP-mp-2314.cif,False,,data/final/MP/graphs/Li1Pb1-MP-mp-2314.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ga1Nb0.3Ni2Zr0.7,3,0.15,1.0,True,Ga1Nb0.3Ni2Zr0.7,Ga1Ni2Zr1,2.3,Other,True,Ga25Nb7.5Ni50Zr17.5,Ga-Nb-Ni-Zr,4,Supercon,Ni2Zr0.7Nb0.3Ga1,MP-mp-22580,Zr1Ga1Ni2,Ga-Ni-Zr,Ga25Ni50Zr25,F m -3 m,cubic,4.32844951,4.328449509999999,4.328449509999999,data/final/MP/cifs/Ga1Nb0.3Ni2Zr0.7-MP-mp-22580-synth_doped.cif,data/source/MP/raw/cifs/mp-22580.cif,mp-22580,0.0,,2014-02-21 11:19:08,8.059961670929592,10.17188/1198801,"@misc{osti_1198801,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrGaNi2 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198801"",
    place = ""United States"",
    year = ""2016"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701292'}},0.0166428195026888,6.17074416,520.0,-25.25551084,-6.31387771,{'tags': ['Gallium nickel zirconium (1/2/1)']},-25.25551084,-6.31387771,-0.529860206875,"['xas', 'elasticity', 'bandstructure']",True,[103902],True,2021-05-12 10:56:16.728000,NM,4,8,mp-22580,,ZrGaNi2,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Ga_d', 'Ni_pv'], 'pot_type': 'paw'}","{'Zr': 1.0, 'Ga': 1.0, 'Ni': 2.0}",GGA,mp-22580,"['mp-993409', 'mp-991461', 'mp-22580', 'mp-1412922', 'mp-1701292', 'mp-1795292', 'mp-994723', 'mp-1588465']",0.0014644,"{'Zr': 1.0, 'Ga': 1.0, 'Ni': 2.0}",57.34321915229719,[],NM,False,225,0,"[0.0, 0.0, -0.0, -0.0]",2.553745711608407e-05,0.0014644,0,0.0014644,MP,data/source/MP/cleaned/cifs/MP-mp-22580.cif,True,,data/final/MP/graphs/Ga1Nb0.3Ni2Zr0.7-MP-mp-22580-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
As1Co0.08Fe0.92Na1,3,0.0533333333333333,2.0,False,As2Co0.16Fe1.84Na2,As2Fe2Na2,7.53,Ferrite,True,As33.333Co2.667Fe30.667Na33.333,As-Co-Fe-Na,4,Supercon,Na1Fe0.92Co0.08As1,MP-mp-22152,Na2Fe2As2,As-Fe-Na,As33.333Fe33.333Na33.333,P 4/n m m,tetragonal,3.923688,3.923688,6.918844,data/final/MP/cifs/As1Co0.08Fe0.92Na1-MP-mp-22152-synth_doped.cif,data/source/MP/raw/cifs/mp-22152.cif,mp-22152,0.0,,2014-02-21 10:51:39,4.793908463406792,10.17188/1197381,"@misc{osti_1197381,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NaFeAs (SG:129) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197381"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704688'}},0.0,4.10723066,520.0,-30.57538864,-5.095898106666667,{'tags': ['Sodium iron arsenide']},-30.57538864,-5.095898106666667,-0.2786807238505749,"['xas', 'elasticity', 'bandstructure']",True,"[163144, 163143]",True,2021-05-12 10:56:16.728000,FM,6,8,mp-22152,,NaFeAs,"{'functional': 'PBE', 'labels': ['Na_pv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Na': 1.0, 'Fe': 1.0, 'As': 1.0}",GGA,mp-22152,"['mp-906352', 'mp-920130', 'mp-919102', 'mp-22152', 'mp-1413190', 'mp-1704688', 'mp-1797758', 'mp-1594769']",0.0693226,"{'Na': 2.0, 'Fe': 2.0, 'As': 2.0}",106.5178694490858,[],FM,True,129,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.0]",0.0013016144682303,0.0693226,2,0.1386452,MP,data/source/MP/cleaned/cifs/MP-mp-22152.cif,True,,data/final/MP/graphs/As1Co0.08Fe0.92Na1-MP-mp-22152-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
As2Ba0.72Fe2K0.28,3,0.088,2.0,False,As4Ba1.44Fe4K0.56,As4Ba1Fe4K1,33.45,Ferrite,True,As40Ba14.4Fe40K5.6,As-Ba-Fe-K,4,Supercon,Ba0.72K0.28Fe2As2,MP-mp-1223517,K1Ba1Fe4As4,As-Ba-Fe-K,As40Ba10Fe40K10,C m m m,orthorhombic,5.479027,5.480024002658328,7.13170472,data/final/MP/cifs/As2Ba0.72Fe2K0.28-MP-mp-1223517-synth_doped.cif,data/source/MP/raw/cifs/mp-1223517.cif,mp-1223517,0.0,,2019-01-12 23:54:03.876000,5.87534599912672,,,{'GGA': {'task_id': 'mp-1743010'}},0.0132513644999994,4.21185628,520.0,-59.66633886,-5.966633886,{'tags': []},-59.66633886,-5.966633886,-0.4120461663000007,[],False,[],True,2021-05-12 11:00:52.054000,FM,10,4,mp-1223517,,KBa(FeAs)4,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",GGA,mp-1223517,"['mp-1223517', 'mp-1396881', 'mp-1743010', 'mp-1827585']",0.9947188,"{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",197.6961518155852,[],FM,True,65,1,"[0.0, 0.0, 0.3, 0.3, 0.3, 0.3, 0.0, 0.0, 0.0, 0.0]",0.0050315536790412,0.9947188,4,0.9947188,MP,data/source/MP/cleaned/cifs/MP-mp-1223517.cif,True,,data/final/MP/graphs/As2Ba0.72Fe2K0.28-MP-mp-1223517-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ba0.175Cu1La1.825O4,3,0.05,1.0,True,Ba0.175Cu1La1.825O4,Cu1La2O4,26.2,Cuprate,True,Ba2.5Cu14.286La26.071O57.142857142857146,Ba-Cu-La-O,4,Supercon,La1.825Ba0.175Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ba0.175Cu1La1.825O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ba0.175Cu1La1.825O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ag1Zn1,1,0.0,1.0,True,Ag1Zn1,Ag1Zn1,0.0,Other,True,Ag50Zn50,Ag-Zn,2,Supercon,Ag1Zn1,MP-mp-1912,Zn1Ag1,Ag-Zn,Ag50Zn50,P m -3 m,cubic,3.191211,3.191211,3.191211,data/final/MP/cifs/Ag1Zn1-MP-mp-1912.cif,data/source/MP/raw/cifs/mp-1912.cif,mp-1912,0.0,,2011-05-12 19:16:50,8.853682791786275,10.17188/1193942,"@misc{osti_1193942,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZnAg (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1193942"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687951'}},0.0049188081578948,3.43394796,520.0,-4.19151912,-2.09575956,"{'tags': ['Silver zinc (1/1) - beta', 'Silver zinc (1/1) - HP', 'Silver zinc (1/1)', 'High pressure experimental phase']}",-4.19151912,-2.09575956,-0.0496097533333332,"['xas', 'elasticity', 'bandstructure']",True,"[58384, 184206, 150570, 605988]",True,2021-05-12 10:56:14.760000,NM,2,13,mp-1912,,ZnAg,"{'functional': 'PBE', 'labels': ['Zn', 'Ag'], 'pot_type': 'paw'}","{'Zn': 1.0, 'Ag': 1.0}",GGA,mp-1912,"['mp-991026', 'mp-993008', 'mp-1912', 'mp-1060427', 'mp-1060473', 'mp-1060445', 'mp-1141889', 'mp-1442268', 'mp-1687951', 'mp-1791780', 'mp-994344', 'mp-1593557', 'mp-1060470']",0.0002065,"{'Zn': 1.0, 'Ag': 1.0}",32.49874280768193,[],NM,False,221,0,"[0, 0]",6.354091948171864e-06,0.0002065,0,0.0002065,MP,data/source/MP/cleaned/cifs/MP-mp-1912.cif,False,,data/final/MP/graphs/Ag1Zn1-MP-mp-1912.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
As1Fe1Tb1O0.8,3,0.0789473684210526,2.0,False,As2Fe2Tb2O1.6,As2Fe2Tb2O2,33.85,Ferrite,True,As26.316Fe26.316Tb26.316O21.05263157894737,As-Fe-Tb-O,4,Supercon,Tb1Fe1As1O0.8,MP-mp-1079887,Tb2Fe2As2O2,As-Fe-Tb-O,As25Fe25Tb25O25,P 4/n m m,tetragonal,3.971557,3.971557,9.096524,data/final/MP/cifs/As1Fe1Tb1O0.8-MP-mp-1079887-synth_doped.cif,data/source/MP/raw/cifs/mp-1079887.cif,mp-1079887,0.0,,2018-04-16 16:53:03,7.075630957925009,,,{'GGA+U': {'task_id': 'mp-1697746'}},0.2848640540625,4.29262424,520.0,-53.1200584,-6.6400073,{'tags': []},-53.1200584,-6.6400073,-1.69789381,['bandstructure'],True,[422004],True,2021-05-12 10:58:16.596000,FM,8,5,mp-1079887,oxide,TbFeAsO,"{'functional': 'PBE', 'labels': ['Tb_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Tb': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-1079887,"['mp-1079887', 'mp-1418181', 'mp-1697746', 'mp-1779163', 'mp-1589035']",3.7855201,"{'Tb': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",143.48188366951112,[],FM,True,129,1,"[0.0, 0.0, 3.6, 3.6, 0.0, 0.0, 0.0, 0.0]",0.0527665235942869,3.7855201,2,7.5710402,MP,data/source/MP/cleaned/cifs/MP-mp-1079887.cif,True,,data/final/MP/graphs/As1Fe1Tb1O0.8-MP-mp-1079887-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Bi2F0.2S2O0.8,3,0.0799999999999999,2.0,False,Bi4F0.4S4O1.6,Bi4S4O2,3.0,Oxide,True,Bi40F4S40O16,Bi-F-S-O,4,Supercon,Bi2F0.2S2O0.8,MP-mp-1078366,Bi4S4O2,Bi-S-O,Bi40S40O20,P 4/n m m,tetragonal,3.978733,3.978733,14.232676,data/final/MP/cifs/Bi2F0.2S2O0.8-MP-mp-1078366-synth_doped.cif,data/source/MP/raw/cifs/mp-1078366.cif,mp-1078366,1.1660999999999992,,2018-04-11 09:14:16,7.341941760049853,,,{'GGA': {'task_id': 'mp-1696674'}},0.0,4.62383276,700.0,-48.62854824,-4.862854824,{'tags': []},-48.62854824,-4.862854824,-1.0012689522500005,"['diel', 'bandstructure']",True,[196230],True,2021-05-12 10:56:43.348000,NM,10,7,mp-1078366,oxide,Bi2S2O,"{'functional': 'PBE', 'labels': ['Bi', 'S', 'O'], 'pot_type': 'paw'}","{'Bi': 2.0, 'S': 2.0, 'O': 1.0}",GGA,mp-1078366,"['mp-1078366', 'mp-1417642', 'mp-1540066', 'mp-1539562', 'mp-1696674', 'mp-1877541', 'mp-1608391']",9.01e-05,"{'Bi': 4.0, 'S': 4.0, 'O': 2.0}",225.30776266604192,[],NM,False,129,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",7.997949021716485e-07,9.01e-05,0,0.0001802,MP,data/source/MP/cleaned/cifs/MP-mp-1078366.cif,True,,data/final/MP/graphs/Bi2F0.2S2O0.8-MP-mp-1078366-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B4Er0.187Ho0.813Rh4,3,0.0415555555555555,2.0,False,B8Er0.374Ho1.626Rh8,B8Ho2Rh8,6.43,Other,True,B44.444Er2.078Ho9.033Rh44.444,B-Er-Ho-Rh,4,Supercon,Er0.187Ho0.813Rh4B4,MP-mp-1189784,Ho2B8Rh8,B-Ho-Rh,B44.444Ho11.111Rh44.444,P 42/n m c,tetragonal,5.334437,5.334437,7.442515,data/final/MP/cifs/B4Er0.187Ho0.813Rh4-MP-mp-1189784-synth_doped.cif,data/source/MP/raw/cifs/mp-1189784.cif,mp-1189784,0.0,,2019-01-11 20:27:24.618000,9.719214946416653,,,{'GGA': {'task_id': 'mp-1671459'}},0.0130335600000011,6.87149626,520.0,-131.93964083,-7.329980046111111,{'tags': ['Holmium rhodium boride (1/4/4)']},-131.93964083,-7.329980046111111,-0.5791792201851851,['bandstructure'],True,[601533],True,2021-05-12 10:58:33.577000,NM,18,5,mp-1189784,,Ho(BRh)4,"{'functional': 'PBE', 'labels': ['Ho_3', 'B', 'Rh_pv'], 'pot_type': 'paw'}","{'Ho': 1.0, 'B': 4.0, 'Rh': 4.0}",GGA,mp-1189784,"['mp-1189784', 'mp-1430146', 'mp-1671459', 'mp-1786743', 'mp-1604112']",0.00025395,"{'Ho': 2.0, 'B': 8.0, 'Rh': 8.0}",211.7858301043884,[],NM,False,137,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.39817744062319e-06,0.00025395,0,0.0005079,MP,data/source/MP/cleaned/cifs/MP-mp-1189784.cif,True,,data/final/MP/graphs/B4Er0.187Ho0.813Rh4-MP-mp-1189784-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Bi2S1,1,0.0,4.0,False,Bi8S4,Bi8S4,0.0,Other,True,Bi66.667S33.333,Bi-S,2,Supercon,Bi2S1,MP-mp-1103100,Bi8S4,Bi-S,Bi66.667S33.333,P 1 21/c 1,monoclinic,4.16836723,7.52570374,11.884725,data/final/MP/cifs/Bi2S1-MP-mp-1103100.cif,data/source/MP/raw/cifs/mp-1103100.cif,mp-1103100,0.0,,2018-07-18 16:59:41,8.29156998824427,,,,0.1679393075000002,5.20212004,520.0,-47.93190483,-3.9943254025,{'tags': ['Bis(oxobismuth) sulfate(VI) hydrate']},-47.93190483,-3.9943254025,-0.1898192402083337,[],False,[109278],True,2021-05-12 10:59:31.014000,NM,12,3,mp-1103100,,Bi2S,"{'functional': 'PBE', 'labels': ['Bi', 'S'], 'pot_type': 'paw'}","{'Bi': 2.0, 'S': 1.0}",GGA,mp-1103100,"['mp-1103100', 'mp-1837441', 'mp-1987078']",0.00258765,"{'Bi': 8.0, 'S': 4.0}",360.5037033697668,[],NM,False,14,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.8711494232233847e-05,0.00258765,0,0.0103506,MP,data/source/MP/cleaned/cifs/MP-mp-1103100.cif,False,,data/final/MP/graphs/Bi2S1-MP-mp-1103100.json,0,True,2/m,0,0,3,0,0,0,0,1,0,0,0,1.0,False
Ga1V2.883W0.117,3,0.0584999999999999,2.0,False,Ga2V5.766W0.234,Ga2V6,11.5,Other,True,Ga25V72.075W2.925,Ga-V-W,3,Supercon,V2.883W0.117Ga1,MP-mp-22568,V6Ga2,Ga-V,Ga25V75,P m -3 n,cubic,4.789645,4.789645,4.789645,data/final/MP/cifs/Ga1V2.883W0.117-MP-mp-22568-synth_doped.cif,data/source/MP/raw/cifs/mp-22568.cif,mp-22568,0.0,,2014-02-22 11:36:40,6.726541666276222,10.17188/1198793,"@misc{osti_1198793,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Ga (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198793"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686867'}},0.0,5.67452231,520.0,-61.95244347,-7.74405543375,{'tags': ['Gallium vanadium (1/3)']},-61.95244347,-7.74405543375,-0.1741018756249994,"['xas', 'elasticity', 'bandstructure']",True,"[635643, 635628, 635619, 635634, 104021, 635646, 635604, 635610, 635617, 635624, 635626, 635605, 635631, 635625, 635636, 635603, 104020, 635616, 635607]",True,2021-05-12 10:56:16.728000,FM,8,9,mp-22568,,V3Ga,"{'functional': 'PBE', 'labels': ['V_pv', 'Ga_d'], 'pot_type': 'paw'}","{'V': 3.0, 'Ga': 1.0}",GGA,mp-22568,"['mp-941343', 'mp-941663', 'mp-934924', 'mp-22568', 'mp-1440749', 'mp-1686867', 'mp-1804076', 'mp-1593784', 'mp-1595713']",0.09063635,"{'V': 6.0, 'Ga': 2.0}",109.87780534443452,[],FM,True,131,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.0, -0.0, -0.0]",0.0016497662965852,0.09063635,2,0.1812727,MP,data/source/MP/cleaned/cifs/MP-mp-22568.cif,True,,data/final/MP/graphs/Ga1V2.883W0.117-MP-mp-22568-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Pt0.2Rh0.8,3,0.1,4.0,False,Pt0.8Rh3.2,Pt1Rh3,0.0,Other,True,Pt20Rh80,Pt-Rh,2,Supercon,Pt0.2Rh0.8,MP-mp-974370,Pt1Rh3,Pt-Rh,Pt25Rh75,P m -3 m,cubic,3.884273,3.884273,3.884273,data/final/MP/cifs/Pt0.2Rh0.8-MP-mp-974370-synth_doped.cif,data/source/MP/raw/cifs/mp-974370.cif,mp-974370,0.0,,2015-09-16 23:09:39,14.275076805940124,10.17188/1314466,"@misc{osti_1314466,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Rh3Pt (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1314466"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1767501'}},0.0047081408333333,6.95786702,520.0,-28.14983058,-7.037457645,{'tags': []},-28.14983058,-7.037457645,0.003500185,"['xas', 'elasticity', 'bandstructure']",True,[],True,2021-05-12 10:56:35.166000,NM,4,8,mp-974370,,PtRh3,"{'functional': 'PBE', 'labels': ['Pt', 'Rh_pv'], 'pot_type': 'paw'}","{'Pt': 1.0, 'Rh': 3.0}",GGA,mp-974370,"['mp-974370', 'mp-974484', 'mp-974472', 'mp-1426127', 'mp-1767501', 'mp-1781375', 'mp-974502', 'mp-1614766']",0.0023936,"{'Pt': 1.0, 'Rh': 3.0}",58.60426696089625,[],NM,False,221,0,"[0, 0, 0, 0]",4.084344236567504e-05,0.0023936,0,0.0023936,MP,data/source/MP/cleaned/cifs/MP-mp-974370.cif,True,,data/final/MP/graphs/Pt0.2Rh0.8-MP-mp-974370-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ag1Te3,1,0.0,1.0,True,Ag1Te3,Ag1Te3,2.6,Other,True,Ag25Te75,Ag-Te,2,Supercon,Ag1Te3,MP-mp-28246,Ag1Te3,Ag-Te,Ag25Te75,I m -3 m,cubic,5.323411391180118,5.32341139,5.32341139,data/final/MP/cifs/Ag1Te3-MP-mp-28246.cif,data/source/MP/raw/cifs/mp-28246.cif,mp-28246,0.0,,2014-02-25 19:34:14,7.015987584034746,10.17188/1202376,"@misc{osti_1202376,
    author = ""Persson, Kristin"",
    title = ""Materials Data on AgTe3 (SG:229) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1202376"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697115'}},0.0,5.6896913,520.0,-12.2597021,-3.064925525,{'tags': ['Silver telluride (1/3)']},-12.2597021,-3.064925525,-0.3158108266666666,"['xas', 'bandstructure']",True,[37186],True,2021-05-12 10:57:03.017000,NM,4,10,mp-28246,,AgTe3,"{'functional': 'PBE', 'labels': ['Ag', 'Te'], 'pot_type': 'paw'}","{'Ag': 1.0, 'Te': 3.0}",GGA,mp-28246,"['mp-992221', 'mp-990555', 'mp-504889', 'mp-28246', 'mp-1116146', 'mp-1440464', 'mp-1697115', 'mp-1804974', 'mp-993853', 'mp-1590896']",0.0044964,"{'Ag': 1.0, 'Te': 3.0}",116.1310086540579,[],NM,False,229,0,"[0, 0, 0, 0]",3.8718341053889446e-05,0.0044964,0,0.0044964,MP,data/source/MP/cleaned/cifs/MP-mp-28246.cif,False,,data/final/MP/graphs/Ag1Te3-MP-mp-28246.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,1,0,1.0,False
Hg2Mg5,3,0.0714285714285714,1.0,True,Hg2Mg5,Hg2Mg6,0.0,Other,True,Hg28.571Mg71.429,Hg-Mg,2,Supercon,Hg2Mg5,MP-mp-1185784,Mg6Hg2,Hg-Mg,Hg25Mg75,P 63/m m c,hexagonal,5.046004,6.2829660043498325,6.28296586,data/final/MP/cifs/Hg2Mg5-MP-mp-1185784-synth_doped.cif,data/source/MP/raw/cifs/mp-1185784.cif,mp-1185784,0.0,,2019-01-11 13:49:32.554000,5.26546506128944,,,,0.0,3.81807418,520.0,-11.45838379,-1.43229797375,{'tags': []},-11.45838379,-1.43229797375,-0.1561678449999999,[],False,[],True,2021-05-12 10:59:52.436000,NM,8,3,mp-1185784,,Mg3Hg,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Hg'], 'pot_type': 'paw'}","{'Mg': 3.0, 'Hg': 1.0}",GGA,mp-1185784,"['mp-1185784', 'mp-1392782', 'mp-1778382']",0.00158385,"{'Mg': 6.0, 'Hg': 2.0}",172.5073596060341,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.836269482782808e-05,0.00158385,0,0.0031677,MP,data/source/MP/cleaned/cifs/MP-mp-1185784.cif,True,,data/final/MP/graphs/Hg2Mg5-MP-mp-1185784-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Ca0.01Cu4Tm0.99O8,2,0.0013333333333333,1.0,True,Ba2Ca0.01Cu4Tm0.99O8,Ba2Cu4Tm1O8,79.2,Cuprate,True,Ba13.333Ca0.067Cu26.667Tm6.6O53.333333333333336,Ba-Ca-Cu-Tm-O,5,Supercon,Tm0.99Ca0.01Ba2Cu4O8,MP-mp-6710,Ba2Tm1Cu4O8,Ba-Cu-Tm-O,Ba13.333Cu26.667Tm6.667O53.333333333333336,C m m m,orthorhombic,3.865297,3.8869580003373287,13.86982093,data/final/MP/cifs/Ba2Ca0.01Cu4Tm0.99O8-MP-mp-6710-synth_doped.cif,data/source/MP/raw/cifs/mp-6710.cif,mp-6710,0.0,,2011-05-16 03:10:26,6.645830128925235,10.17188/1281743,"@misc{osti_1281743,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Tm(CuO2)4 (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281743"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677992'}},0.0,3.30740365,520.0,-89.79535451,-5.986356967333333,"{'tags': ['Thulium dibarium tetracopper octaoxide', 'Thulium dibarium tricopper copper(III) oxide']}",-89.79535451,-5.986356967333333,-2.066470847111112,"['xas', 'bandstructure']",True,"[78622, 75686]",True,2021-05-12 10:57:32.679000,NM,15,7,mp-6710,oxide,Ba2Tm(CuO2)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Tm_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Tm': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-6710,"['mp-1007646', 'mp-1001301', 'mp-6710', 'mp-1420256', 'mp-1677992', 'mp-1831034', 'mp-1603852']",0.0025713,"{'Ba': 2.0, 'Tm': 1.0, 'Cu': 4.0, 'O': 8.0}",206.32772996439093,[],NM,False,65,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.2462212425076202e-05,0.0025713,0,0.0025713,MP,data/source/MP/cleaned/cifs/MP-mp-6710.cif,True,,data/final/MP/graphs/Ba2Ca0.01Cu4Tm0.99O8-MP-mp-6710-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Nb0.47Ta0.53,3,0.06,2.0,False,Nb0.94Ta1.06,Nb1Ta1,6.2,Other,True,Nb47Ta53,Nb-Ta,2,Supercon,Nb0.47Ta0.53,MP-mp-1217892,Ta1Nb1,Nb-Ta,Nb50Ta50,C m m m,orthorhombic,2.87873582,2.87873582,4.693674,data/final/MP/cifs/Nb0.47Ta0.53-MP-mp-1217892-synth_doped.cif,data/source/MP/raw/cifs/mp-1217892.cif,mp-1217892,0.0,,2019-01-12 19:09:10.960000,12.407336172495045,,,{'GGA': {'task_id': 'mp-1675862'}},0.0001007699999995,5.09964765,520.0,-21.95888113,-10.979440565,{'tags': []},-21.95888113,-10.979440565,0.0001007699999995,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,2,5,mp-1217892,,TaNb,"{'functional': 'PBE', 'labels': ['Ta_pv', 'Nb_pv'], 'pot_type': 'paw'}","{'Ta': 1.0, 'Nb': 1.0}",GGA,mp-1217892,"['mp-1217892', 'mp-1382606', 'mp-1675862', 'mp-1791691', 'mp-1610242']",0.0026552,"{'Ta': 1.0, 'Nb': 1.0}",36.65135617852667,[],NM,False,65,0,"[0, 0]",7.244479541402703e-05,0.0026552,0,0.0026552,MP,data/source/MP/cleaned/cifs/MP-mp-1217892.cif,True,,data/final/MP/graphs/Nb0.47Ta0.53-MP-mp-1217892-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ru2Si2Y1,1,0.0,1.0,True,Ru2Si2Y1,Ru2Si2Y1,1.1,Other,True,Ru40Si40Y20,Ru-Si-Y,3,Supercon,Y1Ru2Si2,MP-mp-568673,Y1Si2Ru2,Ru-Si-Y,Ru40Si40Y20,I 4/m m m,tetragonal,4.187643999089907,4.187643999089907,5.62776231,data/final/MP/cifs/Ru2Si2Y1-MP-mp-568673.cif,data/source/MP/raw/cifs/mp-568673.cif,mp-568673,0.0,,2014-02-16 14:33:05,6.870038863566219,10.17188/1274638,"@misc{osti_1274638,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Y(SiRu)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1274638"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698069'}},0.0,6.95939036,520.0,-40.4481522,-8.08963044,"{'tags': ['Ruthenium yttrium silicide (2/1/2)', 'Yttrium ruthenium silicide (1/2/2)']}",-40.4481522,-8.08963044,-0.8880547473333337,"['xas', 'elasticity', 'bandstructure']",True,"[427111, 650661]",True,2021-05-12 10:56:22.739000,NM,5,13,mp-568673,,Y(SiRu)2,"{'functional': 'PBE', 'labels': ['Y_sv', 'Si', 'Ru_pv'], 'pot_type': 'paw'}","{'Y': 1.0, 'Si': 2.0, 'Ru': 2.0}",GGA,mp-568673,"['mp-1008363', 'mp-568673', 'mp-1002001', 'mp-1069146', 'mp-1069078', 'mp-1069106', 'mp-1171424', 'mp-1438401', 'mp-1698069', 'mp-1784291', 'mp-1012653', 'mp-1593964', 'mp-1069130']",0.0001503,"{'Y': 1.0, 'Si': 2.0, 'Ru': 2.0}",83.92487370988432,[],NM,False,139,0,"[0, 0, 0, 0, 0]",1.7908874134212522e-06,0.0001503,0,0.0001503,MP,data/source/MP/cleaned/cifs/MP-mp-568673.cif,False,,data/final/MP/graphs/Ru2Si2Y1-MP-mp-568673.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B4Er0.72Rh4Y0.28,3,0.0622222222222224,2.0,False,B8Er1.44Rh8Y0.56,B8Er2Rh8,9.05,Other,True,B44.444Er8Rh44.444Y3.111,B-Er-Rh-Y,4,Supercon,Y0.28Er0.72Rh4B4,MP-mp-8408,Er2B8Rh8,B-Er-Rh,B44.444Er11.111Rh44.444,P 42/n m c,tetragonal,5.336304,5.336304,7.44528,data/final/MP/cifs/B4Er0.72Rh4Y0.28-MP-mp-8408-synth_doped.cif,data/source/MP/raw/cifs/mp-8408.cif,mp-8408,0.0,,2011-06-07 02:27:50,9.745285939793032,10.17188/1308086,"@misc{osti_1308086,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Er(BRh)4 (SG:137) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1308086"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1673724'}},0.0133402750000009,6.84272912,520.0,-131.92031901,-7.328906611666666,{'tags': ['Erbium rhodium boride (1/4/4)']},-131.92031901,-7.328906611666666,-0.5797380146296286,"['xas', 'bandstructure']",True,"[613809, 601530, 49631]",True,2021-05-12 10:57:51.871000,NM,18,8,mp-8408,,Er(BRh)4,"{'functional': 'PBE', 'labels': ['Er_3', 'B', 'Rh_pv'], 'pot_type': 'paw'}","{'Er': 1.0, 'B': 4.0, 'Rh': 4.0}",GGA,mp-8408,"['mp-932384', 'mp-931412', 'mp-8408', 'mp-915879', 'mp-1434188', 'mp-1673724', 'mp-1785064', 'mp-1597242']",7.985e-05,"{'Er': 2.0, 'B': 8.0, 'Rh': 8.0}",212.01283845150363,[],NM,False,137,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",7.532562705467018e-07,7.985e-05,0,0.0001597,MP,data/source/MP/cleaned/cifs/MP-mp-8408.cif,True,,data/final/MP/graphs/B4Er0.72Rh4Y0.28-MP-mp-8408-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ga6Yb1,1,0.0,2.0,False,Ga12Yb2,Ga12Yb2,0.0,Heavy_fermion,True,Ga85.714Yb14.286,Ga-Yb,2,Supercon,Ga6Yb1,MP-mp-1104639,Yb2Ga12,Ga-Yb,Ga85.714Yb14.286,P 4/n b m,tetragonal,6.023116,6.023116,7.67874,data/final/MP/cifs/Ga6Yb1-MP-mp-1104639.cif,data/source/MP/raw/cifs/mp-1104639.cif,mp-1104639,0.0,,2018-07-18 22:39:26,7.050368874129408,,,{'GGA': {'task_id': 'mp-1669146'}},0.0089440028571394,3.20813471,520.0,-43.38364467,-3.0988317621428574,{'tags': ['Ytterbium gallide (1/6)']},-43.38364467,-3.0988317621428574,-0.2833768457142857,['bandstructure'],True,"[635669, 250901]",True,2021-05-12 10:58:20.361000,NM,14,6,mp-1104639,,YbGa6,"{'functional': 'PBE', 'labels': ['Yb_2', 'Ga_d'], 'pot_type': 'paw'}","{'Yb': 1.0, 'Ga': 6.0}",GGA,mp-1104639,"['mp-1104639', 'mp-1105087', 'mp-1431792', 'mp-1669146', 'mp-1928752', 'mp-1603142']",0.0002355,"{'Yb': 2.0, 'Ga': 12.0}",278.56876417662176,[],NM,False,125,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.6907854022763678e-06,0.0002355,0,0.000471,MP,data/source/MP/cleaned/cifs/MP-mp-1104639.cif,False,,data/final/MP/graphs/Ga6Yb1-MP-mp-1104639.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Au9Nb11,3,0.1,0.8888989898989899,True,Au8Nb9.778,Au8Nb12,0.0,Other,True,Au45Nb55,Au-Nb,2,Supercon,Au9Nb11,MP-mp-1188500,Nb12Au8,Au-Nb,Au40Nb60,P 41 3 2,cubic,7.136592,7.136592,7.136592,data/final/MP/cifs/Au9Nb11-MP-mp-1188500-synth_doped.cif,data/source/MP/raw/cifs/mp-1188500.cif,mp-1188500,0.0,,2019-01-11 19:29:23.522000,12.292128728847166,,,{'GGA': {'task_id': 'mp-1670783'}},0.1225927630000036,5.53677358,520.0,-147.90461866,-7.395230933000001,{'tags': ['Niobium auride (3/2)']},-147.90461866,-7.395230933000001,-0.0248952930000001,['bandstructure'],True,[612191],True,2021-05-12 10:58:33.577000,NM,20,5,mp-1188500,,Nb3Au2,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Au'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Au': 2.0}",GGA,mp-1188500,"['mp-1188500', 'mp-1426553', 'mp-1670783', 'mp-1841690', 'mp-1637979']",0.0004978,"{'Nb': 12.0, 'Au': 8.0}",363.4733773118368,[],NM,False,213,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.478255421969126e-06,0.0004978,0,0.0019912,MP,data/source/MP/cleaned/cifs/MP-mp-1188500.cif,True,,data/final/MP/graphs/Au9Nb11-MP-mp-1188500-synth_doped.json,0,True,432,4,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Cu1Hg1O4.14,2,0.0171990171990171,0.9660458937198066,True,Ba1.932Cu0.966Hg0.966O4,Ba2Cu1Hg1O4,0.0,Cuprate,True,Ba24.57Cu12.285Hg12.285O50.85995085995085,Ba-Cu-Hg-O,4,Supercon,Hg1Ba2Cu1O4.14,MP-mp-6562,Ba2Cu1Hg1O4,Ba-Cu-Hg-O,Ba25Cu12.5Hg12.5O50,P 4/m m m,tetragonal,3.933714,3.933714,9.827602,data/final/MP/cifs/Ba2Cu1Hg1O4.14-MP-mp-6562-synth_doped.cif,data/source/MP/raw/cifs/mp-6562.cif,mp-6562,0.0,,2011-05-13 18:18:06,6.582036471328142,10.17188/1281336,"@misc{osti_1281336,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2CuHgO4 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281336"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697135'}},0.0234340381250053,2.58068675,520.0,-40.91481298,-5.1143516225,"{'tags': ['Mercury dibarium copper oxide', 'High pressure experimental phase']}",-40.91481298,-5.1143516225,-1.953767533125,"['xas', 'bandstructure']",True,"[75722, 75720, 75724, 75721, 75723]",True,2021-05-12 10:57:32.679000,NM,8,8,mp-6562,oxide,Ba2CuHgO4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Cu_pv', 'Hg', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",GGA,mp-6562,"['mp-6562', 'mp-990899', 'mp-992892', 'mp-1435690', 'mp-1697135', 'mp-1878488', 'mp-994198', 'mp-1592659']",0.0003984,"{'Ba': 2.0, 'Cu': 1.0, 'Hg': 1.0, 'O': 4.0}",152.07335344042525,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0, 0, 0]",2.619788352047311e-06,0.0003984,0,0.0003984,MP,data/source/MP/cleaned/cifs/MP-mp-6562.cif,True,,data/final/MP/graphs/Ba2Cu1Hg1O4.14-MP-mp-6562-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
As2Co1,1,0.0,4.0,False,As8Co4,As8Co4,0.0,Other,True,As66.667Co33.333,As-Co,2,Supercon,As2Co1,MP-mp-2715,Co4As8,As-Co,As66.667Co33.333,P 1 21/c 1,monoclinic,5.891213,5.938265,5.99373573,data/final/MP/cifs/As2Co1-MP-mp-2715.cif,data/source/MP/raw/cifs/mp-2715.cif,mp-2715,0.1710000000000002,,2011-05-13 21:50:36,7.35831544375982,10.17188/1201370,"@misc{osti_1201370,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CoAs2 (SG:14) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201370"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687616'}},0.0,6.20925901,520.0,-69.6156962,-5.801308016666667,"{'tags': ['Cobalt arsenide (1/2)', 'Clinosafflorite']}",-69.6156962,-5.801308016666667,-0.3257898150000002,"['diel', 'xas', 'elasticity', 'bandstructure']",True,"[610026, 42613, 610039, 30242, 174220]",True,2021-05-12 10:56:18.721000,NM,12,9,mp-2715,,CoAs2,"{'functional': 'PBE', 'labels': ['Co', 'As'], 'pot_type': 'paw'}","{'Co': 1.0, 'As': 2.0}",GGA,mp-2715,"['mp-922213', 'mp-907601', 'mp-921975', 'mp-2715', 'mp-1140495', 'mp-1300458', 'mp-1687616', 'mp-1830803', 'mp-1588653']",1.15e-06,"{'Co': 4.0, 'As': 8.0}",188.45691665769183,[],NM,False,14,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.4408761862295125e-08,1.15e-06,0,4.6e-06,MP,data/source/MP/cleaned/cifs/MP-mp-2715.cif,False,,data/final/MP/graphs/As2Co1-MP-mp-2715.json,0,True,2/m,0,0,3,0,0,0,0,1,0,0,0,1.0,False
Mo3Si2,1,0.0,2.0,False,Mo6Si4,Mo6Si4,0.0,Other,True,Mo60Si40,Mo-Si,2,Supercon,Mo3Si2,MP-mp-1087230,Si4Mo6,Mo-Si,Mo60Si40,P 4/m b m,tetragonal,3.29676,6.6332,6.6332,data/final/MP/cifs/Mo3Si2-MP-mp-1087230.cif,data/source/MP/raw/cifs/mp-1087230.cif,mp-1087230,0.0,,2018-04-25 14:55:39,7.875763328844874,,,{'GGA': {'task_id': 'mp-1696221'}},0.1447411008571446,9.6705915,520.0,-89.45787688,-8.945787688,{'tags': ['Molybdenum silicide (3/2)']},-89.45787688,-8.945787688,-0.2398762619999985,['bandstructure'],True,[644412],True,2021-05-12 10:58:18.470000,NM,10,5,mp-1087230,,Si2Mo3,"{'functional': 'PBE', 'labels': ['Si', 'Mo_pv'], 'pot_type': 'paw'}","{'Si': 2.0, 'Mo': 3.0}",GGA,mp-1087230,"['mp-1087230', 'mp-1432799', 'mp-1696221', 'mp-1780984', 'mp-1601805']",8.35e-06,"{'Si': 4.0, 'Mo': 6.0}",145.0552715231424,[],NM,False,6,0,"[0.0, 0.0, 0.0, 0.0, -0.0, 0.0, -0.0, 0.0, 0.0, 0.0]",1.151285287645382e-07,8.35e-06,0,1.67e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1087230.cif,False,,data/final/MP/graphs/Mo3Si2-MP-mp-1087230.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B2Co3Yb1,1,0.0,1.0,True,B2Co3Yb1,B2Co3Yb1,0.0,Heavy_fermion,True,B33.333Co50Yb16.667,B-Co-Yb,3,Supercon,Yb1Co3B2,MP-mp-10058,Yb1Co3B2,B-Co-Yb,B33.333Co50Yb16.667,P 6/m m m,hexagonal,2.756735,5.165642002553814,5.16564183,data/final/MP/cifs/B2Co3Yb1-MP-mp-10058.cif,data/source/MP/raw/cifs/mp-10058.cif,mp-10058,0.0,,2011-05-28 00:27:32,9.682528041209444,10.17188/1185089,"@misc{osti_1185089,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YbCo3B2 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1185089"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698010'}},0.0,5.21060085,520.0,-38.70263665,-6.450439441666667,{'tags': ['Cobalt ytterbium boride (3/1/2)']},-38.70263665,-6.450439441666667,-0.4132152405555563,"['xas', 'elasticity', 'bandstructure']",True,[44189],True,2021-05-12 10:56:08.727000,NM,6,6,mp-10058,,YbCo3B2,"{'functional': 'PBE', 'labels': ['Yb_2', 'Co', 'B'], 'pot_type': 'paw'}","{'Yb': 1.0, 'Co': 3.0, 'B': 2.0}",GGA,mp-10058,"['mp-1000780', 'mp-10058', 'mp-1430860', 'mp-1698010', 'mp-1926666', 'mp-1589809']",0.003182,"{'Yb': 1.0, 'Co': 3.0, 'B': 2.0}",63.70510583686455,[],NM,False,191,0,"[0, 0, 0, 0, 0, 0]",4.994890061321672e-05,0.003182,0,0.003182,MP,data/source/MP/cleaned/cifs/MP-mp-10058.cif,False,,data/final/MP/graphs/B2Co3Yb1-MP-mp-10058.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ge1.83La1,2,0.0400471142520612,2.0,False,Ge3.66La2,Ge4La2,2.17,Other,True,Ge64.664La35.336,Ge-La,2,Supercon,Ge1.83La1,MP-mp-19761,La2Ge4,Ge-La,Ge66.667La33.333,I 41/a m d,tetragonal,4.320984000934922,4.320984000934921,8.41484573,data/final/MP/cifs/Ge1.83La1-MP-mp-19761-synth_doped.cif,data/source/MP/raw/cifs/mp-19761.cif,mp-19761,0.0,,2014-02-21 13:34:05,6.447172399329149,10.17188/1194966,"@misc{osti_1194966,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaGe2 (SG:141) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1194966"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703381'}},0.0059020154166642,6.2456377,520.0,-32.49839164,-5.416398606666667,"{'tags': ['Lanthanum germanide (1/2)', 'Germanium lanthanum (2/1)']}",-32.49839164,-5.416398606666667,-0.6890443350000002,"['xas', 'elasticity', 'bandstructure']",True,"[636796, 636784, 57072]",True,2021-05-12 10:56:14.760000,NM,6,6,mp-19761,,LaGe2,"{'functional': 'PBE', 'labels': ['La', 'Ge_d'], 'pot_type': 'paw'}","{'La': 1.0, 'Ge': 2.0}",GGA,mp-19761,"['mp-19761', 'mp-20013', 'mp-1438339', 'mp-1703381', 'mp-1780058', 'mp-1596448']",0.0002277,"{'La': 2.0, 'Ge': 4.0}",146.3900903733194,[],NM,False,141,0,"[0, 0, 0, 0, 0, 0]",3.110866308222457e-06,0.0002277,0,0.0004554,MP,data/source/MP/cleaned/cifs/MP-mp-19761.cif,True,,data/final/MP/graphs/Ge1.83La1-MP-mp-19761-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Au0.1Nb3Rh0.9,2,0.0499999999999999,2.0,False,Au0.2Nb6Rh1.8,Nb6Rh2,2.7,Other,True,Au2.5Nb75Rh22.5,Au-Nb-Rh,3,Supercon,Nb3Rh0.9Au0.1,MP-mp-1545,Nb6Rh2,Nb-Rh,Nb75Rh25,P m -3 n,cubic,5.186072,5.186072,5.186072,data/final/MP/cifs/Au0.1Nb3Rh0.9-MP-mp-1545-synth_doped.cif,data/source/MP/raw/cifs/mp-1545.cif,mp-1545,0.0,,2011-05-14 11:20:25,9.086567873234834,10.17188/1191190,"@misc{osti_1191190,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Rh (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191190"",
    place = ""United States"",
    year = ""2015"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700041'}},0.0,5.48706495,520.0,-77.37430008,-9.67178751,{'tags': ['Niobium rhodium (3/1)']},-77.37430008,-9.67178751,-0.2547317625000005,"['xas', 'elasticity', 'bandstructure']",True,"[105216, 645269]",True,2021-05-12 10:56:12.755000,NM,8,8,mp-1545,,Nb3Rh,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Rh_pv'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Rh': 1.0}",GGA,mp-1545,"['mp-942004', 'mp-943019', 'mp-935201', 'mp-1545', 'mp-1433570', 'mp-1700041', 'mp-1786474', 'mp-1591392']",0.00021655,"{'Nb': 6.0, 'Rh': 2.0}",139.48118416938905,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",3.1050783127424102e-06,0.00021655,0,0.0004331,MP,data/source/MP/cleaned/cifs/MP-mp-1545.cif,True,,data/final/MP/graphs/Au0.1Nb3Rh0.9-MP-mp-1545-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba1.8Cu3La0.2Y1O7,3,0.0307692307692307,1.0,True,Ba1.8Cu3La0.2Y1O7,Ba2Cu3Y1O7,79.05,Cuprate,True,Ba13.846Cu23.077La1.538Y7.692O53.84615384615385,Ba-Cu-La-Y-O,5,Supercon,Y1Ba1.8La0.2Cu3O7,MP-mp-20674,Ba2Y1Cu3O7,Ba-Cu-Y-O,Ba15.385Cu23.077Y7.692O53.84615384615385,P m m m,orthorhombic,3.844668,3.926152,11.823664,data/final/MP/cifs/Ba1.8Cu3La0.2Y1O7-MP-mp-20674-synth_doped.cif,data/source/MP/raw/cifs/mp-20674.cif,mp-20674,0.0,,2014-02-22 18:23:22,6.198285186087997,10.17188/1195834,"@misc{osti_1195834,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2YCu3O7 (SG:47) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195834"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686609'}},0.0313759126602519,3.28295453,520.0,-80.7708035,-6.213138730769231,"{'tags': ['Yttrium barium copper oxide (1/2/3/7)', 'Dibarium yttrium dicopper copper(III) oxide', 'Yttrium barium copper oxide (1/2/3/6.93)', 'Dibarium yttrium copper(III) dicopper oxide', 'High pressure experimental phase', 'Yttrium dibarium dicopper copper(III) oxide']}",-80.7708035,-6.213138730769231,-2.180157206282052,"['xas', 'elasticity', 'bandstructure']",True,"[196266, 196264, 196265, 71423, 66620, 63483, 66621, 164530, 56507, 63487, 66602, 66601, 68394, 63486, 63485, 202774, 62466, 62465, 41646, 65224, 202773, 66600, 63335, 66611, 78598, 66617, 81175, 66610, 66619, 66615, 63484, 86958, 262809, 66609, 184677, 202775, 66616, 63488, 66618, 66623, 202771, 66622, 202772, 77737, 202770, 62928, 77745]",True,2021-05-12 10:56:14.760000,NM,13,14,mp-20674,oxide,Ba2YCu3O7,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Cu': 3.0, 'O': 7.0}",GGA,mp-20674,"['mp-923155', 'mp-917354', 'mp-922372', 'mp-20674', 'mp-1103385', 'mp-1103741', 'mp-1103748', 'mp-1104329', 'mp-1104589', 'mp-1440689', 'mp-1686609', 'mp-1832558', 'mp-1596594', 'mp-1592890']",0.0001806,"{'Ba': 2.0, 'Y': 1.0, 'Cu': 3.0, 'O': 7.0}",178.47526348558395,[],NM,False,47,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.0119049355799813e-06,0.0001806,0,0.0001806,MP,data/source/MP/cleaned/cifs/MP-mp-20674.cif,True,,data/final/MP/graphs/Ba1.8Cu3La0.2Y1O7-MP-mp-20674-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Pt5Th3,1,0.0,1.0,True,Pt5Th3,Pt5Th3,0.0,Other,True,Pt62.5Th37.5,Pt-Th,2,Supercon,Pt5Th3,MP-mp-1207128,Th3Pt5,Pt-Th,Pt62.5Th37.5,P -6 2 m,hexagonal,3.886692,7.278634000163295,7.278634910000001,data/final/MP/cifs/Pt5Th3-MP-mp-1207128.cif,data/source/MP/raw/cifs/mp-1207128.cif,mp-1207128,0.0,,2019-01-12 10:18:00.056000,15.56516629376588,,,{'GGA': {'task_id': 'mp-1722470'}},0.0,7.51569043,520.0,-62.4696133,-7.8087016625,"{'tags': ['Th3Pt5', 'AlB2 family', 'Th3Pd5']}",-62.4696133,-7.8087016625,-1.2341875,['bandstructure'],True,[],True,2021-05-12 10:58:39.488000,NM,8,5,mp-1207128,,Th3Pt5,"{'functional': 'PBE', 'labels': ['Th', 'Pt'], 'pot_type': 'paw'}","{'Th': 3.0, 'Pt': 5.0}",GGA,mp-1207128,"['mp-1207128', 'mp-1404420', 'mp-1722470', 'mp-1828900', 'mp-1619540']",0.0004752,"{'Th': 3.0, 'Pt': 5.0}",178.3243271971268,[],NM,False,189,0,"[0, 0, 0, 0, 0, 0, 0, 0]",2.6648074744995115e-06,0.0004752,0,0.0004752,MP,data/source/MP/cleaned/cifs/MP-mp-1207128.cif,False,,data/final/MP/graphs/Pt5Th3-MP-mp-1207128.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Cu0.9La2Zn0.1O4,2,0.0285714285714285,1.0,True,Cu0.9La2Zn0.1O4,Cu1La2O4,0.0,Cuprate,True,Cu12.857La28.571Zn1.429O57.142857142857146,Cu-La-Zn-O,4,Supercon,La2Cu0.9Zn0.1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu0.9La2Zn0.1O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu0.9La2Zn0.1O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B1V2,3,0.1333333333333334,3.0,False,B3V6,B4V6,0.0,Other,True,B33.333V66.667,B-V,2,Supercon,B1V2,MP-mp-2091,V6B4,B-V,B40V60,P 4/m b m,tetragonal,3.017843,5.730474,5.730474,data/final/MP/cifs/B1V2-MP-mp-2091-synth_doped.cif,data/source/MP/raw/cifs/mp-2091.cif,mp-2091,0.0,,2011-05-13 21:22:51,5.846064712021974,10.17188/1196105,"@misc{osti_1196105,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3B2 (SG:127) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196105"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702148'}},0.0,6.90923861,520.0,-88.44793895,-8.844793894999999,{'tags': ['Vanadium boride (3/2)']},-88.44793895,-8.844793894999999,-0.7226935446666658,"['xas', 'elasticity', 'bandstructure']",True,"[615662, 107318, 88317, 88321]",True,2021-05-12 10:56:14.760000,NM,10,8,mp-2091,,V3B2,"{'functional': 'PBE', 'labels': ['V_pv', 'B'], 'pot_type': 'paw'}","{'V': 3.0, 'B': 2.0}",GGA,mp-2091,"['mp-921427', 'mp-920414', 'mp-906784', 'mp-2091', 'mp-1426677', 'mp-1702148', 'mp-1796458', 'mp-1596660']",0.00360755,"{'V': 6.0, 'B': 4.0}",99.1009311566266,[],NM,False,127,0,"[-0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",7.280557221603407e-05,0.00360755,0,0.0072151,MP,data/source/MP/cleaned/cifs/MP-mp-2091.cif,True,,data/final/MP/graphs/B1V2-MP-mp-2091-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Rh1Te2,1,0.0,4.0,False,Rh4Te8,Rh4Te8,0.755,Other,True,Rh33.333Te66.667,Rh-Te,2,Supercon,Rh1Te2,MP-mp-754,Te8Rh4,Rh-Te,Rh33.333Te66.667,P a -3,cubic,6.541972,6.541972,6.541972,data/final/MP/cifs/Rh1Te2-MP-mp-754.cif,data/source/MP/raw/cifs/mp-754.cif,mp-754,0.0,,2011-05-14 19:15:05,8.495599624405244,10.17188/1289209,"@misc{osti_1289209,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Te2Rh (SG:205) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1289209"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1701657'}},0.0,8.18724479,520.0,-59.41325301,-4.9511044175,"{'tags': ['Rhodium telluride (1/2)', 'Rhodium ditelluride - low-temperature phase', 'Rhenium telluride (1/2)', 'Rhodium pertelluride (1/1)']}",-59.41325301,-4.9511044175,-0.6821345074999995,"['bandstructure', 'elasticity']",True,"[2179, 650457, 26619, 650452]",True,2021-05-12 10:56:29.056000,NM,12,9,mp-754,,Te2Rh,"{'functional': 'PBE', 'labels': ['Te', 'Rh_pv'], 'pot_type': 'paw'}","{'Te': 2.0, 'Rh': 1.0}",GGA,mp-754,"['mp-923525', 'mp-922743', 'mp-908395', 'mp-754', 'mp-1095681', 'mp-1475462', 'mp-1701657', 'mp-1921369', 'mp-1599768']",0.00065305,"{'Te': 8.0, 'Rh': 4.0}",279.97937709121084,[],NM,False,205,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",9.329972897071648e-06,0.00065305,0,0.0026122,MP,data/source/MP/cleaned/cifs/MP-mp-754.cif,False,,data/final/MP/graphs/Rh1Te2-MP-mp-754.json,0,True,m-3,2,0,0,0,0,0,0,1,0,0,0,1.0,False
Nb0.6Ru0.4,3,0.1333333333333333,3.0,False,Nb1.8Ru1.2,Nb2Ru1,0.6,Other,True,Nb60Ru40,Nb-Ru,2,Supercon,Nb0.6Ru0.4,MP-mp-1220677,Nb2Ru1,Nb-Ru,Nb66.667Ru33.333,F m m m,orthorhombic,2.851184741387406,2.85118474,6.82314741,data/final/MP/cifs/Nb0.6Ru0.4-MP-mp-1220677-synth_doped.cif,data/source/MP/raw/cifs/mp-1220677.cif,mp-1220677,0.0,,2019-01-12 21:29:13.342000,9.392703835709009,,,{'GGA': {'task_id': 'mp-1764746'}},0.125383196666668,5.90919132,520.0,-29.66571899,-9.888572996666666,{'tags': []},-29.66571899,-9.888572996666666,-0.0629064183333329,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,3,5,mp-1220677,,Nb2Ru,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Ru_pv'], 'pot_type': 'paw'}","{'Nb': 2.0, 'Ru': 1.0}",GGA,mp-1220677,"['mp-1220677', 'mp-1431434', 'mp-1764746', 'mp-1794148', 'mp-1609880']",0.0007089,"{'Nb': 2.0, 'Ru': 1.0}",50.71809341022112,[],NM,False,69,0,"[0.0, 0.0, 0.0]",1.3977260427875955e-05,0.0007089,0,0.0007089,MP,data/source/MP/cleaned/cifs/MP-mp-1220677.cif,True,,data/final/MP/graphs/Nb0.6Ru0.4-MP-mp-1220677-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,0,0,1,1.0,False
Si1V2.7Zr0.3,3,0.1499999999999999,2.0,False,Si2V5.4Zr0.6,Si2V6,13.2,Other,True,Si25V67.5Zr7.5,Si-V-Zr,3,Supercon,V2.7Zr0.3Si1,MP-mp-2567,V6Si2,Si-V,Si25V75,P m -3 n,cubic,4.702381,4.702381,4.702381,data/final/MP/cifs/Si1V2.7Zr0.3-MP-mp-2567-synth_doped.cif,data/source/MP/raw/cifs/mp-2567.cif,mp-2567,0.0,,2011-05-13 19:15:43,5.778142190030859,10.17188/1200874,"@misc{osti_1200874,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Si (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1200874"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668672'}},0.0,7.30599425,520.0,-69.05773321,-8.63221665125,{'tags': ['Vanadium silicide (3/1)']},-69.05773321,-8.63221665125,-0.4452085937499994,"['xas', 'elasticity', 'bandstructure']",True,"[652491, 87328, 652522, 652502, 652510, 652520, 600518, 186003, 652507, 652513, 652497, 601150, 652514, 652487, 22412, 652509, 652529, 652532, 652499, 652539, 652537, 652533, 652512, 652538, 652490, 652493, 652494, 652511, 652519, 87329, 652526, 652500]",True,2021-05-12 10:56:18.721000,FM,8,13,mp-2567,,V3Si,"{'functional': 'PBE', 'labels': ['V_pv', 'Si'], 'pot_type': 'paw'}","{'V': 3.0, 'Si': 1.0}",GGA,mp-2567,"['mp-920081', 'mp-906309', 'mp-919083', 'mp-2567', 'mp-1078474', 'mp-1078852', 'mp-1138781', 'mp-1145907', 'mp-1440678', 'mp-1668672', 'mp-1795955', 'mp-1593554', 'mp-1596575']",0.8382519,"{'V': 6.0, 'Si': 2.0}",103.98086881866836,[],FM,True,131,1,"[0.2, 0.3, 0.3, 0.2, 0.3, 0.3, 0.0, 0.0]",0.0161231947669493,0.8382519,6,1.6765038,MP,data/source/MP/cleaned/cifs/MP-mp-2567.cif,True,,data/final/MP/graphs/Si1V2.7Zr0.3-MP-mp-2567-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Au0.328Ga0.672,2,0.0106666666666667,3.0,False,Au0.984Ga2.016,Au1Ga2,1.668,Other,True,Au32.8Ga67.2,Au-Ga,2,Supercon,Au0.328Ga0.672,MP-mp-2776,Ga2Au1,Au-Ga,Au33.333Ga66.667,F m -3 m,cubic,4.40327555,4.40327555,4.40327555,data/final/MP/cifs/Au0.328Ga0.672-MP-mp-2776-synth_doped.cif,data/source/MP/raw/cifs/mp-2776.cif,mp-2776,0.0,,2011-05-12 21:57:19,9.253557284351938,10.17188/1201942,"@misc{osti_1201942,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ga2Au (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201942"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687524'}},0.0,3.58527429,520.0,-10.04441228,-3.3481374266666664,"{'tags': ['Gold gallium (1/2)', 'Gallium gold (2/1)']}",-10.04441228,-3.3481374266666664,-0.2381128983333328,"['xas', 'elasticity', 'bandstructure']",True,"[611874, 611864, 150958, 58458]",True,2021-05-12 10:56:18.721000,NM,3,8,mp-2776,,Ga2Au,"{'functional': 'PBE', 'labels': ['Ga_d', 'Au'], 'pot_type': 'paw'}","{'Ga': 2.0, 'Au': 1.0}",GGA,mp-2776,"['mp-991379', 'mp-2776', 'mp-993315', 'mp-1439079', 'mp-1687524', 'mp-1795480', 'mp-994626', 'mp-1589089']",0.000866,"{'Ga': 2.0, 'Au': 1.0}",60.36880695215696,[],NM,False,225,0,"[0, 0, 0]",1.4345156774198237e-05,0.000866,0,0.000866,MP,data/source/MP/cleaned/cifs/MP-mp-2776.cif,True,,data/final/MP/graphs/Au0.328Ga0.672-MP-mp-2776-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
B2Ru3Tm1,1,0.0,1.0,True,B2Ru3Tm1,B2Ru3Tm1,0.0,Other,True,B33.333Ru50Tm16.667,B-Ru-Tm,3,Supercon,Tm1Ru3B2,MP-mp-5620,Tm1B2Ru3,B-Ru-Tm,B33.333Ru50Tm16.667,P 6/m m m,hexagonal,3.031262,5.485628002244312,5.48562696,data/final/MP/cifs/B2Ru3Tm1-MP-mp-5620.cif,data/source/MP/raw/cifs/mp-5620.cif,mp-5620,0.0,,2011-05-13 07:19:18,10.379197133208258,10.17188/1272290,"@misc{osti_1272290,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TmB2Ru3 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1272290"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695646'}},0.0,6.43332818,520.0,-48.56876464,-8.094794106666667,{'tags': ['Ruthenium thulium boride (3/1/2)']},-48.56876464,-8.094794106666667,-0.485162785,"['bandstructure', 'elasticity']",True,"[615388, 44576]",True,2021-05-12 10:56:22.739000,NM,6,8,mp-5620,,TmB2Ru3,"{'functional': 'PBE', 'labels': ['Tm_3', 'B', 'Ru_pv'], 'pot_type': 'paw'}","{'Tm': 1.0, 'B': 2.0, 'Ru': 3.0}",GGA,mp-5620,"['mp-1008066', 'mp-5620', 'mp-1001593', 'mp-1441930', 'mp-1695646', 'mp-1782104', 'mp-1012382', 'mp-1589164']",0.0099543,"{'Tm': 1.0, 'B': 2.0, 'Ru': 3.0}",78.99629142303216,[],NM,False,191,0,"[0.0, 0.0, 0.0, -0.0, -0.0, -0.0]",0.0001260097128698,0.0099543,0,0.0099543,MP,data/source/MP/cleaned/cifs/MP-mp-5620.cif,False,,data/final/MP/graphs/B2Ru3Tm1-MP-mp-5620.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Mo6Se8Yb1,1,0.0,1.0,True,Mo6Se8Yb1,Mo6Se8Yb1,6.0,Heavy_fermionChevrel,False,Mo40Se53.333Yb6.667,Mo-Se-Yb,3,Supercon,Yb1Mo6Se8,MP-mp-1103921,Yb1Mo6Se8,Mo-Se-Yb,Mo40Se53.333Yb6.667,R -3,trigonal,6.82637283,6.82637283,6.82637258,data/final/MP/cifs/Mo6Se8Yb1-MP-mp-1103921.cif,data/source/MP/raw/cifs/mp-1103921.cif,mp-1103921,0.0,,2018-07-18 20:18:04,7.207876122112935,,,{'GGA': {'task_id': 'mp-1673657'}},0.0413582060000008,4.81150279,520.0,-105.19901031,-7.013267354000001,"{'tags': ['Ytterbium molybdenum(II/III) selenide  (1/6/8)', 'Ytterbium molybdenum selenide (1/6/8)']}",-105.19901031,-7.013267354000001,-0.9596168019166668,['bandstructure'],True,"[644390, 600676]",True,2021-05-12 10:58:20.361000,NM,15,6,mp-1103921,,Yb(Mo3Se4)2,"{'functional': 'PBE', 'labels': ['Yb_2', 'Mo_pv', 'Se'], 'pot_type': 'paw'}","{'Yb': 1.0, 'Mo': 6.0, 'Se': 8.0}",GGA,mp-1103921,"['mp-1103921', 'mp-1104021', 'mp-1430393', 'mp-1673657', 'mp-1806630', 'mp-1603284']",0.0008047,"{'Yb': 1.0, 'Mo': 6.0, 'Se': 8.0}",318.005147027978,[],NM,False,148,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.530462187548188e-06,0.0008047,0,0.0008047,MP,data/source/MP/cleaned/cifs/MP-mp-1103921.cif,False,,data/final/MP/graphs/Mo6Se8Yb1-MP-mp-1103921.json,0,True,-3,0,0,0,0,0,0,2,1,0,0,0,1.0,False
Ca0.03Nd0.97Ni1O3,2,0.012,4.0,False,Ca0.12Nd3.88Ni4O12,Nd4Ni4O12,0.0,Oxide,True,Ca0.6Nd19.4Ni20O60,Ca-Nd-Ni-O,4,Supercon,Nd0.97Ca0.03Ni1O3,MP-mp-22106,Nd4Ni4O12,Nd-Ni-O,Nd20Ni20O60,P n m a,orthorhombic,5.431762,5.495849,7.709429,data/final/MP/cifs/Ca0.03Nd0.97Ni1O3-MP-mp-22106-synth_doped.cif,data/source/MP/raw/cifs/mp-22106.cif,mp-22106,0.0,,2014-02-19 13:18:08,7.242194237367626,,,{'GGA+U': {'task_id': 'mp-1701351'}},0.0,3.99854667,520.0,-131.66600273,-6.5833001365,"{'tags': ['Neodymium nickel(III) oxide', 'Dineodymium niccolate', 'Neodymium niccolate', 'Neodymium nickel oxide', 'Neodymium niccolate(III)']}",-131.66600273,-6.5833001365,-2.425267555500001,"['xas', 'bandstructure']",True,"[155746, 67725, 164825, 67724, 416213, 78319, 164562, 155747, 67723, 69788, 155748, 67722, 24875, 416212]",True,2021-05-12 10:57:01.079000,FM,20,11,mp-22106,oxide,NdNiO3,"{'functional': 'PBE', 'labels': ['Nd_3', 'Ni_pv', 'O'], 'pot_type': 'paw'}","{'Nd': 1.0, 'Ni': 1.0, 'O': 3.0}",GGA+U,mp-22106,"['mp-919926', 'mp-918860', 'mp-905914', 'mp-602303', 'mp-25591', 'mp-1189695', 'mp-22106', 'mp-1416651', 'mp-1701351', 'mp-1930748', 'mp-1599871']",1.00005245,"{'Nd': 4.0, 'Ni': 4.0, 'O': 12.0}",230.14298278419733,[],FM,True,62,1,"[0.0, 0.0, 0.0, 0.0, 1.4, 1.4, 1.4, 1.4, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0173814111193255,1.00005245,4,4.0002098,MP,data/source/MP/cleaned/cifs/MP-mp-22106.cif,True,,data/final/MP/graphs/Ca0.03Nd0.97Ni1O3-MP-mp-22106-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ir0.3Nb3Rh0.7,3,0.15,2.0,False,Ir0.6Nb6Rh1.4,Nb6Rh2,0.0,Other,True,Ir7.5Nb75Rh17.5,Ir-Nb-Rh,3,Supercon,Nb3Rh0.7Ir0.3,MP-mp-1545,Nb6Rh2,Nb-Rh,Nb75Rh25,P m -3 n,cubic,5.186072,5.186072,5.186072,data/final/MP/cifs/Ir0.3Nb3Rh0.7-MP-mp-1545-synth_doped.cif,data/source/MP/raw/cifs/mp-1545.cif,mp-1545,0.0,,2011-05-14 11:20:25,9.086567873234834,10.17188/1191190,"@misc{osti_1191190,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Rh (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191190"",
    place = ""United States"",
    year = ""2015"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700041'}},0.0,5.48706495,520.0,-77.37430008,-9.67178751,{'tags': ['Niobium rhodium (3/1)']},-77.37430008,-9.67178751,-0.2547317625000005,"['xas', 'elasticity', 'bandstructure']",True,"[105216, 645269]",True,2021-05-12 10:56:12.755000,NM,8,8,mp-1545,,Nb3Rh,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Rh_pv'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Rh': 1.0}",GGA,mp-1545,"['mp-942004', 'mp-943019', 'mp-935201', 'mp-1545', 'mp-1433570', 'mp-1700041', 'mp-1786474', 'mp-1591392']",0.00021655,"{'Nb': 6.0, 'Rh': 2.0}",139.48118416938905,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",3.1050783127424102e-06,0.00021655,0,0.0004331,MP,data/source/MP/cleaned/cifs/MP-mp-1545.cif,True,,data/final/MP/graphs/Ir0.3Nb3Rh0.7-MP-mp-1545-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
As1Fe1Gd1O0.7,3,0.1216216216216216,2.0,False,As2Fe2Gd2O1.4,As2Fe2Gd2O2,53.6,Ferrite,True,As27.027Fe27.027Gd27.027O18.918918918918916,As-Fe-Gd-O,4,Supercon,Gd1Fe1As1O0.7,MP-mp-1078679,Gd2Fe2As2O2,As-Fe-Gd-O,As25Fe25Gd25O25,P 4/n m m,tetragonal,3.996524,3.996524,9.110606,data/final/MP/cifs/As1Fe1Gd1O0.7-MP-mp-1078679-synth_doped.cif,data/source/MP/raw/cifs/mp-1078679.cif,mp-1078679,0.0,,2018-04-12 14:54:44,6.938465251324023,,,{'GGA+U': {'task_id': 'mp-1704492'}},0.2756975050000001,4.06882668,520.0,-71.78498399,-8.97312299875,{'tags': ['Gadolinium iron arsenic oxide (1/1/1/1)']},-71.78498399,-8.97312299875,-1.670570473750001,['bandstructure'],True,"[425013, 422003, 425006, 425015, 425010, 236655, 425016]",True,2021-05-12 10:58:16.596000,FM,8,10,mp-1078679,oxide,GdFeAsO,"{'functional': 'PBE', 'labels': ['Gd', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Gd': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-1078679,"['mp-1078679', 'mp-1079389', 'mp-1079927', 'mp-1080502', 'mp-1080613', 'mp-1095209', 'mp-1438268', 'mp-1704492', 'mp-1864230', 'mp-1589235']",10.7990939,"{'Gd': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",145.5164583479414,[],FM,True,129,2,"[6.9, 6.9, 3.6, 3.6, 0.0, 0.0, 0.0, 0.0]",0.1484243641248952,10.7990939,4,21.5981878,MP,data/source/MP/cleaned/cifs/MP-mp-1078679.cif,True,,data/final/MP/graphs/As1Fe1Gd1O0.7-MP-mp-1078679-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Cu1.9Gd1Li0.1Ru1Sr2O8,2,0.0142857142857142,2.0,False,Cu3.8Gd2Li0.2Ru2Sr4O16,Cu4Gd2Ru2Sr4O16,19.0,Cuprate,True,Cu13.571Gd7.143Li0.714Ru7.143Sr14.286O57.142857142857146,Cu-Gd-Li-Ru-Sr-O,6,Supercon,Ru1Sr2Gd1Cu1.9Li0.1O8,MP-mp-1194240,Sr4Gd2Cu4Ru2O16,Cu-Gd-Ru-Sr-O,Cu14.286Gd7.143Ru7.143Sr14.286O57.142857142857146,P 4/m b m,tetragonal,5.472451,5.472451,11.740702,data/final/MP/cifs/Cu1.9Gd1Li0.1Ru1Sr2O8-MP-mp-1194240-synth_doped.cif,data/source/MP/raw/cifs/mp-1194240.cif,mp-1194240,0.0,,2019-01-11 23:51:58.932000,6.504561898971391,,,{'GGA': {'task_id': 'mp-1765260'}},0.0213449239285443,3.93502801,520.0,-201.55352223,-7.198340079642857,"{'tags': ['Sr2Cu2GdRuO8 orth', 'Sr2Cu2GdRuO8', 'Ruthenium distrontium gadolinium dicopper octaoxide']}",-201.55352223,-7.198340079642857,-2.268654352380952,['bandstructure'],True,[245741],True,2021-05-12 10:58:35.561000,FiM,28,6,mp-1194240,oxide,Sr2GdCu2RuO8,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Gd', 'Cu_pv', 'Ru_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Gd': 1.0, 'Cu': 2.0, 'Ru': 1.0, 'O': 8.0}",GGA,mp-1194240,"['mp-1194240', 'mp-1396976', 'mp-1659973', 'mp-1765260', 'mp-1841948', 'mp-1638264']",4.23696715,"{'Sr': 4.0, 'Gd': 2.0, 'Cu': 4.0, 'Ru': 2.0, 'O': 16.0}",351.6072554818909,[],FiM,True,127,2,"[-0.0, -0.0, -0.0, -0.0, 6.9, 6.9, 0.0, 0.0, 0.0, 0.0, -1.8, -1.8, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0241005672319991,4.23696715,4,8.4739343,MP,data/source/MP/cleaned/cifs/MP-mp-1194240.cif,True,,data/final/MP/graphs/Cu1.9Gd1Li0.1Ru1Sr2O8-MP-mp-1194240-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ca0.15Cu1La0.85Nd1O4,2,0.0428571428571428,1.0,True,Ca0.15Cu1La0.85Nd1O4,Cu1La1Nd1O4,23.0,Cuprate,True,Ca2.143Cu14.286La12.143Nd14.286O57.142857142857146,Ca-Cu-La-Nd-O,5,Supercon,La0.85Ca0.15Nd1Cu1O4,MP-mp-1222802,La1Nd1Cu1O4,Cu-La-Nd-O,Cu14.286La14.286Nd14.286O57.142857142857146,I 4 m m,tetragonal,3.990583997710408,3.990583997710408,6.86113394,data/final/MP/cifs/Ca0.15Cu1La0.85Nd1O4-MP-mp-1222802-synth_doped.cif,data/source/MP/raw/cifs/mp-1222802.cif,mp-1222802,0.0,,2019-01-12 23:17:08.795000,6.847501059175971,,,{'GGA': {'task_id': 'mp-1757801'}},0.0221520027777764,4.77137154,520.0,-51.89321393,-7.413316275714286,{'tags': []},-51.89321393,-7.413316275714286,-3.006573275,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,7,5,mp-1222802,oxide,LaNdCuO4,"{'functional': 'PBE', 'labels': ['La', 'Nd_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 1.0, 'Nd': 1.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1222802,"['mp-1222802', 'mp-1396444', 'mp-1757801', 'mp-1797162', 'mp-1627120']",0.006009,"{'La': 1.0, 'Nd': 1.0, 'Cu': 1.0, 'O': 4.0}",99.5937875942181,[],NM,False,107,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",6.03350886149936e-05,0.006009,0,0.006009,MP,data/source/MP/cleaned/cifs/MP-mp-1222802.cif,True,,data/final/MP/graphs/Ca0.15Cu1La0.85Nd1O4-MP-mp-1222802-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,0,0,1,0,1.0,False
Al20Pr1Ti2,1,0.0,2.0,False,Al40Pr2Ti4,Al40Pr2Ti4,0.19,Heavy_fermion,True,Al86.957Pr4.348Ti8.696,Al-Pr-Ti,3,Supercon,Pr1Ti2Al20,MP-mp-1204502,Pr2Ti4Al40,Al-Pr-Ti,Al86.957Pr4.348Ti8.696,F d -3 m,cubic,10.41554005,10.41554005,10.41554005,data/final/MP/cifs/Al20Pr1Ti2-MP-mp-1204502.cif,data/source/MP/raw/cifs/mp-1204502.cif,mp-1204502,0.0,,2019-01-12 08:10:11.979000,3.226731797171163,,,,0.0,7.45447225,520.0,-201.52041554,-4.380878598695652,{'tags': ['Praseodymium titanium aluminide (1/2/20)']},-201.52041554,-4.380878598695652,-0.2294264344202894,[],False,[236258],True,2021-05-12 11:00:14.977000,NM,46,3,mp-1204502,,Pr(TiAl10)2,"{'functional': 'PBE', 'labels': ['Pr_3', 'Ti_pv', 'Al'], 'pot_type': 'paw'}","{'Pr': 1.0, 'Ti': 2.0, 'Al': 20.0}",GGA,mp-1204502,"['mp-1204502', 'mp-1377854', 'mp-1920569']",0.03437715,"{'Pr': 2.0, 'Ti': 4.0, 'Al': 40.0}",798.9698333064302,[],NM,False,227,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",8.605368705282587e-05,0.03437715,0,0.0687543,MP,data/source/MP/cleaned/cifs/MP-mp-1204502.cif,False,,data/final/MP/graphs/Al20Pr1Ti2-MP-mp-1204502.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Li1.04Ti1.96O4,2,0.0114285714285714,2.0,False,Li2.08Ti3.92O8,Li2Ti4O8,12.1,Oxide,True,Li14.857Ti28O57.142857142857146,Li-Ti-O,3,Supercon,Li1.04Ti1.96O4,MP-mp-5670,Li2Ti4O8,Li-Ti-O,Li14.286Ti28.571O57.142857142857146,F d -3 m,cubic,5.986032260000001,5.98603226,5.98603226,data/final/MP/cifs/Li1.04Ti1.96O4-MP-mp-5670-synth_doped.cif,data/source/MP/raw/cifs/mp-5670.cif,mp-5670,0.0,,2011-05-14 11:10:22,3.649565337909552,10.17188/1273637,"@misc{osti_1273637,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LiTi2O4 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1273637"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699404'}},0.0,5.03116805,520.0,-114.93444733,-8.209603380714286,"{'tags': ['Lithium titanium oxide (1/2/4)', 'Lithium titanium(III) titanium(IV) oxide', 'Lithium titanium(III) titanium oxide', 'Lithium titanium titanium(III) oxide', 'Lithium titano(III)titanate', 'Spinel-(Li,Ti)']}",-114.93444733,-8.209603380714286,-3.2462103921428564,"['bandstructure', 'elasticity']",True,"[72859, 78482, 154982, 81329, 15789, 48127]",True,2021-05-12 10:56:22.739000,NM,14,7,mp-5670,oxide,LiTi2O4,"{'functional': 'PBE', 'labels': ['Li_sv', 'Ti_pv', 'O'], 'pot_type': 'paw'}","{'Li': 1.0, 'Ti': 2.0, 'O': 4.0}",GGA,mp-5670,"['mp-923613', 'mp-922835', 'mp-908534', 'mp-5670', 'mp-1418091', 'mp-1699404', 'mp-1787951']",0.0521081,"{'Li': 2.0, 'Ti': 4.0, 'O': 8.0}",151.67086379131675,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0006871207652868,0.0521081,0,0.1042162,MP,data/source/MP/cleaned/cifs/MP-mp-5670.cif,True,,data/final/MP/graphs/Li1.04Ti1.96O4-MP-mp-5670-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Pd0.95Te2,2,0.0225988700564971,1.0,True,Pd0.95Te2,Pd1Te2,1.89,Other,True,Pd32.203Te67.797,Pd-Te,2,Supercon,Pd0.95Te2,MP-mp-782,Te2Pd1,Pd-Te,Pd33.333Te66.667,P -3 m 1,trigonal,4.116332001551086,4.11633193,5.170725,data/final/MP/cifs/Pd0.95Te2-MP-mp-782-synth_doped.cif,data/source/MP/raw/cifs/mp-782.cif,mp-782,0.0,,2011-05-12 19:10:21,7.914048115404642,10.17188/1307608,"@misc{osti_1307608,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Te2Pd (SG:164) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1307608"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671974'}},0.0,6.78872762,520.0,-12.46921459,-4.156404863333333,"{'tags': ['Merenskyite', 'Palladium(IV) telluride', 'Palladium telluride (1/2) - 2H', 'Palladium telluride (1/2)']}",-12.46921459,-4.156404863333333,-0.6155769733333329,"['xas', 'elasticity', 'bandstructure']",True,"[41387, 648995, 649013, 649016, 42555, 42554, 83642]",True,2021-05-12 10:56:31.128000,NM,3,8,mp-782,,Te2Pd,"{'functional': 'PBE', 'labels': ['Te', 'Pd'], 'pot_type': 'paw'}","{'Te': 2.0, 'Pd': 1.0}",GGA,mp-782,"['mp-908021', 'mp-923293', 'mp-922494', 'mp-782', 'mp-1442195', 'mp-1671974', 'mp-1800542', 'mp-1587195']",4.83e-05,"{'Te': 2.0, 'Pd': 1.0}",75.87572485123682,[],NM,False,164,0,"[0, 0, 0]",6.365672300949712e-07,4.83e-05,0,4.83e-05,MP,data/source/MP/cleaned/cifs/MP-mp-782.cif,True,,data/final/MP/graphs/Pd0.95Te2-MP-mp-782-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Al1Mg1Si1,1,0.0,4.0,False,Al4Mg4Si4,Al4Mg4Si4,6.0,Other,True,Al33.333Mg33.333Si33.333,Al-Mg-Si,3,Supercon,Mg1Al1Si1,MP-mp-4499,Mg4Al4Si4,Al-Mg-Si,Al33.333Mg33.333Si33.333,P n m a,orthorhombic,3.973346,6.668385,8.120398,data/final/MP/cifs/Al1Mg1Si1-MP-mp-4499.cif,data/source/MP/raw/cifs/mp-4499.cif,mp-4499,0.0,,2011-05-13 08:54:37,2.4503169092845942,10.17188/1208212,"@misc{osti_1208212,
    author = ""Persson, Kristin"",
    title = ""Materials Data on MgAlSi (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208212"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695659'}},0.0490441208333312,6.76044699,520.0,-43.55251061,-3.6293758841666666,{'tags': ['Magnesium aluminium silicide (1/1/1)']},-43.55251061,-3.6293758841666666,-0.0153192508333332,"['xas', 'elasticity', 'bandstructure']",True,"[153548, 153549]",True,2021-05-12 10:56:20.740000,NM,12,10,mp-4499,,MgAlSi,"{'functional': 'PBE', 'labels': ['Mg_pv', 'Al', 'Si'], 'pot_type': 'paw'}","{'Mg': 1.0, 'Al': 1.0, 'Si': 1.0}",GGA,mp-4499,"['mp-919716', 'mp-918764', 'mp-905746', 'mp-4499', 'mp-1163917', 'mp-1264268', 'mp-1265210', 'mp-1418064', 'mp-1695659', 'mp-1832644']",0.0005879,"{'Mg': 4.0, 'Al': 4.0, 'Si': 4.0}",215.15644836237,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.0929721223318382e-05,0.0005879,0,0.0023516,MP,data/source/MP/cleaned/cifs/MP-mp-4499.cif,False,,data/final/MP/graphs/Al1Mg1Si1-MP-mp-4499.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ce0.1La0.9P12Ru4,2,0.0117647058823529,1.0,True,Ce0.1La0.9P12Ru4,La1P12Ru4,4.8,Other,True,Ce0.588La5.294P70.588Ru23.529,Ce-La-P-Ru,4,Supercon,La0.9Ce0.1Ru4P12,MP-mp-15727,La1P12Ru4,La-P-Ru,La5.882P70.588Ru23.529,I m -3,cubic,7.024796241557287,7.02479624,7.02479624,data/final/MP/cifs/Ce0.1La0.9P12Ru4-MP-mp-15727-synth_doped.cif,data/source/MP/raw/cifs/mp-15727.cif,mp-15727,0.0,,2011-06-04 01:34:53,5.692846467357808,10.17188/1191342,"@misc{osti_1191342,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La(P3Ru)4 (SG:204) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191342"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1674189'}},0.0,8.3313753,520.0,-118.66109886,-6.980064638823529,{'tags': ['Lanthanum ruthenium phosphide (1/4/12)']},-118.66109886,-6.980064638823529,-0.6863472385294116,"['xas', 'bandstructure']",True,"[50596, 641633]",True,2021-05-12 10:56:53.126000,NM,17,7,mp-15727,,La(P3Ru)4,"{'functional': 'PBE', 'labels': ['La', 'P', 'Ru_pv'], 'pot_type': 'paw'}","{'La': 1.0, 'P': 12.0, 'Ru': 4.0}",GGA,mp-15727,"['mp-994000', 'mp-992442', 'mp-15727', 'mp-1419602', 'mp-1674189', 'mp-995090', 'mp-1600306']",0.0007731,"{'La': 1.0, 'P': 12.0, 'Ru': 4.0}",266.8574331210477,[],NM,False,204,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",2.8970525233573632e-06,0.0007731,0,0.0007731,MP,data/source/MP/cleaned/cifs/MP-mp-15727.cif,True,,data/final/MP/graphs/Ce0.1La0.9P12Ru4-MP-mp-15727-synth_doped.json,0,True,m-3,2,0,0,0,0,0,0,0,0,1,0,1.0,False
Ge2Rh2U1,1,0.0,2.0,False,Ge4Rh4U2,Ge4Rh4U2,1.1,Heavy_fermion,True,Ge40Rh40U20,Ge-Rh-U,3,Supercon,U1Rh2Ge2,MP-mp-1079648,U2Ge4Rh4,Ge-Rh-U,Ge40Rh40U20,P 4/n m m,tetragonal,4.204453,4.204453,10.180361,data/final/MP/cifs/Ge2Rh2U1-MP-mp-1079648.cif,data/source/MP/raw/cifs/mp-1079648.cif,mp-1079648,0.0,,2018-04-15 20:46:36,10.87177888655562,,,{'GGA': {'task_id': 'mp-1701738'}},0.0182756995000019,7.49479058,520.0,-75.95084055,-7.595084054999999,{'tags': ['Rhodium uranium germanide (2/1/2)']},-75.95084055,-7.595084054999999,-0.5418677629999991,['bandstructure'],True,"[637718, 603847]",True,2021-05-12 10:58:16.596000,FM,10,6,mp-1079648,,U(GeRh)2,"{'functional': 'PBE', 'labels': ['U', 'Ge_d', 'Rh_pv'], 'pot_type': 'paw'}","{'U': 1.0, 'Ge': 2.0, 'Rh': 2.0}",GGA,mp-1079648,"['mp-1079648', 'mp-1079961', 'mp-1435838', 'mp-1701738', 'mp-1829981', 'mp-1600681']",2.41324205,"{'U': 2.0, 'Ge': 4.0, 'Rh': 4.0}",179.96256834778316,[],FM,True,129,1,"[2.2, 2.2, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0268193777423351,2.41324205,2,4.8264841,MP,data/source/MP/cleaned/cifs/MP-mp-1079648.cif,False,,data/final/MP/graphs/Ge2Rh2U1-MP-mp-1079648.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B2Ca1Rh2,1,0.0,2.0,False,B4Ca2Rh4,B4Ca2Rh4,0.0,Other,True,B40Ca20Rh40,B-Ca-Rh,3,Supercon,Ca1Rh2B2,MP-mp-8431,Ca2B4Rh4,B-Ca-Rh,B40Ca20Rh40,F d d d,orthorhombic,5.518469963090888,5.51846996,6.092047250000001,data/final/MP/cifs/B2Ca1Rh2-MP-mp-8431.cif,data/source/MP/raw/cifs/mp-8431.cif,mp-8431,0.0,,2011-05-30 07:12:46,6.045786896913553,10.17188/1308100,"@misc{osti_1308100,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ca(BRh)2 (SG:70) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1308100"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700198'}},0.0,5.22377101,520.0,-66.18785107,-6.618785106999999,{'tags': ['Calcium dirhodium(II) diboride']},-66.18785107,-6.618785106999999,-0.6001852746666657,"['bandstructure', 'elasticity']",True,[49737],True,2021-05-12 10:56:31.128000,NM,10,8,mp-8431,,Ca(BRh)2,"{'functional': 'PBE', 'labels': ['Ca_sv', 'B', 'Rh_pv'], 'pot_type': 'paw'}","{'Ca': 1.0, 'B': 2.0, 'Rh': 2.0}",GGA,mp-8431,"['mp-8431', 'mp-907664', 'mp-922028', 'mp-922257', 'mp-1421856', 'mp-1700198', 'mp-1780957', 'mp-1600514']",0.00081645,"{'Ca': 2.0, 'B': 4.0, 'Rh': 4.0}",146.9494290220545,[],NM,False,70,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.111198601360289e-05,0.00081645,0,0.0016329,MP,data/source/MP/cleaned/cifs/MP-mp-8431.cif,False,,data/final/MP/graphs/B2Ca1Rh2-MP-mp-8431.json,0,True,mmm,0,0,0,7,0,0,0,0,0,0,1,1.0,False
Ba1.98Cu4La0.02Y1O8,2,0.0026666666666666,1.0,True,Ba1.98Cu4La0.02Y1O8,Ba2Cu4Y1O8,74.3,Cuprate,True,Ba13.2Cu26.667La0.133Y6.667O53.333333333333336,Ba-Cu-La-Y-O,5,Supercon,Y1Ba1.98La0.02Cu4O8,MP-mp-6790,Ba2Y1Cu4O8,Ba-Cu-Y-O,Ba13.333Cu26.667Y6.667O53.333333333333336,C m m m,orthorhombic,3.889922,3.899603999537882,13.88942687,data/final/MP/cifs/Ba1.98Cu4La0.02Y1O8-MP-mp-6790-synth_doped.cif,data/source/MP/raw/cifs/mp-6790.cif,mp-6790,0.0,,2011-05-16 03:21:24,5.936250568336678,10.17188/1283441,"@misc{osti_1283441,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Y(CuO2)4 (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1283441"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686864'}},0.0,3.31391536,520.0,-91.58381472,-6.105587648,"{'tags': ['Yttrium barium copper oxide (1/2/4/8)', 'High pressure experimental phase']}",-91.58381472,-6.105587648,-2.0529924817777783,"['xas', 'bandstructure']",True,"[72261, 85273, 74251, 400273, 85277, 85275, 400280, 67632, 85272, 67631, 83920, 66613, 85279, 400277, 75689, 74259, 85278, 85280, 66603, 94265, 400276, 88873, 71417, 75712, 97052, 66605, 72258, 85281, 85274, 400279, 66604, 69698]",True,2021-05-12 10:57:34.594000,NM,15,10,mp-6790,oxide,Ba2Y(CuO2)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-6790,"['mp-1000664', 'mp-6790', 'mp-1007136', 'mp-1237713', 'mp-1440937', 'mp-1686864', 'mp-1834179', 'mp-1011883', 'mp-1590064', 'mp-1590433']",0.0004643,"{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",208.60454115924333,[],NM,False,65,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.225742533790601e-06,0.0004643,0,0.0004643,MP,data/source/MP/cleaned/cifs/MP-mp-6790.cif,True,,data/final/MP/graphs/Ba1.98Cu4La0.02Y1O8-MP-mp-6790-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
C0.985Nb1,2,0.0075566750629723,1.0,True,C0.985Nb1,C1Nb1,12.0,Other,True,C49.622Nb50.378,C-Nb,2,Supercon,C0.985Nb1,MP-mp-910,Nb1C1,C-Nb,C50Nb50,F m -3 m,cubic,3.18634336,3.1863433599999995,3.1863433599999995,data/final/MP/cifs/C0.985Nb1-MP-mp-910-synth_doped.cif,data/source/MP/raw/cifs/mp-910.cif,mp-910,0.0,,2011-05-12 17:28:40,7.616098778357742,10.17188/1282001,"@misc{osti_1282001,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbC (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1282001"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686610'}},0.0408750508333302,7.39992982,520.0,-20.24633413,-10.123167065,"{'tags': ['Niobium carbide (1/1)', 'Niobium carbide (1/1) - RS-type']}",-20.24633413,-10.123167065,-0.4591241950000011,"['xas', 'elasticity', 'bandstructure']",True,"[618465, 77214, 187077, 618456, 181792, 618453, 94449, 618472, 183163, 237582, 618457, 159872, 618480, 618475, 618482, 618469, 155164, 618466, 44355, 618450, 618458, 618449, 44496, 618463, 618462, 618460, 618481, 618471, 618476, 181052, 601142, 618448, 189089, 618478, 26955, 618473, 618484, 618483]",True,2021-05-12 10:56:35.166000,NM,2,25,mp-910,,NbC,"{'functional': 'PBE', 'labels': ['Nb_pv', 'C'], 'pot_type': 'paw'}","{'Nb': 1.0, 'C': 1.0}",GGA,mp-910,"['mp-1000444', 'mp-1001333', 'mp-910', 'mp-1057158', 'mp-1057178', 'mp-1057130', 'mp-1057651', 'mp-1057669', 'mp-1057682', 'mp-1057771', 'mp-1057779', 'mp-1057802', 'mp-1060960', 'mp-1060978', 'mp-1061015', 'mp-1440938', 'mp-1686610', 'mp-1805660', 'mp-1007673', 'mp-1593845', 'mp-1596940', 'mp-1061007', 'mp-1057677', 'mp-1057792', 'mp-1057174']",3.33e-05,"{'Nb': 1.0, 'C': 1.0}",22.87508541625878,[],NM,False,225,0,"[0, 0]",1.4557322691495426e-06,3.33e-05,0,3.33e-05,MP,data/source/MP/cleaned/cifs/MP-mp-910.cif,True,,data/final/MP/graphs/C0.985Nb1-MP-mp-910-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Al3Os2,3,0.1333333333333333,0.5,False,Al1.5Os1,Al2Os1,0.0,Other,True,Al60Os40,Al-Os,2,Supercon,Al3Os2,MP-mp-7188,Al2Os1,Al-Os,Al66.667Os33.333,I 4/m m m,tetragonal,3.1838079989825228,3.1838079989825228,4.7370304,data/final/MP/cifs/Al3Os2-MP-mp-7188-synth_doped.cif,data/source/MP/raw/cifs/mp-7188.cif,mp-7188,0.3106000000000009,,2011-05-27 16:38:41,9.597862886389052,10.17188/1287101,"@misc{osti_1287101,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Al2Os (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1287101"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-662842'}},0.0,9.05033514,520.0,-20.40479948,-6.801599826666667,{'tags': ['Aluminium osmium (2/1)']},-20.40479948,-6.801599826666667,-0.5620938550000005,"['diel', 'bandstructure', 'elasticity', 'phonons']",True,[58108],True,2021-05-12 10:56:29.056000,NM,3,9,mp-7188,,Al2Os,"{'functional': 'PBE', 'labels': ['Al', 'Os_pv'], 'pot_type': 'paw'}","{'Al': 2.0, 'Os': 1.0}",GGA,mp-7188,"['mp-662842', 'mp-7188', 'mp-658200', 'mp-678015', 'mp-1141925', 'mp-1251514', 'mp-1437952', 'mp-1794211', 'mp-1591652']",6e-06,"{'Al': 2.0, 'Os': 1.0}",42.24817016910164,[],NM,False,139,0,"[0, 0, 0]",1.420179850626554e-07,6e-06,0,6e-06,MP,data/source/MP/cleaned/cifs/MP-mp-7188.cif,True,,data/final/MP/graphs/Al3Os2-MP-mp-7188-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Al1Nb2.88Ti0.12,3,0.06,2.0,False,Al2Nb5.76Ti0.24,Al2Nb6,15.0,Other,True,Al25Nb72Ti3,Al-Nb-Ti,3,Supercon,Nb2.88Ti0.12Al1,MP-mp-796,Nb6Al2,Al-Nb,Al25Nb75,P m -3 n,cubic,5.215254,5.215254,5.215254,data/final/MP/cifs/Al1Nb2.88Ti0.12-MP-mp-796-synth_doped.cif,data/source/MP/raw/cifs/mp-796.cif,mp-796,0.0,,2011-05-13 16:07:37,7.157298025966356,,,{'GGA': {'task_id': 'mp-1686893'}},0.0460773865000003,5.52947534,520.0,-69.48918494,-8.6861481175,"{'tags': ['Aluminium niobium (1/3)', 'Niobium aluminide (3/1)', 'Aluminum niobium (1/3)']}",-69.48918494,-8.6861481175,-0.1737753800000003,"['bandstructure', 'elasticity']",True,"[608675, 608654, 608688, 608668, 608669, 608685, 608676, 608683, 58014, 608657, 107856, 608655, 608666, 608691, 608656, 608665, 608673, 608653, 608661]",True,2021-05-12 10:56:31.128000,NM,8,10,mp-796,,Nb3Al,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Al': 1.0}",GGA,mp-796,"['mp-911586', 'mp-927906', 'mp-796', 'mp-927472', 'mp-1260512', 'mp-1440919', 'mp-1686893', 'mp-1927652', 'mp-1591599', 'mp-1587739']",0.16323955,"{'Nb': 6.0, 'Al': 2.0}",141.8490379078192,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0023015954483396,0.16323955,0,0.3264791,MP,data/source/MP/cleaned/cifs/MP-mp-796.cif,True,,data/final/MP/graphs/Al1Nb2.88Ti0.12-MP-mp-796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
As1Ca1F1Fe0.8Ni0.2,3,0.0999999999999999,2.0,False,As2Ca2F2Fe1.6Ni0.4,As2Ca2F2Fe2,3.92,Ferrite,True,As25Ca25F25Fe20Ni5,As-Ca-F-Fe-Ni,5,Supercon,Ca1Fe0.8Ni0.2As1F1,MP-mp-1079859,Ca2Fe2As2F2,As-Ca-F-Fe,As25Ca25F25Fe25,P m m n,orthorhombic,3.933336,3.981276,9.018918,data/final/MP/cifs/As1Ca1F1Fe0.8Ni0.2-MP-mp-1079859-synth_doped.cif,data/source/MP/raw/cifs/mp-1079859.cif,mp-1079859,0.0,,2018-04-16 14:43:21,4.464120586611354,,,{'GGA+U': {'task_id': 'mp-1695365'}},0.2859614887499973,4.27317878,520.0,-41.71531675,-5.21441459375,"{'tags': ['Calcium iron arsenide fluoride', 'High pressure experimental phase']}",-41.71531675,-5.21441459375,-1.632363168125,['bandstructure'],True,[186505],True,2021-05-12 10:58:16.596000,FM,8,6,mp-1079859,,CaFeAsF,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Fe_pv', 'As', 'F'], 'pot_type': 'paw'}","{'Ca': 1.0, 'Fe': 1.0, 'As': 1.0, 'F': 1.0}",GGA+U,mp-1079859,"['mp-1079859', 'mp-1475687', 'mp-1695365', 'mp-1785040', 'mp-1938652', 'mp-1594699']",3.7150606,"{'Ca': 2.0, 'Fe': 2.0, 'As': 2.0, 'F': 2.0}",141.2335160836522,[],FM,True,59,1,"[0.0, 0.0, 3.6, 3.6, 0.0, 0.0, 0.0, 0.0]",0.0526087674231601,3.7150606,2,7.4301212,MP,data/source/MP/cleaned/cifs/MP-mp-1079859.cif,True,,data/final/MP/graphs/As1Ca1F1Fe0.8Ni0.2-MP-mp-1079859-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Cu1La2O4.05,2,0.006079027355623,0.9877181069958848,True,Cu0.988La1.975O4,Cu1La2O4,32.0,Cuprate,True,Cu14.184La28.369O57.4468085106383,Cu-La-O,3,Supercon,La2Cu1O4.05,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La2O4.05-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La2O4.05-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As1Co0.05Fe0.95Pr1O1,2,0.025,2.0,False,As2Co0.1Fe1.9Pr2O2,As2Fe2Pr2O2,6.14,Ferrite,True,As25Co1.25Fe23.75Pr25O25,As-Co-Fe-Pr-O,5,Supercon,Pr1Fe0.95Co0.05As1O1,MP-mp-22491,Pr2Fe2As2O2,As-Fe-Pr-O,As25Fe25Pr25O25,P 4/n m m,tetragonal,4.094889,4.094889,9.258722,data/final/MP/cifs/As1Co0.05Fe0.95Pr1O1-MP-mp-22491-synth_doped.cif,data/source/MP/raw/cifs/mp-22491.cif,mp-22491,0.0,,2014-02-25 19:17:30,6.153806906111091,,,{'GGA+U': {'task_id': 'mp-1695715'}},0.3808778432291664,4.12348168,520.0,-51.7633941,-6.4704242625,{'tags': ['Praseodymium iron arsenic oxide (1/1/1/1)']},-51.7633941,-6.4704242625,-1.491677511249999,"['xas', 'bandstructure']",True,"[162830, 162833, 246832, 90316, 422000, 236649, 236648, 602491]",True,2021-05-12 10:57:10.838000,FM,8,8,mp-22491,oxide,PrFeAsO,"{'functional': 'PBE', 'labels': ['Pr_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Pr': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-22491,"['mp-510622', 'mp-1079608', 'mp-1079857', 'mp-22491', 'mp-1476145', 'mp-1695715', 'mp-1778524', 'mp-1596397']",3.7947681,"{'Pr': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",155.25132378854377,[],FM,True,129,1,"[0.0, 0.0, 3.5, 3.5, 0.0, 0.0, 0.0, 0.0]",0.0488854846116297,3.7947681,2,7.5895362,MP,data/source/MP/cleaned/cifs/MP-mp-22491.cif,True,,data/final/MP/graphs/As1Co0.05Fe0.95Pr1O1-MP-mp-22491-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B2Dy0.1Lu0.9Ru1,2,0.0499999999999999,4.0,False,B8Dy0.4Lu3.6Ru4,B8Lu4Ru4,7.34,Other,True,B50Dy2.5Lu22.5Ru25,B-Dy-Lu-Ru,4,Supercon,Lu0.9Dy0.1Ru1B2,MP-mp-29239,Lu4B8Ru4,B-Lu-Ru,B50Lu25Ru25,P n m a,orthorhombic,5.262881,5.829858,6.288542,data/final/MP/cifs/B2Dy0.1Lu0.9Ru1-MP-mp-29239-synth_doped.cif,data/source/MP/raw/cifs/mp-29239.cif,mp-29239,0.0,,2014-02-24 06:45:28,10.246997128776938,10.17188/1203618,"@misc{osti_1203618,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LuB2Ru (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1203618"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677301'}},0.0,6.02142224,520.0,-119.30016105,-7.456260065625,"{'tags': ['Lutetium ruthenium(III) boride', 'Lutetium ruthenium boride (1/1/2)']}",-119.30016105,-7.456260065625,-0.6677291364583331,"['xas', 'bandstructure']",True,"[614715, 100774]",True,2021-05-12 10:57:03.017000,NM,16,8,mp-29239,,LuB2Ru,"{'functional': 'PBE', 'labels': ['Lu_3', 'B', 'Ru_pv'], 'pot_type': 'paw'}","{'Lu': 1.0, 'B': 2.0, 'Ru': 1.0}",GGA,mp-29239,"['mp-909473', 'mp-925177', 'mp-924466', 'mp-29239', 'mp-1381674', 'mp-1677301', 'mp-1784701', 'mp-1603819']",4.565e-05,"{'Lu': 4.0, 'B': 8.0, 'Ru': 4.0}",192.9440954509509,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",9.4638812124945e-07,4.565e-05,0,0.0001826,MP,data/source/MP/cleaned/cifs/MP-mp-29239.cif,True,,data/final/MP/graphs/B2Dy0.1Lu0.9Ru1-MP-mp-29239-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Hf1Ru1,1,0.0,1.0,True,Hf1Ru1,Hf1Ru1,0.0,Other,True,Hf50Ru50,Hf-Ru,2,Supercon,Hf1Ru1,MP-mp-2802,Hf1Ru1,Hf-Ru,Hf50Ru50,P m -3 m,cubic,3.244216,3.244216,3.244216,data/final/MP/cifs/Hf1Ru1-MP-mp-2802.cif,data/source/MP/raw/cifs/mp-2802.cif,mp-2802,0.0,,2011-05-12 19:34:45,13.595489341688484,10.17188/1202155,"@misc{osti_1202155,
    author = ""Persson, Kristin"",
    title = ""Materials Data on HfRu (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1202155"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-928991'}},0.0,6.76135166,520.0,-20.88034947,-10.440174735,{'tags': ['Hafnium ruthenium (1/1)']},-20.88034947,-10.440174735,-0.8243854824999985,"['xas', 'elasticity', 'bandstructure']",True,"[638837, 104268]",True,2021-05-12 10:56:18.721000,NM,2,7,mp-2802,,HfRu,"{'functional': 'PBE', 'labels': ['Hf_pv', 'Ru_pv'], 'pot_type': 'paw'}","{'Hf': 1.0, 'Ru': 1.0}",GGA,mp-2802,"['mp-929353', 'mp-928991', 'mp-912529', 'mp-2802', 'mp-1440181', 'mp-1794265', 'mp-1587685']",1.61e-05,"{'Hf': 1.0, 'Ru': 1.0}",34.145170489394275,[],NM,False,221,0,"[0, 0]",4.7151616961469764e-07,1.61e-05,0,1.61e-05,MP,data/source/MP/cleaned/cifs/MP-mp-2802.cif,False,,data/final/MP/graphs/Hf1Ru1-MP-mp-2802.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Be13Th0.052U0.948,2,0.0074285714285714,2.0,False,Be26Th0.104U1.896,Be26U2,0.38,Heavy_fermion,True,Be92.857Th0.371U6.771,Be-Th-U,3,Supercon,U0.948Th0.052Be13,MP-mp-1163,U2Be26,Be-U,Be92.857U7.143,F m -3 c,cubic,7.174675929999999,7.174675929999999,7.174675929999999,data/final/MP/cifs/Be13Th0.052U0.948-MP-mp-1163-synth_doped.cif,data/source/MP/raw/cifs/mp-1163.cif,mp-1163,0.0,,2011-05-15 13:39:09,4.516943134220159,10.17188/1188115,"@misc{osti_1188115,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UBe13 (SG:226) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1188115"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1676276'}},0.0,5.60901004,520.0,-121.44122023,-4.337186436785714,"{'tags': ['Uranium beryllium (1/13)', 'Beryllium uranium (13/1)']}",-121.44122023,-4.337186436785714,-0.0583452042857146,"['xas', 'bandstructure']",True,"[616470, 58748, 616481, 58747, 58749, 659562, 107528, 600563, 58750, 616488, 58751]",True,2021-05-12 10:56:51.169000,NM,28,8,mp-1163,,UBe13,"{'functional': 'PBE', 'labels': ['U', 'Be_sv'], 'pot_type': 'paw'}","{'U': 1.0, 'Be': 13.0}",GGA,mp-1163,"['mp-1163', 'mp-906858', 'mp-920459', 'mp-921486', 'mp-1381018', 'mp-1676276', 'mp-1775695', 'mp-1603627']",0.0460573,"{'U': 2.0, 'Be': 26.0}",261.15110606061,[],NM,False,226,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0003527252914587,0.0460573,0,0.0921146,MP,data/source/MP/cleaned/cifs/MP-mp-1163.cif,True,,data/final/MP/graphs/Be13Th0.052U0.948-MP-mp-1163-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
B2C1Fe0.12Ni1.88Tm1,2,0.04,1.0,True,B2C1Fe0.12Ni1.88Tm1,B2C1Ni2Tm1,5.52,Other,True,B33.333C16.667Fe2Ni31.333Tm16.667,B-C-Fe-Ni-Tm,5,Supercon,Tm1Ni1.88Fe0.12B2C1,MP-mp-6754,Tm1Ni2B2C1,B-C-Ni-Tm,B33.333C16.667Ni33.333Tm16.667,I 4/m m m,tetragonal,3.4928639994202824,3.492863999420283,5.7937603300000005,data/final/MP/cifs/B2C1Fe0.12Ni1.88Tm1-MP-mp-6754-synth_doped.cif,data/source/MP/raw/cifs/mp-6754.cif,mp-6754,0.0,,2011-05-13 04:35:22,8.309262229712736,10.17188/1282688,"@misc{osti_1282688,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TmNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1282688"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696752'}},0.0,6.71149537,520.0,-41.76249282,-6.96041547,{'tags': []},-41.76249282,-6.96041547,-0.5234699658333332,"['xas', 'elasticity', 'bandstructure']",True,"[79577, 56652, 164574]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-6754,,TmNi2B2C,"{'functional': 'PBE', 'labels': ['Tm_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Tm': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6754,"['mp-6754', 'mp-1000684', 'mp-1007145', 'mp-1412917', 'mp-1696752', 'mp-1790753', 'mp-1011888', 'mp-1590290']",0.0028138,"{'Tm': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",63.94016944835002,[],NM,False,139,0,"[0.0, -0.0, -0.0, 0.0, 0.0, 0.0]",4.40067648283752e-05,0.0028138,0,0.0028138,MP,data/source/MP/cleaned/cifs/MP-mp-6754.cif,True,,data/final/MP/graphs/B2C1Fe0.12Ni1.88Tm1-MP-mp-6754-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Al0.967Ga0.033Nb3,2,0.0165,2.0,False,Al1.934Ga0.066Nb6,Al2Nb6,19.0,Other,True,Al24.175Ga0.825Nb75,Al-Ga-Nb,3,Supercon,Nb3Al0.967Ga0.033,MP-mp-796,Nb6Al2,Al-Nb,Al25Nb75,P m -3 n,cubic,5.215254,5.215254,5.215254,data/final/MP/cifs/Al0.967Ga0.033Nb3-MP-mp-796-synth_doped.cif,data/source/MP/raw/cifs/mp-796.cif,mp-796,0.0,,2011-05-13 16:07:37,7.157298025966356,,,{'GGA': {'task_id': 'mp-1686893'}},0.0460773865000003,5.52947534,520.0,-69.48918494,-8.6861481175,"{'tags': ['Aluminium niobium (1/3)', 'Niobium aluminide (3/1)', 'Aluminum niobium (1/3)']}",-69.48918494,-8.6861481175,-0.1737753800000003,"['bandstructure', 'elasticity']",True,"[608675, 608654, 608688, 608668, 608669, 608685, 608676, 608683, 58014, 608657, 107856, 608655, 608666, 608691, 608656, 608665, 608673, 608653, 608661]",True,2021-05-12 10:56:31.128000,NM,8,10,mp-796,,Nb3Al,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Al'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Al': 1.0}",GGA,mp-796,"['mp-911586', 'mp-927906', 'mp-796', 'mp-927472', 'mp-1260512', 'mp-1440919', 'mp-1686893', 'mp-1927652', 'mp-1591599', 'mp-1587739']",0.16323955,"{'Nb': 6.0, 'Al': 2.0}",141.8490379078192,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0023015954483396,0.16323955,0,0.3264791,MP,data/source/MP/cleaned/cifs/MP-mp-796.cif,True,,data/final/MP/graphs/Al0.967Ga0.033Nb3-MP-mp-796-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Re0.35W0.65,2,0.0333333333333332,3.0,False,Re1.05W1.95,Re1W2,6.75,Other,True,Re35W65,Re-W,2,Supercon,Re0.35W0.65,MP-mp-1219490,Re1W2,Re-W,Re33.333W66.667,F m m m,orthorhombic,2.7433461908291847,2.74334619,6.91553091,data/final/MP/cifs/Re0.35W0.65-MP-mp-1219490-synth_doped.cif,data/source/MP/raw/cifs/mp-1219490.cif,mp-1219490,0.0,,2019-01-12 20:29:13.511000,19.29240960912995,,,{'GGA': {'task_id': 'mp-1735711'}},0.0646764416666645,7.58580073,520.0,-38.1667508,-12.722250266666668,{'tags': []},-38.1667508,-12.722250266666668,0.0646764416666651,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,3,5,mp-1219490,,ReW2,"{'functional': 'PBE', 'labels': ['Re_pv', 'W_pv'], 'pot_type': 'paw'}","{'Re': 1.0, 'W': 2.0}",GGA,mp-1219490,"['mp-1219490', 'mp-1430360', 'mp-1735711', 'mp-1793084', 'mp-1612596']",0.0014807,"{'Re': 1.0, 'W': 2.0}",47.67424187109373,[],NM,False,69,0,"[0, 0, 0]",3.105870050338003e-05,0.0014807,0,0.0014807,MP,data/source/MP/cleaned/cifs/MP-mp-1219490.cif,True,,data/final/MP/graphs/Re0.35W0.65-MP-mp-1219490-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,0,0,1,1.0,False
Ir0.43Ru0.57,3,0.1399999999999999,2.0,False,Ir0.86Ru1.14,Ir1Ru1,0.18,Other,True,Ir43Ru57,Ir-Ru,2,Supercon,Ir0.43Ru0.57,MP-mp-974421,Ir1Ru1,Ir-Ru,Ir50Ru50,P -6 m 2,hexagonal,2.7450599956986865,2.7450602600000003,4.363817,data/final/MP/cifs/Ir0.43Ru0.57-MP-mp-974421-synth_doped.cif,data/source/MP/raw/cifs/mp-974421.cif,mp-974421,0.0,,2015-09-16 23:34:28,17.10176799806812,10.17188/1314489,"@misc{osti_1314489,
    author = ""Persson, Kristin"",
    title = ""Materials Data on RuIr (SG:187) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1314489"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1674544'}},0.0062945618749985,9.25026202,520.0,-18.19942888,-9.09971444,{'tags': []},-18.19942888,-9.09971444,-0.0433044024999986,"['xas', 'bandstructure']",True,[],True,2021-05-12 10:57:55.580000,NM,2,8,mp-974421,,IrRu,"{'functional': 'PBE', 'labels': ['Ir', 'Ru_pv'], 'pot_type': 'paw'}","{'Ir': 1.0, 'Ru': 1.0}",GGA,mp-974421,"['mp-974421', 'mp-974483', 'mp-974476', 'mp-1382215', 'mp-1674544', 'mp-1930881', 'mp-974487', 'mp-1630205']",0.0001316,"{'Ir': 1.0, 'Ru': 1.0}",28.4774370276178,[],NM,False,187,0,"[0, 0]",4.6212023881353005e-06,0.0001316,0,0.0001316,MP,data/source/MP/cleaned/cifs/MP-mp-974421.cif,True,,data/final/MP/graphs/Ir0.43Ru0.57-MP-mp-974421-synth_doped.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
Sc1Se1,1,0.0,1.0,True,Sc1Se1,Sc1Se1,0.0,Other,True,Sc50Se50,Sc-Se,2,Supercon,Sc1Se1,MP-mp-1782,Sc1Se1,Sc-Se,Sc50Se50,F m -3 m,cubic,3.87477121,3.87477121,3.87477121,data/final/MP/cifs/Sc1Se1-MP-mp-1782.cif,data/source/MP/raw/cifs/mp-1782.cif,mp-1782,0.0,,2011-05-12 18:04:31,5.002107021173253,10.17188/1192713,"@misc{osti_1192713,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ScSe (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1192713"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672077'}},0.0,6.47011655,520.0,-13.00615437,-6.503077185,{'tags': ['Scandium selenide (1/1)']},-13.00615437,-6.503077185,-1.8248868936718745,"['xas', 'elasticity', 'bandstructure']",True,"[44972, 651805]",True,2021-05-12 10:56:14.760000,NM,2,8,mp-1782,,ScSe,"{'functional': 'PBE', 'labels': ['Sc_sv', 'Se'], 'pot_type': 'paw'}","{'Sc': 1.0, 'Se': 1.0}",GGA,mp-1782,"['mp-1000800', 'mp-1007255', 'mp-1782', 'mp-1439205', 'mp-1672077', 'mp-1794775', 'mp-1011999', 'mp-1596444']",0.0026589,"{'Sc': 1.0, 'Se': 1.0}",41.13610763991704,[],NM,False,225,0,"[0, 0]",6.463664533539621e-05,0.0026589,0,0.0026589,MP,data/source/MP/cleaned/cifs/MP-mp-1782.cif,False,,data/final/MP/graphs/Sc1Se1-MP-mp-1782.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Cu30Sn70,3,0.1,0.0666690476190476,False,Cu2Sn4.667,Cu2Sn6,4.91,Other,True,Cu30Sn70,Cu-Sn,2,Supercon,Cu30Sn70,MP-mp-1184173,Cu2Sn6,Cu-Sn,Cu25Sn75,P 63/m m c,hexagonal,5.004808,6.622883998810204,6.62288418,data/final/MP/cifs/Cu30Sn70-MP-mp-1184173-synth_doped.cif,data/source/MP/raw/cifs/mp-1184173.cif,mp-1184173,0.0,,2019-01-11 12:35:19.801000,7.331297805247819,,,{'GGA': {'task_id': 'mp-1752005'}},0.2376003362499998,7.78412286,520.0,-30.44828701,-3.80603587625,{'tags': []},-30.44828701,-3.80603587625,0.2259446824999997,['bandstructure'],True,[],True,2021-05-12 10:58:27.755000,NM,8,5,mp-1184173,,CuSn3,"{'functional': 'PBE', 'labels': ['Cu_pv', 'Sn_d'], 'pot_type': 'paw'}","{'Cu': 1.0, 'Sn': 3.0}",GGA,mp-1184173,"['mp-1184173', 'mp-1401514', 'mp-1752005', 'mp-1834353', 'mp-1622532']",0.0003779,"{'Cu': 2.0, 'Sn': 6.0}",190.1132410186861,[],NM,False,187,0,"[0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",3.975525302447045e-06,0.0003779,0,0.0007558,MP,data/source/MP/cleaned/cifs/MP-mp-1184173.cif,True,,data/final/MP/graphs/Cu30Sn70-MP-mp-1184173-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Th0.25Zr0.75,1,0.0,4.0,False,Th1Zr3,Th1Zr3,6.29,Other,True,Th25Zr75,Th-Zr,2,Supercon,Th0.25Zr0.75,MP-mp-1217289,Th1Zr3,Th-Zr,Th25Zr75,P -6 m 2,hexagonal,3.31248600203001,3.3124859800000004,10.784718,data/final/MP/cifs/Th0.25Zr0.75-MP-mp-1217289.cif,data/source/MP/raw/cifs/mp-1217289.cif,mp-1217289,0.0,,2019-01-12 18:39:04.689000,8.194135971359845,,,{'GGA': {'task_id': 'mp-1760960'}},0.0674665574999977,5.25400406,520.0,-32.78709391,-8.1967734775,{'tags': []},-32.78709391,-8.1967734775,0.0674665574999977,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,4,5,mp-1217289,,ThZr3,"{'functional': 'PBE', 'labels': ['Th', 'Zr_sv'], 'pot_type': 'paw'}","{'Th': 1.0, 'Zr': 3.0}",GGA,mp-1217289,"['mp-1217289', 'mp-1413087', 'mp-1760960', 'mp-1797537', 'mp-1615680']",0.0003724,"{'Th': 1.0, 'Zr': 3.0}",102.48198393799296,[],NM,False,187,0,"[0, 0, 0, 0]",3.633809433522694e-06,0.0003724,0,0.0003724,MP,data/source/MP/cleaned/cifs/MP-mp-1217289.cif,False,,data/final/MP/graphs/Th0.25Zr0.75-MP-mp-1217289.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
B0.57Nb0.43,3,0.1399999999999999,4.0,False,B2.28Nb1.72,B2Nb2,0.0,Other,True,B57Nb43,B-Nb,2,Supercon,B0.57Nb0.43,MP-mp-2580,Nb2B2,B-Nb,B50Nb50,C m c m,orthorhombic,3.182971,3.317732000142166,4.6933521,data/final/MP/cifs/B0.57Nb0.43-MP-mp-2580-synth_doped.cif,data/source/MP/raw/cifs/mp-2580.cif,mp-2580,0.0,,2011-05-12 20:12:32,7.42935944108271,10.17188/1201056,"@misc{osti_1201056,
    author = ""Persson, Kristin"",
    title = ""Materials Data on NbB (SG:63) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201056"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687766'}},0.0,6.64786064,520.0,-36.63877428,-9.15969357,"{'tags': ['Niobium(III) boride', 'Niobium boride (1/1)']}",-36.63877428,-9.15969357,-0.7693451645833331,"['xas', 'elasticity', 'bandstructure']",True,"[42953, 614903, 656210, 614895, 614885, 191899]",True,2021-05-12 10:56:18.721000,NM,4,12,mp-2580,,NbB,"{'functional': 'PBE', 'labels': ['Nb_pv', 'B'], 'pot_type': 'paw'}","{'Nb': 1.0, 'B': 1.0}",GGA,mp-2580,"['mp-925850', 'mp-924903', 'mp-909890', 'mp-2580', 'mp-1066877', 'mp-1067004', 'mp-1066914', 'mp-1440004', 'mp-1687766', 'mp-1791101', 'mp-1593293', 'mp-1066940']",8.9e-06,"{'Nb': 2.0, 'B': 2.0}",46.36382523721269,[],NM,False,63,0,"[0, 0, 0, 0]",3.839200046357112e-07,8.9e-06,0,1.78e-05,MP,data/source/MP/cleaned/cifs/MP-mp-2580.cif,True,,data/final/MP/graphs/B0.57Nb0.43-MP-mp-2580-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ag0.2Ge2Pd1.8Sr1,3,0.0799999999999999,1.0,True,Ag0.2Ge2Pd1.8Sr1,Ge2Pd2Sr1,2.52,Other,True,Ag4Ge40Pd36Sr20,Ag-Ge-Pd-Sr,4,Supercon,Sr1Pd1.8Ag0.2Ge2,MP-mp-978986,Sr1Ge2Pd2,Ge-Pd-Sr,Ge40Pd40Sr20,I 4/m m m,tetragonal,4.438671999438209,4.438671999438209,6.03054834,data/final/MP/cifs/Ag0.2Ge2Pd1.8Sr1-MP-mp-978986-synth_doped.cif,data/source/MP/raw/cifs/mp-978986.cif,mp-978986,0.0,,2015-10-09 03:56:43,7.295677176868866,10.17188/1316057,"@misc{osti_1316057,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr(GePd)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1316057"",
    place = ""United States"",
    year = ""2016"",
    month = ""9"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688092'}},0.0,4.0155429,520.0,-24.8627221,-4.97254442,"{'tags': ['Strontium palladium germanide (1/2/2)', 'Strontium palladium germanium (1/2/2)', 'High pressure experimental phase']}",-24.8627221,-4.97254442,-0.7134818633333324,"['xas', 'elasticity', 'bandstructure']",True,"[165985, 181157, 181155, 181156, 168133]",True,2021-05-12 10:56:37.246000,NM,5,9,mp-978986,,Sr(GePd)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ge_d', 'Pd'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Ge': 2.0, 'Pd': 2.0}",GGA,mp-978986,"['mp-1005776', 'mp-978986', 'mp-1005866', 'mp-979737', 'mp-1438850', 'mp-1688092', 'mp-1782349', 'mp-1011093', 'mp-1589601']",0.0012593,"{'Sr': 1.0, 'Ge': 2.0, 'Pd': 2.0}",101.45304755163892,[],NM,False,139,0,"[0, 0, 0, 0, 0]",1.2412638460752248e-05,0.0012593,0,0.0012593,MP,data/source/MP/cleaned/cifs/MP-mp-978986.cif,True,,data/final/MP/graphs/Ag0.2Ge2Pd1.8Sr1-MP-mp-978986-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ba2Cu4Dy1O8,1,0.0,1.0,True,Ba2Cu4Dy1O8,Ba2Cu4Dy1O8,74.46666667,Cuprate,True,Ba13.333Cu26.667Dy6.667O53.333333333333336,Ba-Cu-Dy-O,4,Supercon,Dy1Ba2Cu4O8,MP-mp-6691,Ba2Dy1Cu4O8,Ba-Cu-Dy-O,Ba13.333Cu26.667Dy6.667O53.333333333333336,C m m m,orthorhombic,3.886246,3.897522001622928,13.87885898,data/final/MP/cifs/Ba2Cu4Dy1O8-MP-mp-6691.cif,data/source/MP/raw/cifs/mp-6691.cif,mp-6691,0.0,,2011-05-16 02:52:15,6.536736444395467,10.17188/1281561,"@misc{osti_1281561,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Dy(CuO2)4 (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281561"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698809'}},0.0,3.29500259,520.0,-89.84357728,-5.989571818666667,"{'tags': ['Dysprosium dibarium tricopper copper(III) oxide', 'Dysprosium barium copper oxide (1/2/4/8)']}",-89.84357728,-5.989571818666667,-2.060955604,"['xas', 'bandstructure']",True,"[74125, 67637, 78625]",True,2021-05-12 10:57:32.679000,NM,15,8,mp-6691,oxide,Ba2Dy(CuO2)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Dy_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Dy': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-6691,"['mp-1007135', 'mp-1000661', 'mp-6691', 'mp-1431030', 'mp-1698809', 'mp-1785190', 'mp-1011884', 'mp-1599163']",0.0002446,"{'Ba': 2.0, 'Dy': 1.0, 'Cu': 4.0, 'O': 8.0}",208.1367053323528,[],NM,False,65,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.175189160457895e-06,0.0002446,0,0.0002446,MP,data/source/MP/cleaned/cifs/MP-mp-6691.cif,False,,data/final/MP/graphs/Ba2Cu4Dy1O8-MP-mp-6691.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
B2C1Gd0.1Ni2Y0.9,2,0.0333333333333333,1.0,True,B2C1Gd0.1Ni2Y0.9,B2C1Ni2Y1,12.0,Other,True,B33.333C16.667Gd1.667Ni33.333Y15,B-C-Gd-Ni-Y,5,Supercon,Y0.9Gd0.1Ni2B2C1,MP-mp-6576,Y1Ni2B2C1,B-C-Ni-Y,B33.333C16.667Ni33.333Y16.667,I 4/m m m,tetragonal,3.548790000501972,3.548790000501972,5.76144136,data/final/MP/cifs/B2C1Gd0.1Ni2Y0.9-MP-mp-6576-synth_doped.cif,data/source/MP/raw/cifs/mp-6576.cif,mp-6576,0.0,,2011-05-13 05:21:43,6.099730998852292,10.17188/1281366,"@misc{osti_1281366,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281366"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688230'}},0.0,6.81083016,520.0,-43.677878,-7.279646333333333,{'tags': []},-43.677878,-7.279646333333333,-0.5109282141666659,"['xas', 'bandstructure']",True,"[75816, 89142, 83231, 79574, 41549]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6576,,YNi2B2C,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6576,"['mp-6576', 'mp-1007054', 'mp-1000583', 'mp-1439516', 'mp-1688230', 'mp-1794280', 'mp-1011792', 'mp-1597064']",0.0006603,"{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.3152437079014,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",1.010943177297096e-05,0.0006603,0,0.0006603,MP,data/source/MP/cleaned/cifs/MP-mp-6576.cif,True,,data/final/MP/graphs/B2C1Gd0.1Ni2Y0.9-MP-mp-6576-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Nb2.85Sn1Ti0.15,3,0.0749999999999999,2.0,False,Nb5.7Sn2Ti0.3,Nb6Sn2,17.9,Other,True,Nb71.25Sn25Ti3.75,Nb-Sn-Ti,3,Supercon,Nb2.85Ti0.15Sn1,MP-mp-1326,Nb6Sn2,Nb-Sn,Nb75Sn25,P m -3 n,cubic,5.334611,5.334611,5.334611,data/final/MP/cifs/Nb2.85Sn1Ti0.15-MP-mp-1326-synth_doped.cif,data/source/MP/raw/cifs/mp-1326.cif,mp-1326,0.0,,2011-05-14 09:51:48,8.694218121896231,10.17188/1189484,"@misc{osti_1189484,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Nb3Sn (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189484"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668415'}},0.0,6.59372491,520.0,-69.93787048,-8.74223381,{'tags': ['Niobium tin (3/1)']},-69.93787048,-8.74223381,-0.163862066250001,"['xas', 'elasticity', 'bandstructure']",True,"[105230, 645503, 645489, 105231, 645498, 645485, 645474, 645496, 645480, 645488, 645482, 645487, 645500, 645493, 645477, 645484, 645502, 645483, 150878, 645479, 645481, 645486, 645473]",True,2021-05-12 10:56:12.755000,NM,8,9,mp-1326,,Nb3Sn,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Sn_d'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Sn': 1.0}",GGA,mp-1326,"['mp-930046', 'mp-913770', 'mp-930577', 'mp-1326', 'mp-1440651', 'mp-1668415', 'mp-1880085', 'mp-1594093', 'mp-1594507']",0.62023085,"{'Nb': 6.0, 'Sn': 2.0}",151.81275738025872,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0081709977567491,0.62023085,0,1.2404617,MP,data/source/MP/cleaned/cifs/MP-mp-1326.cif,True,,data/final/MP/graphs/Nb2.85Sn1Ti0.15-MP-mp-1326-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Bi0.025Ga0.975V3,2,0.0125,2.0,False,Bi0.05Ga1.95V6,Ga2V6,14.7,Other,True,Bi0.625Ga24.375V75,Bi-Ga-V,3,Supercon,V3Ga0.975Bi0.025,MP-mp-22568,V6Ga2,Ga-V,Ga25V75,P m -3 n,cubic,4.789645,4.789645,4.789645,data/final/MP/cifs/Bi0.025Ga0.975V3-MP-mp-22568-synth_doped.cif,data/source/MP/raw/cifs/mp-22568.cif,mp-22568,0.0,,2014-02-22 11:36:40,6.726541666276222,10.17188/1198793,"@misc{osti_1198793,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Ga (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198793"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686867'}},0.0,5.67452231,520.0,-61.95244347,-7.74405543375,{'tags': ['Gallium vanadium (1/3)']},-61.95244347,-7.74405543375,-0.1741018756249994,"['xas', 'elasticity', 'bandstructure']",True,"[635643, 635628, 635619, 635634, 104021, 635646, 635604, 635610, 635617, 635624, 635626, 635605, 635631, 635625, 635636, 635603, 104020, 635616, 635607]",True,2021-05-12 10:56:16.728000,FM,8,9,mp-22568,,V3Ga,"{'functional': 'PBE', 'labels': ['V_pv', 'Ga_d'], 'pot_type': 'paw'}","{'V': 3.0, 'Ga': 1.0}",GGA,mp-22568,"['mp-941343', 'mp-941663', 'mp-934924', 'mp-22568', 'mp-1440749', 'mp-1686867', 'mp-1804076', 'mp-1593784', 'mp-1595713']",0.09063635,"{'V': 6.0, 'Ga': 2.0}",109.87780534443452,[],FM,True,131,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.0, -0.0, -0.0]",0.0016497662965852,0.09063635,2,0.1812727,MP,data/source/MP/cleaned/cifs/MP-mp-22568.cif,True,,data/final/MP/graphs/Bi0.025Ga0.975V3-MP-mp-22568-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
B5Mo1.9Y0.1,2,0.0285714285714285,1.0,True,B5Mo1.9Y0.1,B5Mo2,8.0,Other,True,B71.429Mo27.143Y1.429,B-Mo-Y,3,Supercon,B5Mo1.9Y0.1,MP-mp-7229,B5Mo2,B-Mo,B71.429Mo28.571,R -3 m,trigonal,3.086062143206312,3.086062143206312,7.38317517,data/final/MP/cifs/B5Mo1.9Y0.1-MP-mp-7229-synth_doped.cif,data/source/MP/raw/cifs/mp-7229.cif,mp-7229,0.0,,2011-05-27 17:15:57,6.910597742884047,10.17188/1287525,"@misc{osti_1287525,
    author = ""Persson, Kristin"",
    title = ""Materials Data on B5Mo2 (SG:166) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1287525"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1678538'}},0.4354736101190504,10.26159619,520.0,-54.63026953,-7.804324218571429,"{'tags': ['Molybdenum boride (2/5)', 'Molybdenum boride (1/2.5) - epsilon']}",-54.63026953,-7.804324218571429,0.0654250548809522,['bandstructure'],True,"[157530, 614795, 614810, 24282]",True,2021-05-12 10:58:55.498000,NM,7,11,mp-7229,,B5Mo2,"{'functional': 'PBE', 'labels': ['B', 'Mo_pv'], 'pot_type': 'paw'}","{'B': 5.0, 'Mo': 2.0}",GGA,mp-7229,"['mp-1001204', 'mp-7229', 'mp-1007569', 'mp-1077992', 'mp-1078025', 'mp-1078031', 'mp-1441558', 'mp-1678538', 'mp-1793658', 'mp-1012321', 'mp-1593525']",0.0189101,"{'B': 5.0, 'Mo': 2.0}",59.09541989544843,[],NM,False,166,0,"[0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0]",0.0003199926497426,0.0189101,0,0.0189101,MP,data/source/MP/cleaned/cifs/MP-mp-7229.cif,True,,data/final/MP/graphs/B5Mo1.9Y0.1-MP-mp-7229-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Cu1La0.1Sr0.9O1.96,3,0.0555555555555555,1.0,True,Cu1La0.1Sr0.9O1.96,Cu1Sr1O2,42.5,Cuprate,True,Cu25.253La2.525Sr22.727O49.494949494949495,Cu-La-Sr-O,4,Supercon,Sr0.9La0.1Cu1O1.96,MP-mp-37514,Sr1Cu1O2,Cu-Sr-O,Cu25Sr25O50,P 4/m m m,tetragonal,3.484968,3.947813,3.947813,data/final/MP/cifs/Cu1La0.1Sr0.9O1.96-MP-mp-37514-synth_doped.cif,data/source/MP/raw/cifs/mp-37514.cif,mp-37514,0.0,,2014-02-19 09:18:09,5.599885836861445,10.17188/1207376,"@misc{osti_1207376,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SrCuO2 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207376"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1731754'}},0.0140859162499999,3.30951965,520.0,-22.56552868,-5.64138217,{'tags': []},-22.56552868,-5.64138217,-2.0637266366666664,"['xas', 'elasticity', 'bandstructure']",True,[],True,2021-05-12 10:56:20.740000,NM,4,6,mp-37514,oxide,SrCuO2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Cu': 1.0, 'O': 2.0}",GGA,mp-37514,"['mp-37514', 'mp-1141686', 'mp-1443464', 'mp-1731754', 'mp-1794901', 'mp-1613121']",0.0002664,"{'Sr': 1.0, 'Cu': 1.0, 'O': 2.0}",54.31401905086751,[],NM,False,123,0,"[0, 0, 0, 0]",4.904811035075576e-06,0.0002664,0,0.0002664,MP,data/source/MP/cleaned/cifs/MP-mp-37514.cif,True,,data/final/MP/graphs/Cu1La0.1Sr0.9O1.96-MP-mp-37514-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ba0.13Cu1La1.87O4,2,0.0371428571428571,1.0,True,Ba0.13Cu1La1.87O4,Cu1La2O4,4.96,Cuprate,True,Ba1.857Cu14.286La26.714O57.142857142857146,Ba-Cu-La-O,4,Supercon,La1.87Ba0.13Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ba0.13Cu1La1.87O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ba0.13Cu1La1.87O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ce0.1Ge12Pr0.9Pt4,2,0.0117647058823529,1.0,True,Ce0.1Ge12Pr0.9Pt4,Ge12Pr1Pt4,4.11,Heavy_fermion,True,Ce0.588Ge70.588Pr5.294Pt23.529,Ce-Ge-Pr-Pt,4,Supercon,Pr0.9Ce0.1Pt4Ge12,MP-mp-1105939,Pr1Ge12Pt4,Ge-Pr-Pt,Ge70.588Pr5.882Pt23.529,I m -3,cubic,7.560907531676135,7.560907530000001,7.56090753,data/final/MP/cifs/Ce0.1Ge12Pr0.9Pt4-MP-mp-1105939-synth_doped.cif,data/source/MP/raw/cifs/mp-1105939.cif,mp-1105939,0.0,,2018-07-19 06:58:09,8.947691530234051,,,{'GGA': {'task_id': 'mp-1705662'}},0.0059454020588258,4.25899828,520.0,-91.15368674,-5.361981572941176,{'tags': ['Praseodymium platinum germanide (1/4/12)']},-91.15368674,-5.361981572941176,-0.3889895585294119,['bandstructure'],True,[174554],True,2021-05-12 10:58:22.271000,NM,17,5,mp-1105939,,Pr(Ge3Pt)4,"{'functional': 'PBE', 'labels': ['Pr_3', 'Ge_d', 'Pt'], 'pot_type': 'paw'}","{'Pr': 1.0, 'Ge': 12.0, 'Pt': 4.0}",GGA,mp-1105939,"['mp-1105939', 'mp-1427343', 'mp-1705662', 'mp-1805701', 'mp-1584493']",0.0022709,"{'Pr': 1.0, 'Ge': 12.0, 'Pt': 4.0}",332.73607546662794,[],NM,False,204,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.824928727115922e-06,0.0022709,0,0.0022709,MP,data/source/MP/cleaned/cifs/MP-mp-1105939.cif,True,,data/final/MP/graphs/Ce0.1Ge12Pr0.9Pt4-MP-mp-1105939-synth_doped.json,0,True,m-3,2,0,0,0,0,0,0,0,0,1,0,1.0,False
Hf2Ir1,3,0.0833333333333333,5.0,False,Hf10Ir5,Hf10Ir6,0.0,Other,True,Hf66.667Ir33.333,Hf-Ir,2,Supercon,Hf2Ir1,MP-mp-1189573,Hf10Ir6,Hf-Ir,Hf62.5Ir37.5,P 63/m c m,hexagonal,5.527256,7.973427999429947,7.97342869,data/final/MP/cifs/Hf2Ir1-MP-mp-1189573-synth_doped.cif,data/source/MP/raw/cifs/mp-1189573.cif,mp-1189573,0.0,,2019-01-11 20:17:50.410000,16.03246616557024,,,{'GGA': {'task_id': 'mp-1705647'}},0.0171375266666657,6.35899876,520.0,-165.51384138,-10.34461508625,"{'tags': ['Zr5Ir3', 'Hf5Ir3', 'Hafnium iridide (5/3)']}",-165.51384138,-10.34461508625,-0.8069606475000004,['bandstructure'],True,[638578],True,2021-05-12 10:58:33.577000,NM,16,5,mp-1189573,,Hf5Ir3,"{'functional': 'PBE', 'labels': ['Hf_pv', 'Ir'], 'pot_type': 'paw'}","{'Hf': 5.0, 'Ir': 3.0}",GGA,mp-1189573,"['mp-1189573', 'mp-1504527', 'mp-1705647', 'mp-1808575', 'mp-1608203']",0.02316475,"{'Hf': 10.0, 'Ir': 6.0}",304.31994405451576,[],NM,False,193,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0001522394470199,0.02316475,0,0.0463295,MP,data/source/MP/cleaned/cifs/MP-mp-1189573.cif,True,,data/final/MP/graphs/Hf2Ir1-MP-mp-1189573-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Co1Ge0.92Si0.08U1,3,0.0533333333333333,4.0,False,Co4Ge3.68Si0.32U4,Co4Ge4U4,0.288,Heavy_fermion,True,Co33.333Ge30.667Si2.667U33.333,Co-Ge-Si-U,4,Supercon,U1Co1Ge0.92Si0.08,MP-mp-20671,U4Co4Ge4,Co-Ge-U,Co33.333Ge33.333U33.333,P n m a,orthorhombic,4.28722,6.693007,7.099451,data/final/MP/cifs/Co1Ge0.92Si0.08U1-MP-mp-20671-synth_doped.cif,data/source/MP/raw/cifs/mp-20671.cif,mp-20671,0.0,,2014-02-22 17:09:25,12.050961791187769,10.17188/1195831,"@misc{osti_1195831,
    author = ""Persson, Kristin"",
    title = ""Materials Data on UCoGe (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195831"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696056'}},0.0092126219444441,8.81618313,520.0,-96.12146646,-8.010122205,"{'tags': ['Uranium nickel germanium (1/1/1)', 'Uranium cobalt germanium (1/1/1)', 'Uranium cobalt germanide (1/1/1)', 'Uranium cobalt germanium hydride (1/1/1/0.1)']}",-96.12146646,-8.010122205,-0.3358703183333335,"['xas', 'bandstructure']",True,"[55538, 184392, 184389, 184388]",True,2021-05-12 10:56:57.051000,NM,12,11,mp-20671,,UCoGe,"{'functional': 'PBE', 'labels': ['U', 'Co', 'Ge_d'], 'pot_type': 'paw'}","{'U': 1.0, 'Co': 1.0, 'Ge': 1.0}",GGA,mp-20671,"['mp-921572', 'mp-906970', 'mp-920534', 'mp-20671', 'mp-1102081', 'mp-1102694', 'mp-1103716', 'mp-1433082', 'mp-1696056', 'mp-1832133', 'mp-1602688']",0.006528975,"{'U': 4.0, 'Co': 4.0, 'Ge': 4.0}",203.71444041881864,[],NM,False,62,0,"[0.0, 0.0, 0.0, 0.0, -0.0, -0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0]",0.0001281985702452,0.006528975,0,0.0261159,MP,data/source/MP/cleaned/cifs/MP-mp-20671.cif,True,,data/final/MP/graphs/Co1Ge0.92Si0.08U1-MP-mp-20671-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Cr3Pt1,1,0.0,2.0,False,Cr6Pt2,Cr6Pt2,0.0,Other,True,Cr75Pt25,Cr-Pt,2,Supercon,Cr3Pt1,MP-mp-446,Cr6Pt2,Cr-Pt,Cr75Pt25,P m -3 n,cubic,4.677137,4.677137,4.677137,data/final/MP/cifs/Cr3Pt1-MP-mp-446.cif,data/source/MP/raw/cifs/mp-446.cif,mp-446,0.0,,2011-05-14 07:30:38,11.395552440735688,10.17188/1208169,"@misc{osti_1208169,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Cr3Pt (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208169"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702362'}},0.0751529233333361,7.27226864,520.0,-70.12698298,-8.7658728725,{'tags': ['Chromium platinum (3/1)']},-70.12698298,-8.7658728725,-0.0083603424999996,"['xas', 'elasticity', 'bandstructure']",True,"[102837, 102836]",True,2021-05-12 10:56:20.740000,FM,8,8,mp-446,,Cr3Pt,"{'functional': 'PBE', 'labels': ['Cr_pv', 'Pt'], 'pot_type': 'paw'}","{'Cr': 3.0, 'Pt': 1.0}",GGA,mp-446,"['mp-941249', 'mp-941551', 'mp-934775', 'mp-446', 'mp-1504950', 'mp-1702362', 'mp-1795671', 'mp-1588107']",0.6271698,"{'Cr': 6.0, 'Pt': 2.0}",102.3152273455694,[],FM,True,223,1,"[0.2, 0.2, 0.2, 0.2, 0.2, 0.2, 0.0, 0.0]",0.0122595593299467,0.6271698,6,1.2543396,MP,data/source/MP/cleaned/cifs/MP-mp-446.cif,False,,data/final/MP/graphs/Cr3Pt1-MP-mp-446.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ce0.17Cu1Sm1.83O4,3,0.0485714285714285,1.0,True,Ce0.17Cu1Sm1.83O4,Cu1Sm2O4,0.0,Cuprate,True,Ce2.429Cu14.286Sm26.143O57.142857142857146,Ce-Cu-Sm-O,4,Supercon,Sm1.83Ce0.17Cu1O4,MP-mp-4210,Sm2Cu1O4,Cu-Sm-O,Cu14.286Sm28.571O57.142857142857146,I 4/m m m,tetragonal,3.936481999770292,3.936481999770292,6.66682973,data/final/MP/cifs/Ce0.17Cu1Sm1.83O4-MP-mp-4210-synth_doped.cif,data/source/MP/raw/cifs/mp-4210.cif,mp-4210,0.0,,2011-05-13 10:20:22,7.575626216473968,10.17188/1207966,"@misc{osti_1207966,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sm2CuO4 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207966"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-670158'}},0.0084157301785579,3.24265454,520.0,-51.71666507,-7.38809501,"{'tags': ['Samarium cuprate', 'Disamarium copper oxide', 'Disamarium copper tetraoxide']}",-51.71666507,-7.38809501,-3.0194917299999995,"['xas', 'elasticity', 'bandstructure']",True,"[261378, 72243, 71182, 95371, 261377]",True,2021-05-12 10:56:20.740000,NM,7,8,mp-4210,oxide,Sm2CuO4,"{'functional': 'PBE', 'labels': ['Sm_3', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Sm': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-4210,"['mp-660482', 'mp-670158', 'mp-4210', 'mp-1412888', 'mp-1702500', 'mp-1798108', 'mp-1589420', 'mp-688388']",0.0004776,"{'Sm': 2.0, 'Cu': 1.0, 'O': 4.0}",93.8732216032902,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",5.087712894507291e-06,0.0004776,0,0.0004776,MP,data/source/MP/cleaned/cifs/MP-mp-4210.cif,True,,data/final/MP/graphs/Ce0.17Cu1Sm1.83O4-MP-mp-4210-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ba2Ca0.025Cu4Y0.975O8,2,0.0033333333333333,1.0,True,Ba2Ca0.025Cu4Y0.975O8,Ba2Cu4Y1O8,80.75,Cuprate,True,Ba13.333Ca0.167Cu26.667Y6.5O53.333333333333336,Ba-Ca-Cu-Y-O,5,Supercon,Y0.975Ca0.025Ba2Cu4O8,MP-mp-6790,Ba2Y1Cu4O8,Ba-Cu-Y-O,Ba13.333Cu26.667Y6.667O53.333333333333336,C m m m,orthorhombic,3.889922,3.899603999537882,13.88942687,data/final/MP/cifs/Ba2Ca0.025Cu4Y0.975O8-MP-mp-6790-synth_doped.cif,data/source/MP/raw/cifs/mp-6790.cif,mp-6790,0.0,,2011-05-16 03:21:24,5.936250568336678,10.17188/1283441,"@misc{osti_1283441,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Y(CuO2)4 (SG:65) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1283441"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686864'}},0.0,3.31391536,520.0,-91.58381472,-6.105587648,"{'tags': ['Yttrium barium copper oxide (1/2/4/8)', 'High pressure experimental phase']}",-91.58381472,-6.105587648,-2.0529924817777783,"['xas', 'bandstructure']",True,"[72261, 85273, 74251, 400273, 85277, 85275, 400280, 67632, 85272, 67631, 83920, 66613, 85279, 400277, 75689, 74259, 85278, 85280, 66603, 94265, 400276, 88873, 71417, 75712, 97052, 66605, 72258, 85281, 85274, 400279, 66604, 69698]",True,2021-05-12 10:57:34.594000,NM,15,10,mp-6790,oxide,Ba2Y(CuO2)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Y_sv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-6790,"['mp-1000664', 'mp-6790', 'mp-1007136', 'mp-1237713', 'mp-1440937', 'mp-1686864', 'mp-1834179', 'mp-1011883', 'mp-1590064', 'mp-1590433']",0.0004643,"{'Ba': 2.0, 'Y': 1.0, 'Cu': 4.0, 'O': 8.0}",208.60454115924333,[],NM,False,65,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.225742533790601e-06,0.0004643,0,0.0004643,MP,data/source/MP/cleaned/cifs/MP-mp-6790.cif,True,,data/final/MP/graphs/Ba2Ca0.025Cu4Y0.975O8-MP-mp-6790-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Lu1Rh2,1,0.0,2.0,False,Lu2Rh4,Lu2Rh4,0.0,Other,True,Lu33.333Rh66.667,Lu-Rh,2,Supercon,Lu1Rh2,MP-mp-1728,Lu2Rh4,Lu-Rh,Lu33.333Rh66.667,F d -3 m,cubic,5.2961011,5.296101099999999,5.296101099999999,data/final/MP/cifs/Lu1Rh2-MP-mp-1728.cif,data/source/MP/raw/cifs/mp-1728.cif,mp-1728,0.0,,2011-05-13 21:26:36,12.039186412457042,10.17188/1192429,"@misc{osti_1192429,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LuRh2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1192429"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699087'}},0.0,5.35845802,520.0,-43.10735067,-7.184558445,{'tags': ['Lutetium rhodium (1/2)']},-43.10735067,-7.184558445,-0.7680363583333332,"['xas', 'bandstructure']",True,"[104822, 642546, 642547, 104823]",True,2021-05-12 10:56:55.092000,NM,6,8,mp-1728,,LuRh2,"{'functional': 'PBE', 'labels': ['Lu_3', 'Rh_pv'], 'pot_type': 'paw'}","{'Lu': 1.0, 'Rh': 2.0}",GGA,mp-1728,"['mp-941958', 'mp-941774', 'mp-935119', 'mp-1728', 'mp-1441532', 'mp-1699087', 'mp-1882042', 'mp-1588336']",0.0027199,"{'Lu': 2.0, 'Rh': 4.0}",105.03977977242256,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",5.1787998906564544e-05,0.0027199,0,0.0054398,MP,data/source/MP/cleaned/cifs/MP-mp-1728.cif,False,,data/final/MP/graphs/Lu1Rh2-MP-mp-1728.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Br2Ca1.75Cu1Na0.25O2,3,0.0714285714285714,1.0,True,Br2Ca1.75Cu1Na0.25O2,Br2Ca2Cu1O2,18.0,Cuprate,True,Br28.571Ca25Cu14.286Na3.571O28.571428571428573,Br-Ca-Cu-Na-O,5,Supercon,Ca1.75Na0.25Cu1Br2O2,MP-mp-545481,Ca2Cu1Br2O2,Br-Ca-Cu-O,Br28.571Ca28.571Cu14.286O28.571428571428573,I 4/m m m,tetragonal,3.8848960001664095,3.8848960001664095,9.26575389,data/final/MP/cifs/Br2Ca1.75Cu1Na0.25O2-MP-mp-545481-synth_doped.cif,data/source/MP/raw/cifs/mp-545481.cif,mp-545481,0.0,,2014-02-21 09:12:30,4.171489837215984,10.17188/1267001,"@misc{osti_1267001,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ca2Cu(BrO)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1267001"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687817'}},0.0,3.0811802,520.0,-34.65890385,-4.9512719785714285,{'tags': ['Dicalcium dibromodioxocuprate']},-34.65890385,-4.9512719785714285,-2.260101375,"['xas', 'elasticity', 'bandstructure']",True,[1028],True,2021-05-12 10:56:22.739000,NM,7,8,mp-545481,oxide,Ca2Cu(BrO)2,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Cu_pv', 'Br', 'O'], 'pot_type': 'paw'}","{'Ca': 2.0, 'Cu': 1.0, 'Br': 2.0, 'O': 2.0}",GGA,mp-545481,"['mp-1000746', 'mp-1007202', 'mp-545481', 'mp-1301034', 'mp-1687817', 'mp-1779505', 'mp-1011944', 'mp-1590430']",0.0093361,"{'Ca': 2.0, 'Cu': 1.0, 'Br': 2.0, 'O': 2.0}",133.55551405583833,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",6.990426464980444e-05,0.0093361,0,0.0093361,MP,data/source/MP/cleaned/cifs/MP-mp-545481.cif,True,,data/final/MP/graphs/Br2Ca1.75Cu1Na0.25O2-MP-mp-545481-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B4Co4Dy1,1,0.0,2.0,False,B8Co8Dy2,B8Co8Dy2,0.0,Other,True,B44.444Co44.444Dy11.111,B-Co-Dy,3,Supercon,Dy1Co4B4,MP-mp-1189595,Dy2Co8B8,B-Co-Dy,B44.444Co44.444Dy11.111,P 42/n m c,tetragonal,5.001925,5.001925,6.980406,data/final/MP/cifs/B4Co4Dy1-MP-mp-1189595.cif,data/source/MP/raw/cifs/mp-1189595.cif,mp-1189595,0.0,,2019-01-11 20:18:50.334000,8.395216978922052,,,,0.0,6.28596107,520.0,-128.60285737,-7.144603187222223,{'tags': ['Dysprosium cobalt boride (1/4/4)']},-128.60285737,-7.144603187222223,-0.5048670646296303,[],False,[612908],True,2021-05-12 10:59:54.607000,NM,18,3,mp-1189595,,Dy(CoB)4,"{'functional': 'PBE', 'labels': ['Dy_3', 'Co', 'B'], 'pot_type': 'paw'}","{'Dy': 1.0, 'Co': 4.0, 'B': 4.0}",GGA,mp-1189595,"['mp-1189595', 'mp-1832532', 'mp-1982432']",0.00787385,"{'Dy': 2.0, 'Co': 8.0, 'B': 8.0}",174.644548682267,[],NM,False,137,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",9.017000598541434e-05,0.00787385,0,0.0157477,MP,data/source/MP/cleaned/cifs/MP-mp-1189595.cif,False,,data/final/MP/graphs/B4Co4Dy1-MP-mp-1189595.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ge2Th3,1,0.0,2.0,False,Ge4Th6,Ge4Th6,0.0,Other,True,Ge40Th60,Ge-Th,2,Supercon,Ge2Th3,MP-mp-314,Th6Ge4,Ge-Th,Ge40Th60,P 4/m b m,tetragonal,4.139799,8.01774,8.01774,data/final/MP/cifs/Ge2Th3-MP-mp-314.cif,data/source/MP/raw/cifs/mp-314.cif,mp-314,0.0,,2011-05-15 10:09:13,10.50014759753245,10.17188/1205627,"@misc{osti_1205627,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Th3Ge2 (SG:127) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1205627"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696604'}},0.0,6.65310671,520.0,-69.9305762,-6.99305762,"{'tags': ['Thorium germanide (3/2)', 'Germanium thorium (2/3)']}",-69.9305762,-6.99305762,-0.6955315280000007,"['xas', 'elasticity', 'bandstructure']",True,"[638034, 44503, 638039]",True,2021-05-12 10:56:20.740000,NM,10,7,mp-314,,Th3Ge2,"{'functional': 'PBE', 'labels': ['Th', 'Ge_d'], 'pot_type': 'paw'}","{'Th': 3.0, 'Ge': 2.0}",GGA,mp-314,"['mp-920481', 'mp-314', 'mp-906876', 'mp-921509', 'mp-1475457', 'mp-1696604', 'mp-1598056']",0.0006714,"{'Th': 6.0, 'Ge': 4.0}",266.1234793743678,[],NM,False,127,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.045778009354158e-06,0.0006714,0,0.0013428,MP,data/source/MP/cleaned/cifs/MP-mp-314.cif,False,,data/final/MP/graphs/Ge2Th3-MP-mp-314.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ni0.05S2Ta1,3,0.1210592686002522,4.0,False,Ni0.2S8Ta4,Ni1S8Ta4,2.6775,Ferrite,True,Ni1.639S65.574Ta32.787,Ni-S-Ta,3,Supercon,Ni0.05Ta1S2,MP-mp-1218136,Ta4Ni1S8,Ni-S-Ta,Ni7.692S61.538Ta30.769,P -3 m 1,trigonal,3.369069999250622,3.36906982,24.425977,data/final/MP/cifs/Ni0.05S2Ta1-MP-mp-1218136-synth_doped.cif,data/source/MP/raw/cifs/mp-1218136.cif,mp-1218136,0.0,,2019-01-12 19:21:19.076000,7.185617374365983,,,{'GGA': {'task_id': 'mp-1746242'}},0.0414952845607894,5.36411464,520.0,-98.60879648,-7.585292036923077,{'tags': []},-98.60879648,-7.585292036923077,-1.2561500265384615,[],False,[],True,2021-05-12 11:00:42.526000,FM,13,4,mp-1218136,,Ta4NiS8,"{'functional': 'PBE', 'labels': ['Ta_pv', 'Ni_pv', 'S'], 'pot_type': 'paw'}","{'Ta': 4.0, 'Ni': 1.0, 'S': 8.0}",GGA,mp-1218136,"['mp-1218136', 'mp-1395464', 'mp-1746242', 'mp-1876649']",0.5894077,"{'Ta': 4.0, 'Ni': 1.0, 'S': 8.0}",240.1057793870966,[],FM,True,164,1,"[0.0, 0.0, 0.0, 0.0, 0.5, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.002454783477118,0.5894077,1,0.5894077,MP,data/source/MP/cleaned/cifs/MP-mp-1218136.cif,True,,data/final/MP/graphs/Ni0.05S2Ta1-MP-mp-1218136-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Ba0.7Rb0.3Sb2Ti2O1,3,0.1,1.0,True,Ba0.7Rb0.3Sb2Ti2O1,Ba1Sb2Ti2O1,5.93,Oxide,True,Ba11.667Rb5Sb33.333Ti33.333O16.666666666666668,Ba-Rb-Sb-Ti-O,5,Supercon,Ba0.7Rb0.3Ti2Sb2O1,MP-mp-1070806,Ba1Ti2Sb2O1,Ba-Sb-Ti-O,Ba16.667Sb33.333Ti33.333O16.666666666666668,P 4/m m m,tetragonal,4.113474,4.113474,8.312382,data/final/MP/cifs/Ba0.7Rb0.3Sb2Ti2O1-MP-mp-1070806-synth_doped.cif,data/source/MP/raw/cifs/mp-1070806.cif,mp-1070806,0.0,,2018-03-22 04:02:04,5.8154485533321445,,,{'GGA': {'task_id': 'mp-1702174'}},0.0,5.89751533,520.0,-39.14932631,-6.524887718333333,{'tags': []},-39.14932631,-6.524887718333333,-1.5507346602777776,['bandstructure'],True,"[430061, 237789, 430060]",True,2021-05-12 10:58:14.654000,NM,6,16,mp-1070806,oxide,BaTi2Sb2O,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ti_pv', 'Sb', 'O'], 'pot_type': 'paw'}","{'Ba': 1.0, 'Ti': 2.0, 'Sb': 2.0, 'O': 1.0}",GGA,mp-1070806,"['mp-1071055', 'mp-1071068', 'mp-1071083', 'mp-1071088', 'mp-1070806', 'mp-1071124', 'mp-1070846', 'mp-1070900', 'mp-1071137', 'mp-1423542', 'mp-1702174', 'mp-1785425', 'mp-1588663', 'mp-1070899', 'mp-1071129', 'mp-1071119']",0.001055,"{'Ba': 1.0, 'Ti': 2.0, 'Sb': 2.0, 'O': 1.0}",140.65105900950408,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0]",7.500832254158225e-06,0.001055,0,0.001055,MP,data/source/MP/cleaned/cifs/MP-mp-1070806.cif,True,,data/final/MP/graphs/Ba0.7Rb0.3Sb2Ti2O1-MP-mp-1070806-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Cu3Pb2Sm1Sr2O8,1,0.0,1.0,True,Cu3Pb2Sm1Sr2O8,Cu3Pb2Sm1Sr2O8,0.0,Cuprate,True,Cu18.75Pb12.5Sm6.25Sr12.5O50,Cu-Pb-Sm-Sr-O,5,Supercon,Pb2Sr2Sm1Cu3O8,MP-mp-20437,Sr2Sm1Cu3Pb2O8,Cu-Pb-Sm-Sr-O,Cu18.75Pb12.5Sm6.25Sr12.5O50,P 4/m m m,tetragonal,3.853889,3.853889,16.084248,data/final/MP/cifs/Cu3Pb2Sm1Sr2O8-MP-mp-20437.cif,data/source/MP/raw/cifs/mp-20437.cif,mp-20437,0.0,,2015-01-23 19:26:34,7.358604178144397,10.17188/1195558,"@misc{osti_1195558,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr2SmCu3(PbO4)2 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195558"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-931637'}},0.0205153902636769,4.54928815,520.0,-94.71715359,-5.919822099375,{'tags': ['Lead strontium samarium copper oxide (2/2/1/3/8)']},-94.71715359,-5.919822099375,-2.0505611473958325,['xas'],False,[71480],True,2021-05-12 10:56:57.051000,NM,16,6,mp-20437,oxide,Sr2SmCu3(PbO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Sm_3', 'Cu_pv', 'Pb_d', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Sm': 1.0, 'Cu': 3.0, 'Pb': 2.0, 'O': 8.0}",GGA,mp-20437,"['mp-932702', 'mp-918071', 'mp-931637', 'mp-20437', 'mp-1244603', 'mp-1774463']",0.0019205,"{'Sr': 2.0, 'Sm': 1.0, 'Cu': 3.0, 'Pb': 2.0, 'O': 8.0}",238.8906568749641,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",8.039242828174705e-06,0.0019205,0,0.0019205,MP,data/source/MP/cleaned/cifs/MP-mp-20437.cif,False,,data/final/MP/graphs/Cu3Pb2Sm1Sr2O8-MP-mp-20437.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Cu1Rh1.95Se4Sn0.05,2,0.0142857142857142,2.0,False,Cu2Rh3.9Se8Sn0.1,Cu2Rh4Se8,2.7,Other,True,Cu14.286Rh27.857Se57.143Sn0.714,Cu-Rh-Se-Sn,4,Supercon,Cu1Rh1.95Se4Sn0.05,MP-mp-15614,Cu2Rh4Se8,Cu-Rh-Se,Cu14.286Rh28.571Se57.143,F d -3 m,cubic,7.355548180000001,7.35554818,7.35554818,data/final/MP/cifs/Cu1Rh1.95Se4Sn0.05-MP-mp-15614-synth_doped.cif,data/source/MP/raw/cifs/mp-15614.cif,mp-15614,0.0,,2011-06-05 07:24:52,6.906389184589765,10.17188/1191272,"@misc{osti_1191272,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Cu(RhSe2)2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191272"",
    place = ""United States"",
    year = ""2015"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696606'}},0.0,4.3275914,520.0,-70.96322011,-5.068801436428571,"{'tags': ['Copper rhodium selenide (1/2/4)', 'Copper dirhodium tetraselenide']}",-70.96322011,-5.068801436428571,-0.6511631049107142,"['xas', 'bandstructure']",True,"[41903, 628775, 628777, 602898]",True,2021-05-12 10:56:53.126000,NM,14,8,mp-15614,,Cu(RhSe2)2,"{'functional': 'PBE', 'labels': ['Cu_pv', 'Rh_pv', 'Se'], 'pot_type': 'paw'}","{'Cu': 1.0, 'Rh': 2.0, 'Se': 4.0}",GGA,mp-15614,"['mp-920967', 'mp-942426', 'mp-942820', 'mp-15614', 'mp-1422873', 'mp-1696606', 'mp-1860746', 'mp-1604721']",0.00066735,"{'Cu': 2.0, 'Rh': 4.0, 'Se': 8.0}",281.40391576118253,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.743004362216169e-06,0.00066735,0,0.0013347,MP,data/source/MP/cleaned/cifs/MP-mp-15614.cif,True,,data/final/MP/graphs/Cu1Rh1.95Se4Sn0.05-MP-mp-15614-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
B4Ta3,1,0.0,1.0,True,B4Ta3,B4Ta3,0.0,Other,True,B57.143Ta42.857,B-Ta,2,Supercon,B4Ta3,MP-mp-10142,Ta3B4,B-Ta,B57.143Ta42.857,I m m m,orthorhombic,3.145996001627906,3.310162002160564,7.39626829,data/final/MP/cifs/B4Ta3-MP-mp-10142.cif,data/source/MP/raw/cifs/mp-10142.cif,mp-10142,0.0,,2011-05-28 02:38:07,13.28435247984026,10.17188/1186674,"@misc{osti_1186674,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ta3B4 (SG:71) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1186674"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697685'}},0.0,8.2185329,520.0,-67.70295838,-9.671851197142855,"{'tags': ['Tantalum(IV) boride (3/4) - delta', 'Tantalum boride (3/4)']}",-67.70295838,-9.671851197142855,-0.773151200952381,"['xas', 'elasticity', 'bandstructure']",True,"[615515, 602946, 191904, 44589]",True,2021-05-12 10:56:08.727000,NM,7,9,mp-10142,,Ta3B4,"{'functional': 'PBE', 'labels': ['Ta_pv', 'B'], 'pot_type': 'paw'}","{'Ta': 3.0, 'B': 4.0}",GGA,mp-10142,"['mp-991259', 'mp-993229', 'mp-10142', 'mp-1077973', 'mp-1441648', 'mp-1697685', 'mp-1800799', 'mp-994540', 'mp-1592029']",0.0006494,"{'Ta': 3.0, 'B': 4.0}",73.26073469883566,[],NM,False,71,0,"[0, 0, 0, 0, 0, 0, 0]",8.864229968066657e-06,0.0006494,0,0.0006494,MP,data/source/MP/cleaned/cifs/MP-mp-10142.cif,False,,data/final/MP/graphs/B4Ta3-MP-mp-10142.json,0,True,mmm,0,0,0,7,0,0,0,0,0,1,0,1.0,False
Ba2Ca1Cu2Hg1O6.31,2,0.0251827782290819,0.9509743264659272,True,Ba1.902Ca0.951Cu1.902Hg0.951O6,Ba2Ca1Cu2Hg1O6,98.0,Cuprate,True,Ba16.247Ca8.123Cu16.247Hg8.123O51.25913891145411,Ba-Ca-Cu-Hg-O,5,Supercon,Hg1Ba2Ca1Cu2O6.31,MP-mp-6879,Ba2Ca1Cu2Hg1O6,Ba-Ca-Cu-Hg-O,Ba16.667Ca8.333Cu16.667Hg8.333O50,P 4/m m m,tetragonal,3.904834,3.904834,13.058604,data/final/MP/cifs/Ba2Ca1Cu2Hg1O6.31-MP-mp-6879-synth_doped.cif,data/source/MP/raw/cifs/mp-6879.cif,mp-6879,0.0,,2011-05-14 23:17:39,6.158075338837193,10.17188/1284432,"@misc{osti_1284432,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2CaCu2HgO6 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1284432"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698891'}},0.017586347638888,3.04291167,520.0,-64.08791228,-5.3406593566666665,"{'tags': ['High pressure experimental phase', 'Mercury dibarium calcium dicopper oxide', 'Mercury barium calcium copper oxide (1/2/1/2/6)']}",-64.08791228,-5.3406593566666665,-2.0147092504166664,"['bandstructure', 'elasticity']",True,"[83087, 75729, 75727, 75726, 75725, 75728]",True,2021-05-12 10:56:27.046000,NM,12,12,mp-6879,oxide,Ba2CaCu2HgO6,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ca_sv', 'Cu_pv', 'Hg', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Hg': 1.0, 'O': 6.0}",GGA,mp-6879,"['mp-917434', 'mp-924375', 'mp-6879', 'mp-923788', 'mvc-16307', 'mp-1045026', 'mp-1045039', 'mp-1422313', 'mp-1698891', 'mp-1833979', 'mp-1592102', 'mp-1045044']",0.0305618,"{'Ba': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Hg': 1.0, 'O': 6.0}",199.11404926320108,[],NM,False,123,0,"[0.0, 0.0, 0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001534889181004,0.0305618,0,0.0305618,MP,data/source/MP/cleaned/cifs/MP-mp-6879.cif,True,,data/final/MP/graphs/Ba2Ca1Cu2Hg1O6.31-MP-mp-6879-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ir0.95Pt0.05Te2,2,0.0333333333333333,4.0,False,Ir3.8Pt0.2Te8,Ir4Te8,2.683333333,Other,True,Ir31.667Pt1.667Te66.667,Ir-Pt-Te,3,Supercon,Ir0.95Pt0.05Te2,MP-mp-569322,Te8Ir4,Ir-Te,Ir33.333Te66.667,P n m a,orthorhombic,4.049805,5.441863,13.587474,data/final/MP/cifs/Ir0.95Pt0.05Te2-MP-mp-569322-synth_doped.cif,data/source/MP/raw/cifs/mp-569322.cif,mp-569322,0.0,,2014-02-16 04:48:25,9.924328423353325,10.17188/1275037,"@misc{osti_1275037,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Te2Ir (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1275037"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1746248'}},0.0123894575000003,7.60847828,520.0,-63.94410921,-5.3286757675,{'tags': ['Iridium telluride (1/2)']},-63.94410921,-5.3286757675,-0.5683316741666667,"['xas', 'bandstructure']",True,[93894],True,2021-05-12 10:57:24.969000,NM,12,7,mp-569322,,Te2Ir,"{'functional': 'PBE', 'labels': ['Te', 'Ir'], 'pot_type': 'paw'}","{'Te': 2.0, 'Ir': 1.0}",GGA,mp-569322,"['mp-927873', 'mp-927408', 'mp-569322', 'mp-911451', 'mp-1392626', 'mp-1746248', 'mp-1810340']",0.000153075,"{'Te': 8.0, 'Ir': 4.0}",299.44732816890644,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.0447669503153013e-06,0.000153075,0,0.0006123,MP,data/source/MP/cleaned/cifs/MP-mp-569322.cif,True,,data/final/MP/graphs/Ir0.95Pt0.05Te2-MP-mp-569322-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
P1Ru1Zr1,1,0.0,4.0,False,P4Ru4Zr4,P4Ru4Zr4,8.496153846,Other,True,P33.333Ru33.333Zr33.333,P-Ru-Zr,3,Supercon,Zr1Ru1P1,MP-mp-22268,Zr4P4Ru4,P-Ru-Zr,P33.333Ru33.333Zr33.333,P n m a,orthorhombic,3.896771,6.476559,7.378435,data/final/MP/cifs/P1Ru1Zr1-MP-mp-22268.cif,data/source/MP/raw/cifs/mp-22268.cif,mp-22268,0.0,,2014-02-22 18:40:36,7.963823777103373,10.17188/1197495,"@misc{osti_1197495,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrPRu (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197495"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677547'}},0.0,7.91938263,520.0,-106.40582437,-8.867152030833333,"{'tags': ['Ruthenium zirconium phosphide (1/1/1)', 'Zirconium ruthenium phosphide (1/1/1)']}",-106.40582437,-8.867152030833333,-1.1220211002777785,"['xas', 'elasticity', 'bandstructure']",True,"[648038, 30727]",True,2021-05-12 10:56:16.728000,NM,12,9,mp-22268,,ZrPRu,"{'functional': 'PBE', 'labels': ['Zr_sv', 'P', 'Ru_pv'], 'pot_type': 'paw'}","{'Zr': 1.0, 'P': 1.0, 'Ru': 1.0}",GGA,mp-22268,"['mp-921696', 'mp-907212', 'mp-920689', 'mp-22268', 'mp-1102635', 'mp-1442687', 'mp-1677547', 'mp-1785321', 'mp-1602314']",3.01e-05,"{'Zr': 4.0, 'P': 4.0, 'Ru': 4.0}",186.21448765818843,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.46566233992512e-07,3.01e-05,0,0.0001204,MP,data/source/MP/cleaned/cifs/MP-mp-22268.cif,False,,data/final/MP/graphs/P1Ru1Zr1-MP-mp-22268.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ga1La1,1,0.0,2.0,False,Ga2La2,Ga2La2,0.0,Other,True,Ga50La50,Ga-La,2,Supercon,Ga1La1,MP-mp-1002133,La2Ga2,Ga-La,Ga50La50,C m c m,orthorhombic,4.248501,4.569160000223256,6.245586979999999,data/final/MP/cifs/Ga1La1-MP-mp-1002133.cif,data/source/MP/raw/cifs/mp-1002133.cif,mp-1002133,0.0,,2016-07-27 04:12:18,6.140433114977302,10.17188/1274590,"@misc{osti_1274590,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaGa (SG:63) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1274590"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1677470'}},0.0,6.01089897,520.0,-18.29504608,-4.57376152,"{'tags': ['Lanthanum gallide (1/1)', 'Gallium lanthanum (1/1)', 'LaGa', 'TlI']}",-18.29504608,-4.57376152,-0.5917099562499999,"['xas', 'bandstructure']",True,"[634476, 634484, 423623]",True,2021-05-12 10:56:51.169000,NM,4,13,mp-1002133,,LaGa,"{'functional': 'PBE', 'labels': ['La', 'Ga_d'], 'pot_type': 'paw'}","{'La': 1.0, 'Ga': 1.0}",GGA,mp-1002133,"['mp-1065110', 'mp-1065017', 'mp-1065254', 'mp-1076914', 'mp-1002133', 'mp-1002161', 'mp-1002185', 'mp-1441457', 'mp-1677470', 'mp-1803934', 'mp-1002192', 'mp-1595586', 'mp-1065195']",0.0010764,"{'La': 2.0, 'Ga': 2.0}",112.83755342761896,[],NM,False,63,0,"[0, 0, 0, 0]",1.907875467524152e-05,0.0010764,0,0.0021528,MP,data/source/MP/cleaned/cifs/MP-mp-1002133.cif,False,,data/final/MP/graphs/Ga1La1-MP-mp-1002133.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ga2La1,1,0.0,1.0,True,Ga2La1,Ga2La1,0.575,Other,True,Ga66.667La33.333,Ga-La,2,Supercon,Ga2La1,MP-mp-19839,La1Ga2,Ga-La,Ga66.667La33.333,P 6/m m m,hexagonal,4.328900000613345,4.32889968,4.45379,data/final/MP/cifs/Ga2La1-MP-mp-19839.cif,data/source/MP/raw/cifs/mp-19839.cif,mp-19839,0.0,,2014-02-21 07:40:43,6.394803221708668,10.17188/1195032,"@misc{osti_1195032,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaGa2 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195032"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1673208'}},0.0,5.45973855,520.0,-13.10294252,-4.367647506666667,"{'tags': ['Gallium lanthanum (2/1)', 'Lanthanum digallide']}",-13.10294252,-4.367647506666667,-0.7035811233333327,"['xas', 'bandstructure']",True,"[103766, 634488, 634487, 103767, 409562, 657421]",True,2021-05-12 10:56:57.051000,NM,3,8,mp-19839,,LaGa2,"{'functional': 'PBE', 'labels': ['La', 'Ga_d'], 'pot_type': 'paw'}","{'La': 1.0, 'Ga': 2.0}",GGA,mp-19839,"['mp-991351', 'mp-993292', 'mp-19839', 'mp-1440061', 'mp-1673208', 'mp-1783191', 'mp-994600', 'mp-1587935']",0.0009804,"{'La': 1.0, 'Ga': 2.0}",72.27954858899255,[],NM,False,191,0,"[0, 0, 0]",1.3564002807694692e-05,0.0009804,0,0.0009804,MP,data/source/MP/cleaned/cifs/MP-mp-19839.cif,False,,data/final/MP/graphs/Ga2La1-MP-mp-19839.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
C1Y1,1,0.0,1.0,True,C1Y1,C1Y1,0.0,Other,True,C50Y50,C-Y,2,Supercon,C1Y1,MP-mp-998893,Y1C1,C-Y,C50Y50,F m -3 m,cubic,3.601825170000001,3.60182517,3.60182517,data/final/MP/cifs/C1Y1-MP-mp-998893.cif,data/source/MP/raw/cifs/mp-998893.cif,mp-998893,0.0,,2016-05-18 03:19:49,5.07175896514963,10.17188/1317410,"@misc{osti_1317410,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YC (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1317410"",
    place = ""United States"",
    year = ""2016"",
    month = ""5"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672918'}},0.3602082225000007,3.24198222,520.0,-15.60630618,-7.80315309,"{'tags': ['Yttrium carbide (1/1) - RS-type', 'NaCl', 'Yttrium carbide (1/1) - B1', 'YC0.33 ht']}",-15.60630618,-7.80315309,0.0434728166666662,"['xas', 'elasticity', 'bandstructure']",True,"[183159, 181049]",True,2021-05-12 10:56:37.246000,NM,2,15,mp-998893,,YC,"{'functional': 'PBE', 'labels': ['Y_sv', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'C': 1.0}",GGA,mp-998893,"['mp-998909', 'mp-998904', 'mp-998893', 'mp-1057858', 'mp-1057865', 'mp-1057887', 'mp-1061496', 'mp-1061514', 'mp-1061543', 'mp-1416732', 'mp-1672918', 'mp-1793522', 'mp-1607677', 'mp-1061544', 'mp-1057890']",0.0005036,"{'Y': 1.0, 'C': 1.0}",33.040977478027344,[],NM,False,225,0,"[0, 0]",1.5241679830292557e-05,0.0005036,0,0.0005036,MP,data/source/MP/cleaned/cifs/MP-mp-998893.cif,False,,data/final/MP/graphs/C1Y1-MP-mp-998893.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
As2Co0.1Fe1.9Mg1Sr4Ti1O6,2,0.0125,1.0,True,As2Co0.1Fe1.9Mg1Sr4Ti1O6,As2Fe2Mg1Sr4Ti1O6,24.1,Ferrite,True,As12.5Co0.625Fe11.875Mg6.25Sr25Ti6.25O37.5,As-Co-Fe-Mg-Sr-Ti-O,7,Supercon,Fe1.9Co0.1As2Sr4Mg1Ti1O6,MP-mp-1218475,Sr4Mg1Ti1Fe2As2O6,As-Fe-Mg-Sr-Ti-O,As12.5Fe12.5Mg6.25Sr25Ti6.25O37.5,P 4 m m,tetragonal,4.015363,4.015363,16.837343,data/final/MP/cifs/As2Co0.1Fe1.9Mg1Sr4Ti1O6-MP-mp-1218475-synth_doped.cif,data/source/MP/raw/cifs/mp-1218475.cif,mp-1218475,0.0,,2019-01-12 19:38:13.106000,4.772232743847063,,,,0.596506169999997,3.61641349,520.0,-93.06331959,-5.816457474375,{'tags': []},-93.06331959,-5.816457474375,-1.8435971231250008,[],False,[],True,2021-05-12 11:00:42.526000,FM,16,3,mp-1218475,oxide,Sr4MgTiFe2(AsO3)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Mg_pv', 'Ti_pv', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Sr': 4.0, 'Mg': 1.0, 'Ti': 1.0, 'Fe': 2.0, 'As': 2.0, 'O': 6.0}",GGA+U,mp-1218475,"['mp-1218475', 'mp-1332338', 'mp-1770100']",0.1094594,"{'Sr': 4.0, 'Mg': 1.0, 'Ti': 1.0, 'Fe': 2.0, 'As': 2.0, 'O': 6.0}",271.4708387835521,[],FM,True,25,1,"[-0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, 0.1, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0004032086852881,0.1094594,1,0.1094594,MP,data/source/MP/cleaned/cifs/MP-mp-1218475.cif,True,,data/final/MP/graphs/As2Co0.1Fe1.9Mg1Sr4Ti1O6-MP-mp-1218475-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
Bi2Ca1Cu2Sr2O8.118,2,0.0072849142302773,1.9709857600394187,False,Bi3.942Ca1.971Cu3.942Sr3.942O16,Bi4Ca2Cu4Sr4O16,91.0,Cuprate,True,Bi13.229Ca6.615Cu13.229Sr13.229O53.6975790448472,Bi-Ca-Cu-Sr-O,5,Supercon,Bi2Sr2Ca1Cu2O8.118,MP-mp-1218930,Sr4Ca2Cu4Bi4O16,Bi-Ca-Cu-Sr-O,Bi13.333Ca6.667Cu13.333Sr13.333O53.333333333333336,C c c 2,orthorhombic,5.417115,5.472898000129128,16.11398919,data/final/MP/cifs/Bi2Ca1Cu2Sr2O8.118-MP-mp-1218930-synth_doped.cif,data/source/MP/raw/cifs/mp-1218930.cif,mp-1218930,0.0,,2019-01-12 20:01:06.544000,6.266668983881059,,,,0.039252223722225,4.51768334,520.0,-173.15021002,-5.771673667333333,{'tags': []},-173.15021002,-5.771673667333333,-2.074956548222222,[],False,[],True,2021-05-12 11:00:42.526000,NM,30,3,mp-1218930,oxide,Sr2CaCu2(BiO4)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ca_sv', 'Cu_pv', 'Bi', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Bi': 2.0, 'O': 8.0}",GGA,mp-1218930,"['mp-1218930', 'mp-1359698', 'mp-1817714']",0.00011165,"{'Sr': 4.0, 'Ca': 2.0, 'Cu': 4.0, 'Bi': 4.0, 'O': 16.0}",470.7976286073367,[],NM,False,37,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.743014544498498e-07,0.00011165,0,0.0002233,MP,data/source/MP/cleaned/cifs/MP-mp-1218930.cif,True,,data/final/MP/graphs/Bi2Ca1Cu2Sr2O8.118-MP-mp-1218930-synth_doped.json,0,True,mm2,0,0,0,6,0,0,0,0,1,0,0,1.0,False
Al0.3Ge0.7Nb3,3,0.15,8.0,False,Al2.4Ge5.6Nb24,Ge8Nb24,9.1,Other,True,Al7.5Ge17.5Nb75,Al-Ge-Nb,3,Supercon,Nb3Al0.3Ge0.7,MP-mp-1198302,Nb24Ge8,Ge-Nb,Ge25Nb75,P 42/n,tetragonal,5.306278,10.359149,10.359149,data/final/MP/cifs/Al0.3Ge0.7Nb3-MP-mp-1198302-synth_doped.cif,data/source/MP/raw/cifs/mp-1198302.cif,mp-1198302,0.0,,2019-01-12 03:06:44.296000,8.196948021040575,,,{'GGA': {'task_id': 'mp-1742625'}},0.0019252397916673,5.75996855,520.0,-289.59347082,-9.049795963125,{'tags': ['Niobium germanide (3/1)']},-289.59347082,-9.049795963125,-0.318060219374999,[],False,[637202],True,2021-05-12 11:00:03.538000,NM,32,4,mp-1198302,,Nb3Ge,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Ge_d'], 'pot_type': 'paw'}","{'Nb': 3.0, 'Ge': 1.0}",GGA,mp-1198302,"['mp-1198302', 'mp-1395148', 'mp-1742625', 'mp-1889888']",7.45875e-05,"{'Nb': 24.0, 'Ge': 8.0}",569.4271349573957,[],NM,False,86,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.0478952676616736e-06,7.45875e-05,0,0.0005967,MP,data/source/MP/cleaned/cifs/MP-mp-1198302.cif,True,,data/final/MP/graphs/Al0.3Ge0.7Nb3-MP-mp-1198302-synth_doped.json,0,True,4/m,0,0,0,0,3,0,0,1,0,0,0,1.0,False
Al0.07B2Mg0.93,2,0.0466666666666666,1.0,True,Al0.07B2Mg0.93,B2Mg1,35.8,Other,True,Al2.333B66.667Mg31,Al-B-Mg,3,Supercon,Mg0.93Al0.07B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/Al0.07B2Mg0.93-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/Al0.07B2Mg0.93-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
As1Ru1,1,0.0,4.0,False,As4Ru4,As4Ru4,0.0,Other,True,As50Ru50,As-Ru,2,Supercon,As1Ru1,MP-mp-15650,As4Ru4,As-Ru,As50Ru50,P n m a,orthorhombic,3.352683,5.766234,6.42637,data/final/MP/cifs/As1Ru1-MP-mp-15650.cif,data/source/MP/raw/cifs/mp-15650.cif,mp-15650,0.0,,2011-05-29 08:50:51,9.409153356035254,10.17188/1191295,"@misc{osti_1191295,
    author = ""Persson, Kristin"",
    title = ""Materials Data on AsRu (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191295"",
    place = ""United States"",
    year = ""2015"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695137'}},0.0357557600000024,7.77684685,520.0,-57.83075908,-7.228844885,"{'tags': ['Ruthenarsenite', 'Ruthenium arsenide (1/1)', 'Ruthenium(III) arsenide']}",-57.83075908,-7.228844885,-0.2620908549999994,"['xas', 'bandstructure']",True,"[611293, 42577]",True,2021-05-12 10:56:53.126000,NM,8,8,mp-15650,,AsRu,"{'functional': 'PBE', 'labels': ['As', 'Ru_pv'], 'pot_type': 'paw'}","{'As': 1.0, 'Ru': 1.0}",GGA,mp-15650,"['mp-942479', 'mp-942865', 'mp-921019', 'mp-15650', 'mp-1413342', 'mp-1695137', 'mp-1802887', 'mp-1596913']",0.002763975,"{'As': 4.0, 'Ru': 4.0}",124.23686431085332,[],NM,False,62,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",8.899049457926602e-05,0.002763975,0,0.0110559,MP,data/source/MP/cleaned/cifs/MP-mp-15650.cif,False,,data/final/MP/graphs/As1Ru1-MP-mp-15650.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Rh1V3,1,0.0,2.0,False,Rh2V6,Rh2V6,0.19,Other,True,Rh25V75,Rh-V,2,Supercon,Rh1V3,MP-mp-1578,V6Rh2,Rh-V,Rh25V75,P m -3 n,cubic,4.782896,4.782896,4.782896,data/final/MP/cifs/Rh1V3-MP-mp-1578.cif,data/source/MP/raw/cifs/mp-1578.cif,mp-1578,0.0,,2011-05-14 11:21:55,7.762255950174997,10.17188/1191366,"@misc{osti_1191366,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Rh (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191366"",
    place = ""United States"",
    year = ""2015"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697569'}},0.0,6.45328063,520.0,-71.80599187,-8.97574898375,{'tags': ['Rhodium vanadium (1/3)']},-71.80599187,-8.97574898375,-0.3217424637500006,"['xas', 'elasticity', 'bandstructure']",True,"[105965, 650522, 650519, 650516]",True,2021-05-12 10:56:12.755000,NM,8,8,mp-1578,,V3Rh,"{'functional': 'PBE', 'labels': ['V_pv', 'Rh_pv'], 'pot_type': 'paw'}","{'V': 3.0, 'Rh': 1.0}",GGA,mp-1578,"['mp-942086', 'mp-943100', 'mp-932821', 'mp-1578', 'mp-1429630', 'mp-1697569', 'mp-1805182', 'mp-1593933']",0.00078655,"{'V': 6.0, 'Rh': 2.0}",109.41397919042969,[],NM,False,223,0,"[0, 0, 0, 0, 0, 0, 0, 0]",1.4377504699487225e-05,0.00078655,0,0.0015731,MP,data/source/MP/cleaned/cifs/MP-mp-1578.cif,False,,data/final/MP/graphs/Rh1V3-MP-mp-1578.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
La0.901Pr0.099Tl3,2,0.0494999999999999,1.0,True,La0.901Pr0.099Tl3,La1Tl3,0.55,Other,True,La22.525Pr2.475Tl75,La-Pr-Tl,3,Supercon,La0.901Pr0.099Tl3,MP-mp-2001,La1Tl3,La-Tl,La25Tl75,P m -3 m,cubic,4.907746,4.907746,4.907746,data/final/MP/cifs/La0.901Pr0.099Tl3-MP-mp-2001-synth_doped.cif,data/source/MP/raw/cifs/mp-2001.cif,mp-2001,0.0,,2011-05-13 03:01:14,10.564590817587634,10.17188/1195185,"@misc{osti_1195185,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaTl3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195185"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672173'}},0.0,7.0710754,520.0,-13.48295662,-3.370739155,{'tags': ['Lanthanum thallium (1/3)']},-13.48295662,-3.370739155,-0.3647550187499999,"['xas', 'elasticity', 'bandstructure']",True,"[642070, 642074, 104731, 191075]",True,2021-05-12 10:56:14.760000,NM,4,12,mp-2001,,LaTl3,"{'functional': 'PBE', 'labels': ['La', 'Tl_d'], 'pot_type': 'paw'}","{'La': 1.0, 'Tl': 3.0}",GGA,mp-2001,"['mp-912617', 'mp-929406', 'mp-929013', 'mp-2001', 'mp-1067206', 'mp-1067244', 'mp-1067279', 'mp-1437566', 'mp-1672173', 'mp-1784822', 'mp-1591944', 'mp-1067301']",0.0014032,"{'La': 1.0, 'Tl': 3.0}",118.20782685234924,[],NM,False,221,0,"[0, 0, 0, 0]",1.18706183622909e-05,0.0014032,0,0.0014032,MP,data/source/MP/cleaned/cifs/MP-mp-2001.cif,True,,data/final/MP/graphs/La0.901Pr0.099Tl3-MP-mp-2001-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Bi1Cu1,1,0.0,2.0,False,Bi2Cu2,Bi2Cu2,1.8,Other,True,Bi50Cu50,Bi-Cu,2,Supercon,Bi1Cu1,MP-mp-569792,Cu2Bi2,Bi-Cu,Bi50Cu50,P 63/m m c,hexagonal,4.4319339983031805,4.43193449,5.13717,data/final/MP/cifs/Bi1Cu1-MP-mp-569792.cif,data/source/MP/raw/cifs/mp-569792.cif,mp-569792,0.0,,2014-02-16 06:42:05,10.357297958809978,10.17188/1275266,"@misc{osti_1275266,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CuBi (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1275266"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1765089'}},0.1101925375000001,6.64669288,520.0,-15.53771181,-3.8844279525,{'tags': ['Bismuth copper (1/1)']},-15.53771181,-3.8844279525,0.1101925375000001,"['xas', 'bandstructure']",True,[616577],True,2021-05-12 10:57:24.969000,NM,4,8,mp-569792,,CuBi,"{'functional': 'PBE', 'labels': ['Cu_pv', 'Bi'], 'pot_type': 'paw'}","{'Cu': 1.0, 'Bi': 1.0}",GGA,mp-569792,"['mp-943727', 'mp-944366', 'mp-933512', 'mp-569792', 'mp-1402393', 'mp-1765089', 'mp-1781780', 'mp-1617755']",0.0016965,"{'Cu': 2.0, 'Bi': 2.0}",87.38586756499062,[],NM,False,194,0,"[0, 0, 0, 0]",3.8827788686500805e-05,0.0016965,0,0.003393,MP,data/source/MP/cleaned/cifs/MP-mp-569792.cif,False,,data/final/MP/graphs/Bi1Cu1-MP-mp-569792.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Ca1Cu2Hg1O6.27,2,0.02200488997555,0.9569875598086124,True,Ba1.914Ca0.957Cu1.914Hg0.957O6,Ba2Ca1Cu2Hg1O6,110.0,Cuprate,True,Ba16.3Ca8.15Cu16.3Hg8.15O51.100244498777506,Ba-Ca-Cu-Hg-O,5,Supercon,Hg1Ba2Ca1Cu2O6.27,MP-mp-6879,Ba2Ca1Cu2Hg1O6,Ba-Ca-Cu-Hg-O,Ba16.667Ca8.333Cu16.667Hg8.333O50,P 4/m m m,tetragonal,3.904834,3.904834,13.058604,data/final/MP/cifs/Ba2Ca1Cu2Hg1O6.27-MP-mp-6879-synth_doped.cif,data/source/MP/raw/cifs/mp-6879.cif,mp-6879,0.0,,2011-05-14 23:17:39,6.158075338837193,10.17188/1284432,"@misc{osti_1284432,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2CaCu2HgO6 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1284432"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698891'}},0.017586347638888,3.04291167,520.0,-64.08791228,-5.3406593566666665,"{'tags': ['High pressure experimental phase', 'Mercury dibarium calcium dicopper oxide', 'Mercury barium calcium copper oxide (1/2/1/2/6)']}",-64.08791228,-5.3406593566666665,-2.0147092504166664,"['bandstructure', 'elasticity']",True,"[83087, 75729, 75727, 75726, 75725, 75728]",True,2021-05-12 10:56:27.046000,NM,12,12,mp-6879,oxide,Ba2CaCu2HgO6,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Ca_sv', 'Cu_pv', 'Hg', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Hg': 1.0, 'O': 6.0}",GGA,mp-6879,"['mp-917434', 'mp-924375', 'mp-6879', 'mp-923788', 'mvc-16307', 'mp-1045026', 'mp-1045039', 'mp-1422313', 'mp-1698891', 'mp-1833979', 'mp-1592102', 'mp-1045044']",0.0305618,"{'Ba': 2.0, 'Ca': 1.0, 'Cu': 2.0, 'Hg': 1.0, 'O': 6.0}",199.11404926320108,[],NM,False,123,0,"[0.0, 0.0, 0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0001534889181004,0.0305618,0,0.0305618,MP,data/source/MP/cleaned/cifs/MP-mp-6879.cif,True,,data/final/MP/graphs/Ba2Ca1Cu2Hg1O6.27-MP-mp-6879-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ce1In5Ir1,1,0.0,1.0,True,Ce1In5Ir1,Ce1In5Ir1,0.770428571,Heavy_fermion,True,Ce14.286In71.429Ir14.286,Ce-In-Ir,3,Supercon,Ce1Ir1In5,MP-mp-20975,Ce1In5Ir1,Ce-In-Ir,Ce14.286In71.429Ir14.286,P 4/m m m,tetragonal,4.724199,4.724199,7.575801,data/final/MP/cifs/Ce1In5Ir1-MP-mp-20975.cif,data/source/MP/raw/cifs/mp-20975.cif,mp-20975,0.0,,2014-02-21 16:15:16,8.902153726103897,10.17188/1196209,"@misc{osti_1196209,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeIn5Ir (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196209"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688300'}},0.0,8.1498488,520.0,-31.20695684,-4.458136691428572,{'tags': ['Cerium iridium indide (1/1/5)']},-31.20695684,-4.458136691428572,-0.3824312307142854,"['xas', 'bandstructure']",True,[150225],True,2021-05-12 10:56:57.051000,FM,7,8,mp-20975,,CeIn5Ir,"{'functional': 'PBE', 'labels': ['Ce', 'In_d', 'Ir'], 'pot_type': 'paw'}","{'Ce': 1.0, 'In': 5.0, 'Ir': 1.0}",GGA,mp-20975,"['mp-919528', 'mp-918523', 'mp-905302', 'mp-20975', 'mp-1300982', 'mp-1688300', 'mp-1832383', 'mp-1591628']",0.1040192,"{'Ce': 1.0, 'In': 5.0, 'Ir': 1.0}",169.077152414387,[],FM,True,123,1,"[0.1, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0006152173638757,0.1040192,1,0.1040192,MP,data/source/MP/cleaned/cifs/MP-mp-20975.cif,False,,data/final/MP/graphs/Ce1In5Ir1-MP-mp-20975.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B2C1Gd1Ni2,1,0.0,1.0,True,B2C1Gd1Ni2,B2C1Gd1Ni2,0.0,Other,True,B33.333C16.667Gd16.667Ni33.333,B-C-Gd-Ni,4,Supercon,Gd1Ni2B2C1,MP-mp-20728,Gd1Ni2B2C1,B-C-Gd-Ni,B33.333C16.667Gd16.667Ni33.333,I 4/m m m,tetragonal,3.585321997303853,3.585321997303853,5.73680392,data/final/MP/cifs/B2C1Gd1Ni2-MP-mp-20728.cif,data/source/MP/raw/cifs/mp-20728.cif,mp-20728,0.0,,2014-02-21 09:39:31,7.738100830211668,10.17188/1195889,"@misc{osti_1195889,
    author = ""Persson, Kristin"",
    title = ""Materials Data on GdNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195889"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671216'}},0.0,6.43293366,520.0,-51.21064634,-8.535107723333333,{'tags': []},-51.21064634,-8.535107723333333,-0.4981144163888882,"['xas', 'bandstructure']",True,[79563],True,2021-05-12 10:56:57.051000,FM,6,5,mp-20728,,GdNi2B2C,"{'functional': 'PBE', 'labels': ['Gd', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Gd': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-20728,"['mp-20728', 'mp-1300449', 'mp-1671216', 'mp-1879352', 'mp-1593615']",7.0502106,"{'Gd': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",66.15234913878038,[],FM,True,139,1,"[6.9, 0.0, 0.0, 0.0, 0.0, 0.0]",0.1065753626558208,7.0502106,1,7.0502106,MP,data/source/MP/cleaned/cifs/MP-mp-20728.cif,False,,data/final/MP/graphs/B2C1Gd1Ni2-MP-mp-20728.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Sb1Sn1,1,0.0,1.0,True,Sb1Sn1,Sb1Sn1,1.43,Other,True,Sb50Sn50,Sb-Sn,2,Supercon,Sb1Sn1,MP-mp-10635,Sn1Sb1,Sb-Sn,Sb50Sn50,F m -3 m,cubic,4.37302128,4.37302128,4.37302128,data/final/MP/cifs/Sb1Sn1-MP-mp-10635.cif,data/source/MP/raw/cifs/mp-10635.cif,mp-10635,0.0,,2011-05-27 17:59:24,6.752743088929917,10.17188/1187247,"@misc{osti_1187247,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SnSb (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187247"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671515'}},0.0,6.96780292,520.0,-8.11438571,-4.057192855,"{'tags': ['Tin antimonide (1/1)', 'Tin antimonide (1/1) - HP', 'Stistaite', 'High pressure experimental phase']}",-8.11438571,-4.057192855,-0.0839063075000003,"['xas', 'elasticity', 'bandstructure']",True,"[52303, 52294]",True,2021-05-12 10:56:10.715000,NM,2,9,mp-10635,,SnSb,"{'functional': 'PBE', 'labels': ['Sn_d', 'Sb'], 'pot_type': 'paw'}","{'Sn': 1.0, 'Sb': 1.0}",GGA,mp-10635,"['mp-1007355', 'mp-1000906', 'mp-10635', 'mp-16229', 'mp-1439257', 'mp-1671515', 'mp-1792688', 'mp-1012119', 'mp-1590352']",0.000627,"{'Sn': 1.0, 'Sb': 1.0}",59.13298108436983,[],NM,False,225,0,"[0, 0]",1.060321986989643e-05,0.000627,0,0.000627,MP,data/source/MP/cleaned/cifs/MP-mp-10635.cif,False,,data/final/MP/graphs/Sb1Sn1-MP-mp-10635.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
As1Ce1F0.08Fe1O0.92,2,0.0399999999999999,2.0,False,As2Ce2F0.16Fe2O1.84,As2Ce2Fe2O2,27.6,Ferrite,True,As25Ce25F2Fe25O23,As-Ce-F-Fe-O,5,Supercon,Ce1Fe1As1F0.08O0.92,MP-mp-605060,Ce2Fe2As2O2,As-Ce-Fe-O,As25Ce25Fe25O25,P 4 m m,tetragonal,3.992256,3.992256,9.041971,data/final/MP/cifs/As1Ce1F0.08Fe1O0.92-MP-mp-605060-synth_doped.cif,data/source/MP/raw/cifs/mp-605060.cif,mp-605060,0.0,,2014-02-14 20:12:08,6.611233843492404,10.17188/1277425,"@misc{osti_1277425,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CeFeAsO (SG:99) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277425"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA+U': {'task_id': 'mp-1751604'}},0.2072581873958352,6.30288445,520.0,-55.74271596,-6.967839495,{'tags': []},-55.74271596,-6.967839495,-1.7010452412499992,['bandstructure'],True,[],True,2021-05-12 10:58:51.532000,FiM,8,10,mp-605060,oxide,CeFeAsO,"{'functional': 'PBE', 'labels': ['Ce', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-605060,"['mp-605060', 'mp-917114', 'mp-918266', 'mp-919274', 'mp-1443189', 'mp-1751604', 'mp-1770633', 'mp-1779614', 'mp-1873964', 'mp-1622328']",2.99945325,"{'Ce': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",144.11191005541338,[],FiM,True,99,3,"[-0.5, -0.5, 3.5, 3.5, 0.0, 0.0, 0.0, 0.0]",0.0416267225775671,2.99945325,4,5.9989065,MP,data/source/MP/cleaned/cifs/MP-mp-605060.cif,True,,data/final/MP/graphs/As1Ce1F0.08Fe1O0.92-MP-mp-605060-synth_doped.json,0,True,4mm,0,0,0,0,5,0,0,1,0,0,0,1.0,False
C1Hf0.9Nb0.1,3,0.0999999999999999,1.0,True,C1Hf0.9Nb0.1,C1Hf1,0.0,Other,True,C50Hf45Nb5,C-Hf-Nb,3,Supercon,C1Hf0.9Nb0.1,MP-mp-21075,Hf1C1,C-Hf,C50Hf50,F m -3 m,cubic,3.28897426,3.28897426,3.28897426,data/final/MP/cifs/C1Hf0.9Nb0.1-MP-mp-21075-synth_doped.cif,data/source/MP/raw/cifs/mp-21075.cif,mp-21075,0.0,,2014-02-15 06:54:13,12.57416771071356,10.17188/1196352,"@misc{osti_1196352,
    author = ""Persson, Kristin"",
    title = ""Materials Data on HfC (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196352"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686608'}},0.0,5.97796141,520.0,-21.06360483,-10.531802415,"{'tags': ['Hafnium carbide (1/1)', 'Hafnium carbide']}",-21.06360483,-10.531802415,-0.9398176399999992,"['xas', 'elasticity', 'bandstructure']",True,"[618012, 618010, 618002, 658336, 618020, 618017, 180600, 618008, 185978, 618018, 181793, 618016, 108134, 618005, 22262, 618000, 618013, 617997, 618011, 658398, 618001, 617998, 618015, 618004, 159873, 192046, 618009, 618003]",True,2021-05-12 10:56:16.728000,NM,2,17,mp-21075,,HfC,"{'functional': 'PBE', 'labels': ['Hf_pv', 'C'], 'pot_type': 'paw'}","{'Hf': 1.0, 'C': 1.0}",GGA,mp-21075,"['mp-919916', 'mp-906043', 'mp-918940', 'mp-21075', 'mp-1058491', 'mp-1058503', 'mp-1058524', 'mp-1061352', 'mp-1061374', 'mp-1061411', 'mp-1440553', 'mp-1686608', 'mp-1791532', 'mp-1590031', 'mp-1595311', 'mp-1058520', 'mp-1061403']",5.9e-05,"{'Hf': 1.0, 'C': 1.0}",25.1574387937518,[],NM,False,225,0,"[0, 0]",2.345230787748293e-06,5.9e-05,0,5.9e-05,MP,data/source/MP/cleaned/cifs/MP-mp-21075.cif,True,,data/final/MP/graphs/C1Hf0.9Nb0.1-MP-mp-21075-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
La2.85Pr0.15Se4,2,0.0428571428571428,2.0,False,La5.7Pr0.3Se8,La6Se8,4.81,Other,True,La40.714Pr2.143Se57.143,La-Pr-Se,3,Supercon,La2.85Pr0.15Se4,MP-mp-491,La6Se8,La-Se,La42.857Se57.143,I -4 3 d,cubic,7.877519491746323,7.87751949,7.87751949,data/final/MP/cifs/La2.85Pr0.15Se4-MP-mp-491-synth_doped.cif,data/source/MP/raw/cifs/mp-491.cif,mp-491,0.0,,2011-05-14 23:56:19,6.46507544280331,10.17188/1208484,"@misc{osti_1208484,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La3Se4 (SG:220) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208484"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1670698'}},0.0059004883928572,7.97223997,520.0,-85.7790007,-6.127071478571429,{'tags': ['Lanthanum selenide (3/4)']},-85.7790007,-6.127071478571429,-2.283690446339285,"['xas', 'bandstructure']",True,"[60208, 641916, 641938, 641920, 641931]",True,2021-05-12 10:57:08.928000,NM,14,9,mp-491,,La3Se4,"{'functional': 'PBE', 'labels': ['La', 'Se'], 'pot_type': 'paw'}","{'La': 3.0, 'Se': 4.0}",GGA,mp-491,"['mp-922256', 'mp-922010', 'mp-907667', 'mp-491', 'mp-1116362', 'mp-1435004', 'mp-1670698', 'mp-1843423', 'mp-1597749']",0.5037201,"{'La': 6.0, 'Se': 8.0}",376.3107014156632,[],NM,False,220,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0026771500151604,0.5037201,0,1.0074402,MP,data/source/MP/cleaned/cifs/MP-mp-491.cif,True,,data/final/MP/graphs/La2.85Pr0.15Se4-MP-mp-491-synth_doped.json,0,True,-43m,5,0,0,0,0,0,0,0,0,1,0,1.0,False
La2.916Pr0.084Tl1,2,0.042,1.0,True,La2.916Pr0.084Tl1,La3Tl1,7.7,Other,True,La72.9Pr2.1Tl25,La-Pr-Tl,3,Supercon,La2.916Pr0.084Tl1,MP-mp-371,La3Tl1,La-Tl,La75Tl25,P m -3 m,cubic,5.080077,5.080077,5.080077,data/final/MP/cifs/La2.916Pr0.084Tl1-MP-mp-371-synth_doped.cif,data/source/MP/raw/cifs/mp-371.cif,mp-371,0.0,,2011-05-13 01:00:39,7.866825897387702,10.17188/1207308,"@misc{osti_1207308,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La3Tl (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1207308"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1696891'}},0.0,8.20468759,520.0,-18.13168413,-4.5329210325,{'tags': ['Lanthanum thallium (3/1)']},-18.13168413,-4.5329210325,-0.240254917083333,"['xas', 'bandstructure']",True,"[642071, 104732]",True,2021-05-12 10:57:06.958000,NM,4,8,mp-371,,La3Tl,"{'functional': 'PBE', 'labels': ['La', 'Tl_d'], 'pot_type': 'paw'}","{'La': 3.0, 'Tl': 1.0}",GGA,mp-371,"['mp-929022', 'mp-912604', 'mp-929400', 'mp-371', 'mp-1441859', 'mp-1696891', 'mp-1779718', 'mp-1597062']",0.0883015,"{'La': 3.0, 'Tl': 1.0}",131.10247336875844,[],NM,False,221,0,"[0, 0, 0, 0]",0.0006735303898625,0.0883015,0,0.0883015,MP,data/source/MP/cleaned/cifs/MP-mp-371.cif,True,,data/final/MP/graphs/La2.916Pr0.084Tl1-MP-mp-371-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ge12Pt4U1,1,0.0,1.0,True,Ge12Pt4U1,Ge12Pt4U1,0.0,Heavy_fermion,True,Ge70.588Pt23.529U5.882,Ge-Pt-U,3,Supercon,U1Pt4Ge12,MP-mp-1189358,U1Ge12Pt4,Ge-Pt-U,Ge70.588Pt23.529U5.882,I m -3,cubic,7.5446089416725215,7.544608939999999,7.54460894,data/final/MP/cifs/Ge12Pt4U1-MP-mp-1189358.cif,data/source/MP/raw/cifs/mp-1189358.cif,mp-1189358,0.0,,2019-01-11 20:08:03.003000,9.49364331808112,,,{'GGA': {'task_id': 'mp-1674131'}},0.0583196532352952,4.76434373,520.0,-95.47426278,-5.616133104705883,"{'tags': ['LaFe4P12', 'UPt4Ge12', 'Uranium platinum germanide (1/4/12)']}",-95.47426278,-5.616133104705883,-0.2601698629411761,['bandstructure'],True,[189912],True,2021-05-12 10:58:33.577000,FM,17,4,mp-1189358,,U(Ge3Pt)4,"{'functional': 'PBE', 'labels': ['U', 'Ge_d', 'Pt'], 'pot_type': 'paw'}","{'U': 1.0, 'Ge': 12.0, 'Pt': 4.0}",GGA,mp-1189358,"['mp-1189358', 'mp-1435277', 'mp-1674131', 'mp-1637679']",0.2286674,"{'U': 1.0, 'Ge': 12.0, 'Pt': 4.0}",330.58893256565284,[],FM,True,204,1,"[0.2, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0006916970820086,0.2286674,1,0.2286674,MP,data/source/MP/cleaned/cifs/MP-mp-1189358.cif,False,,data/final/MP/graphs/Ge12Pt4U1-MP-mp-1189358.json,0,True,m-3,2,0,0,0,0,0,0,0,0,1,0,1.0,False
Al1Ge1,3,0.0909090909090908,10.0,False,Al10Ge10,Al12Ge10,5.5,Other,True,Al50Ge50,Al-Ge,2,Supercon,Al1Ge1,MP-mp-1190320,Al12Ge10,Al-Ge,Al54.545Ge45.455,R -3 c,trigonal,7.720881860000001,7.72088186,7.72088186,data/final/MP/cifs/Al1Ge1-MP-mp-1190320-synth_doped.cif,data/source/MP/raw/cifs/mp-1190320.cif,mp-1190320,0.4336000000000002,,2019-01-11 20:51:32.791000,3.871635308996453,,,{'GGA': {'task_id': 'mp-1674516'}},0.0475482163636371,4.53012758,520.0,-90.13112775,-4.096869443181818,{'tags': ['Aluminium germanium (6/5)']},-90.13112775,-4.096869443181818,0.0475482163636365,['bandstructure'],True,[193394],True,2021-05-12 10:58:33.577000,NM,22,5,mp-1190320,,Al6Ge5,"{'functional': 'PBE', 'labels': ['Al', 'Ge_d'], 'pot_type': 'paw'}","{'Al': 6.0, 'Ge': 5.0}",GGA,mp-1190320,"['mp-1190320', 'mp-1425937', 'mp-1674516', 'mp-1815567', 'mp-1610796']",0.00059395,"{'Al': 12.0, 'Ge': 10.0}",450.4201005175686,[],NM,False,167,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.6373156940265504e-06,0.00059395,0,0.0011879,MP,data/source/MP/cleaned/cifs/MP-mp-1190320.cif,True,,data/final/MP/graphs/Al1Ge1-MP-mp-1190320-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
N0.48Nb1,2,0.018018018018018,2.0,False,N0.96Nb2,N1Nb2,5.5,Other,True,N32.432Nb67.568,N-Nb,2,Supercon,N0.48Nb1,MP-mp-1220726,Nb2N1,N-Nb,N33.333Nb66.667,P -3 m 1,trigonal,3.157419999867271,3.15742006,4.856693,data/final/MP/cifs/N0.48Nb1-MP-mp-1220726-synth_doped.cif,data/source/MP/raw/cifs/mp-1220726.cif,mp-1220726,0.0,,2019-01-12 21:31:41.654000,7.913176866402883,,,{'GGA': {'task_id': 'mp-1734962'}},0.1173309299999996,6.40095003,520.0,-30.81361956,-10.27120652,{'tags': []},-30.81361956,-10.27120652,-0.8785048516666668,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,3,5,mp-1220726,,Nb2N,"{'functional': 'PBE', 'labels': ['Nb_pv', 'N'], 'pot_type': 'paw'}","{'Nb': 2.0, 'N': 1.0}",GGA,mp-1220726,"['mp-1220726', 'mp-1414021', 'mp-1734962', 'mp-1791625', 'mp-1612255']",0.0012896,"{'Nb': 2.0, 'N': 1.0}",41.931075874934535,[],NM,False,164,0,"[0, 0, 0]",3.075523279789952e-05,0.0012896,0,0.0012896,MP,data/source/MP/cleaned/cifs/MP-mp-1220726.cif,True,,data/final/MP/graphs/N0.48Nb1-MP-mp-1220726-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Fe0.135Ga1V2.865,3,0.0674999999999999,2.0,False,Fe0.27Ga2V5.73,Ga2V6,10.1,Other,True,Fe3.375Ga25V71.625,Fe-Ga-V,3,Supercon,V2.865Fe0.135Ga1,MP-mp-22568,V6Ga2,Ga-V,Ga25V75,P m -3 n,cubic,4.789645,4.789645,4.789645,data/final/MP/cifs/Fe0.135Ga1V2.865-MP-mp-22568-synth_doped.cif,data/source/MP/raw/cifs/mp-22568.cif,mp-22568,0.0,,2014-02-22 11:36:40,6.726541666276222,10.17188/1198793,"@misc{osti_1198793,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Ga (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198793"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686867'}},0.0,5.67452231,520.0,-61.95244347,-7.74405543375,{'tags': ['Gallium vanadium (1/3)']},-61.95244347,-7.74405543375,-0.1741018756249994,"['xas', 'elasticity', 'bandstructure']",True,"[635643, 635628, 635619, 635634, 104021, 635646, 635604, 635610, 635617, 635624, 635626, 635605, 635631, 635625, 635636, 635603, 104020, 635616, 635607]",True,2021-05-12 10:56:16.728000,FM,8,9,mp-22568,,V3Ga,"{'functional': 'PBE', 'labels': ['V_pv', 'Ga_d'], 'pot_type': 'paw'}","{'V': 3.0, 'Ga': 1.0}",GGA,mp-22568,"['mp-941343', 'mp-941663', 'mp-934924', 'mp-22568', 'mp-1440749', 'mp-1686867', 'mp-1804076', 'mp-1593784', 'mp-1595713']",0.09063635,"{'V': 6.0, 'Ga': 2.0}",109.87780534443452,[],FM,True,131,1,"[0.0, 0.0, 0.1, 0.1, 0.0, 0.0, -0.0, -0.0]",0.0016497662965852,0.09063635,2,0.1812727,MP,data/source/MP/cleaned/cifs/MP-mp-22568.cif,True,,data/final/MP/graphs/Fe0.135Ga1V2.865-MP-mp-22568-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Nb0.3Si1V2.7,3,0.1499999999999999,2.0,False,Nb0.6Si2V5.4,Si2V6,12.8,Other,True,Nb7.5Si25V67.5,Nb-Si-V,3,Supercon,V2.7Nb0.3Si1,MP-mp-2567,V6Si2,Si-V,Si25V75,P m -3 n,cubic,4.702381,4.702381,4.702381,data/final/MP/cifs/Nb0.3Si1V2.7-MP-mp-2567-synth_doped.cif,data/source/MP/raw/cifs/mp-2567.cif,mp-2567,0.0,,2011-05-13 19:15:43,5.778142190030859,10.17188/1200874,"@misc{osti_1200874,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Si (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1200874"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668672'}},0.0,7.30599425,520.0,-69.05773321,-8.63221665125,{'tags': ['Vanadium silicide (3/1)']},-69.05773321,-8.63221665125,-0.4452085937499994,"['xas', 'elasticity', 'bandstructure']",True,"[652491, 87328, 652522, 652502, 652510, 652520, 600518, 186003, 652507, 652513, 652497, 601150, 652514, 652487, 22412, 652509, 652529, 652532, 652499, 652539, 652537, 652533, 652512, 652538, 652490, 652493, 652494, 652511, 652519, 87329, 652526, 652500]",True,2021-05-12 10:56:18.721000,FM,8,13,mp-2567,,V3Si,"{'functional': 'PBE', 'labels': ['V_pv', 'Si'], 'pot_type': 'paw'}","{'V': 3.0, 'Si': 1.0}",GGA,mp-2567,"['mp-920081', 'mp-906309', 'mp-919083', 'mp-2567', 'mp-1078474', 'mp-1078852', 'mp-1138781', 'mp-1145907', 'mp-1440678', 'mp-1668672', 'mp-1795955', 'mp-1593554', 'mp-1596575']",0.8382519,"{'V': 6.0, 'Si': 2.0}",103.98086881866836,[],FM,True,131,1,"[0.2, 0.3, 0.3, 0.2, 0.3, 0.3, 0.0, 0.0]",0.0161231947669493,0.8382519,6,1.6765038,MP,data/source/MP/cleaned/cifs/MP-mp-2567.cif,True,,data/final/MP/graphs/Nb0.3Si1V2.7-MP-mp-2567-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Co0.3Cu2La2Ti1.7O10.82,3,0.0695005313496281,0.5,False,Ba1Co0.15Cu1La1Ti0.85O5.41,Ba1Cu1La1Ti1O6,0.0,Cuprate,True,Ba10.627Co1.594Cu10.627La10.627Ti9.033O57.49202975557917,Ba-Co-Cu-La-Ti-O,6,Supercon,La2Ba2Cu2Ti1.7Co0.3O10.82,MP-mp-1227852,Ba1La1Ti1Cu1O6,Ba-Cu-La-Ti-O,Ba10Cu10La10Ti10O60,F -4 3 m,cubic,5.61997722,5.619977219999999,5.619977219999999,data/final/MP/cifs/Ba2Co0.3Cu2La2Ti1.7O10.82-MP-mp-1227852-synth_doped.cif,data/source/MP/raw/cifs/mp-1227852.cif,mp-1227852,0.0,,2019-01-13 03:38:10.917000,6.398590577851808,,,{'GGA': {'task_id': 'mp-1734188'}},0.1228187138579528,4.96777084,520.0,-72.7941219,-7.279412189999999,{'tags': []},-72.7941219,-7.279412189999999,-2.8378679248333327,['bandstructure'],True,[],True,2021-05-12 10:58:49.477000,FM,10,5,mp-1227852,oxide,BaLaTiCuO6,"{'functional': 'PBE', 'labels': ['Ba_sv', 'La', 'Ti_pv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 1.0, 'La': 1.0, 'Ti': 1.0, 'Cu': 1.0, 'O': 6.0}",GGA,mp-1227852,"['mp-1227852', 'mp-1389128', 'mp-1734188', 'mp-1805149', 'mp-1621737']",1.9113509,"{'Ba': 1.0, 'La': 1.0, 'Ti': 1.0, 'Cu': 1.0, 'O': 6.0}",125.51298752546604,[],FM,True,216,1,"[0.0, 0.0, 0.0, 0.9, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0152283117283954,1.9113509,1,1.9113509,MP,data/source/MP/cleaned/cifs/MP-mp-1227852.cif,True,,data/final/MP/graphs/Ba2Co0.3Cu2La2Ti1.7O10.82-MP-mp-1227852-synth_doped.json,0,True,-43m,5,0,0,0,0,0,0,0,0,0,1,1.0,False
Ni33Zr67,2,0.0066666666666666,0.0596992311171415,False,Ni1.97Zr4,Ni2Zr4,2.6,Other,True,Ni33Zr67,Ni-Zr,2,Supercon,Ni33Zr67,MP-mp-328,Zr4Ni2,Ni-Zr,Ni33.333Zr66.667,I 4/m c m,tetragonal,5.262569995425936,5.300086679397286,5.30008668,data/final/MP/cifs/Ni33Zr67-MP-mp-328-synth_doped.cif,data/source/MP/raw/cifs/mp-328.cif,mp-328,0.0,,2011-05-13 23:00:52,7.189329355994663,10.17188/1206385,"@misc{osti_1206385,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Zr2Ni (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1206385"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1704571'}},0.0,5.05377097,520.0,-47.68946569,-7.948244281666667,{'tags': ['Nickel zirconium (1/2)']},-47.68946569,-7.948244281666667,-0.3230649683333328,"['xas', 'elasticity', 'bandstructure']",True,"[656070, 647167, 102805, 105479]",True,2021-05-12 10:56:20.740000,NM,6,11,mp-328,,Zr2Ni,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Ni_pv'], 'pot_type': 'paw'}","{'Zr': 2.0, 'Ni': 1.0}",GGA,mp-328,"['mp-918996', 'mp-919988', 'mp-906163', 'mp-604722', 'mp-328', 'mp-1076983', 'mp-1205320', 'mp-1413019', 'mp-1704571', 'mp-1802467', 'mp-1592827']",0.00134705,"{'Zr': 4.0, 'Ni': 2.0}",111.39417752247834,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0]",2.4185285621920005e-05,0.00134705,0,0.0026941,MP,data/source/MP/cleaned/cifs/MP-mp-328.cif,True,,data/final/MP/graphs/Ni33Zr67-MP-mp-328-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Er2Rh3Si5,1,0.0,2.0,False,Er4Rh6Si10,Er4Rh6Si10,0.0,Other,True,Er20Rh30Si50,Er-Rh-Si,3,Supercon,Er2Rh3Si5,MP-mp-1212876,Er4Si10Rh6,Er-Rh-Si,Er20Rh30Si50,I b a m,orthorhombic,5.745139999362158,8.12852914,8.128529139709382,data/final/MP/cifs/Er2Rh3Si5-MP-mp-1212876.cif,data/source/MP/raw/cifs/mp-1212876.cif,mp-1212876,0.0,,2019-01-12 14:59:20.558000,7.924805141321145,,,,0.0,7.32419684,520.0,-135.86199865,-6.7930999325000005,"{'tags': ['U2Co3Si5', 'Er2Rh3Si5']}",-135.86199865,-6.7930999325000005,-0.9576067995000004,[],False,[],True,2021-05-12 11:00:31.209000,NM,20,3,mp-1212876,,Er2Si5Rh3,"{'functional': 'PBE', 'labels': ['Er_3', 'Si', 'Rh_pv'], 'pot_type': 'paw'}","{'Er': 2.0, 'Si': 5.0, 'Rh': 3.0}",GGA,mp-1212876,"['mp-1212876', 'mp-1367683', 'mp-1812090']",0.0003043,"{'Er': 4.0, 'Si': 10.0, 'Rh': 6.0}",328.4122051720123,[],NM,False,72,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.8531588973108776e-06,0.0003043,0,0.0006086,MP,data/source/MP/cleaned/cifs/MP-mp-1212876.cif,False,,data/final/MP/graphs/Er2Rh3Si5-MP-mp-1212876.json,0,True,mmm,0,0,0,7,0,0,0,0,0,1,0,1.0,False
B2Dy1Ir3,1,0.0,1.0,True,B2Dy1Ir3,B2Dy1Ir3,0.0,Other,True,B33.333Dy16.667Ir50,B-Dy-Ir,3,Supercon,Dy1Ir3B2,MP-mp-1024993,Dy1B2Ir3,B-Dy-Ir,B33.333Dy16.667Ir50,P 6/m m m,hexagonal,3.160844,5.464852001600298,5.46485143,data/final/MP/cifs/B2Dy1Ir3-MP-mp-1024993.cif,data/source/MP/raw/cifs/mp-1024993.cif,mp-1024993,0.0,,2016-09-26 10:58:28,15.453033477566729,10.17188/1355489,"@article{osti_1355489,
    author = ""Persson, Kristin"",
    title = ""Materials Data on DyB2Ir3 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1355489"",
    place = ""United States"",
    year = ""2017"",
    month = ""5""
}
",{'GGA': {'task_id': 'mp-1702582'}},0.0,7.80253514,520.0,-48.64818876,-8.10803146,"{'tags': ['DyIr3B2', 'ErIr3B2', 'Dysprosium iridium boride (1/3/2)']}",-48.64818876,-8.10803146,-0.6945545197222222,"['bandstructure', 'elasticity']",True,[613640],True,2021-05-12 10:56:10.715000,NM,6,6,mp-1024993,,DyB2Ir3,"{'functional': 'PBE', 'labels': ['Dy_3', 'B', 'Ir'], 'pot_type': 'paw'}","{'Dy': 1.0, 'B': 2.0, 'Ir': 3.0}",GGA,mp-1024993,"['mp-1024993', 'mp-1207098', 'mp-1421089', 'mp-1702582', 'mp-1799949', 'mp-1588587']",0.0002234,"{'Dy': 1.0, 'B': 2.0, 'Ir': 3.0}",81.75050478913498,[],NM,False,191,0,"[0, 0, 0, 0, 0, 0]",2.7327048386579613e-06,0.0002234,0,0.0002234,MP,data/source/MP/cleaned/cifs/MP-mp-1024993.cif,False,,data/final/MP/graphs/B2Dy1Ir3-MP-mp-1024993.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Si1U1,1,0.0,4.0,False,Si4U4,Si4U4,0.0,Heavy_fermion,True,Si50U50,Si-U,2,Supercon,Si1U1,MP-mp-19715,U4Si4,Si-U,Si50U50,P n m a,orthorhombic,3.606532,5.022614,8.623904,data/final/MP/cifs/Si1U1-MP-mp-19715.cif,data/source/MP/raw/cifs/mp-19715.cif,mp-19715,0.0,,2014-02-21 13:04:18,11.314984795082772,10.17188/1194925,"@misc{osti_1194925,
    author = ""Persson, Kristin"",
    title = ""Materials Data on USi (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1194925"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703376'}},0.1004509887500013,11.13878291,520.0,-68.5434653,-8.5679331625,{'tags': ['Uranium silicide (1/1)']},-68.5434653,-8.5679331625,-0.1740711474999976,"['xas', 'bandstructure']",True,"[652481, 31647]",True,2021-05-12 10:56:57.051000,FM,8,9,mp-19715,,USi,"{'functional': 'PBE', 'labels': ['U', 'Si'], 'pot_type': 'paw'}","{'U': 1.0, 'Si': 1.0}",GGA,mp-19715,"['mp-907275', 'mp-921754', 'mp-920730', 'mp-19715', 'mp-1172322', 'mp-1418674', 'mp-1703376', 'mp-1790069', 'mp-1594443']",1.940791075,"{'U': 4.0, 'Si': 4.0}",156.21527805578535,[],FM,True,62,1,"[1.8, 1.8, 1.8, 1.8, 0.0, 0.0, 0.0, 0.0]",0.0496952948304309,1.940791075,4,7.7631643,MP,data/source/MP/cleaned/cifs/MP-mp-19715.cif,False,,data/final/MP/graphs/Si1U1-MP-mp-19715.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
La0.962Sn3Tm0.038,2,0.019,1.0,True,La0.962Sn3Tm0.038,La1Sn3,5.49,Other,True,La24.05Sn75Tm0.95,La-Sn-Tm,3,Supercon,La0.962Tm0.038Sn3,MP-mp-633,La1Sn3,La-Sn,La25Sn75,P m -3 m,cubic,4.820061,4.820061,4.820061,data/final/MP/cifs/La0.962Sn3Tm0.038-MP-mp-633-synth_doped.cif,data/source/MP/raw/cifs/mp-633.cif,mp-633,0.0,,2011-05-13 04:30:54,7.340536659909055,10.17188/1279358,"@misc{osti_1279358,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaSn3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1279358"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688008'}},0.0,8.68748013,520.0,-19.26482408,-4.81620602,"{'tags': ['Lanthanum stannide (1/3)', 'Lanthanum tin (1/3)']}",-19.26482408,-4.81620602,-0.5750253525,"['xas', 'bandstructure']",True,"[641991, 104721, 641986, 261870, 104720, 151359, 642000, 641998, 191074]",True,2021-05-12 10:57:30.779000,NM,4,12,mp-633,,LaSn3,"{'functional': 'PBE', 'labels': ['La', 'Sn_d'], 'pot_type': 'paw'}","{'La': 1.0, 'Sn': 3.0}",GGA,mp-633,"['mp-991111', 'mp-993073', 'mp-633', 'mp-1066557', 'mp-1066573', 'mp-1066594', 'mp-1442023', 'mp-1688008', 'mp-1787436', 'mp-994393', 'mp-1590336', 'mp-1066601']",0.0055557,"{'La': 1.0, 'Sn': 3.0}",111.98441958300587,[],NM,False,221,0,"[0, 0, 0, 0]",4.961136576577034e-05,0.0055557,0,0.0055557,MP,data/source/MP/cleaned/cifs/MP-mp-633.cif,True,,data/final/MP/graphs/La0.962Sn3Tm0.038-MP-mp-633-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ba0.64Bi1K0.36O3,2,0.0106666666666666,3.0,False,Ba1.92Bi3K1.08O9,Ba2Bi3K1O9,28.5,Oxide,True,Ba12.8Bi20K7.2O60,Ba-Bi-K-O,4,Supercon,Ba0.64K0.36Bi1O3,MP-mp-1223518,K1Ba2Bi3O9,Ba-Bi-K-O,Ba13.333Bi20K6.667O60,P -3 m 1,trigonal,6.18756400330999,6.187564340000001,7.581401,data/final/MP/cifs/Ba0.64Bi1K0.36O3-MP-mp-1223518-synth_doped.cif,data/source/MP/raw/cifs/mp-1223518.cif,mp-1223518,0.0,,2019-01-12 23:54:06.965000,7.16530091201999,,,{'GGA': {'task_id': 'mp-1729135'}},0.001551682833333,3.46143017,520.0,-85.22271396,-5.681514264,{'tags': []},-85.22271396,-5.681514264,-2.0170414252000004,[],False,[],True,2021-05-12 11:00:52.054000,NM,15,4,mp-1223518,oxide,KBa2(BiO3)3,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Bi', 'O'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 2.0, 'Bi': 3.0, 'O': 9.0}",GGA,mp-1223518,"['mp-1223518', 'mp-1391182', 'mp-1729135', 'mp-1775199']",4.99e-05,"{'K': 1.0, 'Ba': 2.0, 'Bi': 3.0, 'O': 9.0}",251.37352739849624,[],NM,False,164,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.9850936777799505e-07,4.99e-05,0,4.99e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1223518.cif,True,,data/final/MP/graphs/Ba0.64Bi1K0.36O3-MP-mp-1223518-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Al3Ca2Si4,3,0.1333333333333333,0.5,False,Al1.5Ca1Si2,Al2Ca1Si2,6.2,Other,True,Al33.333Ca22.222Si44.444,Al-Ca-Si,3,Supercon,Ca2Al3Si4,MP-mp-7704,Ca1Al2Si2,Al-Ca-Si,Al40Ca20Si40,P -3 m 1,trigonal,4.155346000837841,4.15534583,7.106862,data/final/MP/cifs/Al3Ca2Si4-MP-mp-7704-synth_doped.cif,data/source/MP/raw/cifs/mp-7704.cif,mp-7704,0.0,,2011-05-27 17:37:53,2.347097201078894,10.17188/1299756,"@misc{osti_1299756,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ca(AlSi)2 (SG:164) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1299756"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695480'}},0.0,5.45136951,520.0,-21.84505476,-4.369010952,{'tags': ['Calcium dialuminium silicide']},-21.84505476,-4.369010952,-0.2711350359999997,"['bandstructure', 'elasticity']",True,[20278],True,2021-05-12 10:56:29.056000,NM,5,10,mp-7704,,Ca(AlSi)2,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Al', 'Si'], 'pot_type': 'paw'}","{'Ca': 1.0, 'Al': 2.0, 'Si': 2.0}",GGA,mp-7704,"['mp-927783', 'mp-927398', 'mp-7704', 'mp-911442', 'mp-1171114', 'mp-1267188', 'mp-1422876', 'mp-1695480', 'mp-1866262', 'mp-1593164']",0.000888,"{'Ca': 1.0, 'Al': 2.0, 'Si': 2.0}",106.27298364595968,[],NM,False,164,0,"[0, 0, 0, 0, 0]",8.355839551454621e-06,0.000888,0,0.000888,MP,data/source/MP/cleaned/cifs/MP-mp-7704.cif,True,,data/final/MP/graphs/Al3Ca2Si4-MP-mp-7704-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Hf0.8Ta0.2V2,3,0.1333333333333333,2.0,False,Hf1.6Ta0.4V4,Hf2V4,9.54,Other,True,Hf26.667Ta6.667V66.667,Hf-Ta-V,3,Supercon,Hf0.8Ta0.2V2,MP-mp-1077017,Hf2V4,Hf-V,Hf33.333V66.667,I 41/a m d,tetragonal,5.147745850539648,5.14774585,5.14774585,data/final/MP/cifs/Hf0.8Ta0.2V2-MP-mp-1077017-synth_doped.cif,data/source/MP/raw/cifs/mp-1077017.cif,mp-1077017,0.0,,2018-04-07 18:44:03,9.47163160017764,,,{'GGA': {'task_id': 'mp-1759109'}},0.0337706083333326,5.06389256,520.0,-56.04737833,-9.341229721666666,{'tags': ['Hafnium vanadium (1/2)']},-56.04737833,-9.341229721666666,0.033770608333332,['bandstructure'],True,[187951],True,2021-05-12 10:58:14.654000,NM,6,5,mp-1077017,,HfV2,"{'functional': 'PBE', 'labels': ['Hf_pv', 'V_pv'], 'pot_type': 'paw'}","{'Hf': 1.0, 'V': 2.0}",GGA,mp-1077017,"['mp-1077017', 'mp-1391381', 'mp-1759109', 'mp-1796366', 'mp-1627385']",0.03458425,"{'Hf': 2.0, 'V': 4.0}",98.30836742237948,[],NM,False,141,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0007035871087434,0.03458425,0,0.0691685,MP,data/source/MP/cleaned/cifs/MP-mp-1077017.cif,True,,data/final/MP/graphs/Hf0.8Ta0.2V2-MP-mp-1077017-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Be13Th1,1,0.0,2.0,False,Be26Th2,Be26Th2,0.0,Other,True,Be92.857Th7.143,Be-Th,2,Supercon,Be13Th1,MP-mp-1562,Th2Be26,Be-Th,Be92.857Th7.143,F m -3 c,cubic,7.31089015,7.310890149999999,7.310890149999999,data/final/MP/cifs/Be13Th1-MP-mp-1562.cif,data/source/MP/raw/cifs/mp-1562.cif,mp-1562,0.0,,2011-05-15 11:47:49,4.197136620361269,10.17188/1191275,"@misc{osti_1191275,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ThBe13 (SG:226) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191275"",
    place = ""United States"",
    year = ""2015"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671375'}},0.0,4.91687049,520.0,-116.44955721,-4.1589127575,{'tags': ['Beryllium thorium (13/1)']},-116.44955721,-4.1589127575,-0.1570395078571433,"['xas', 'bandstructure']",True,"[58741, 616440, 659561, 616445, 58742, 600562, 58740]",True,2021-05-12 10:56:53.126000,NM,28,7,mp-1562,,ThBe13,"{'functional': 'PBE', 'labels': ['Th', 'Be_sv'], 'pot_type': 'paw'}","{'Th': 1.0, 'Be': 13.0}",GGA,mp-1562,"['mp-941426', 'mp-941112', 'mp-934587', 'mp-1562', 'mp-1419268', 'mp-1671375', 'mp-1608746']",0.0107694,"{'Th': 2.0, 'Be': 26.0}",276.3094746437798,[],NM,False,226,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",7.795172434013701e-05,0.0107694,0,0.0215388,MP,data/source/MP/cleaned/cifs/MP-mp-1562.cif,False,,data/final/MP/graphs/Be13Th1-MP-mp-1562.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ba0.4Bi1K0.6O3,3,0.1066666666666666,3.0,False,Ba1.2Bi3K1.8O9,Ba2Bi3K1O9,7.2,Oxide,True,Ba8Bi20K12O60,Ba-Bi-K-O,4,Supercon,Ba0.4K0.6Bi1O3,MP-mp-1223518,K1Ba2Bi3O9,Ba-Bi-K-O,Ba13.333Bi20K6.667O60,P -3 m 1,trigonal,6.18756400330999,6.187564340000001,7.581401,data/final/MP/cifs/Ba0.4Bi1K0.6O3-MP-mp-1223518-synth_doped.cif,data/source/MP/raw/cifs/mp-1223518.cif,mp-1223518,0.0,,2019-01-12 23:54:06.965000,7.16530091201999,,,{'GGA': {'task_id': 'mp-1729135'}},0.001551682833333,3.46143017,520.0,-85.22271396,-5.681514264,{'tags': []},-85.22271396,-5.681514264,-2.0170414252000004,[],False,[],True,2021-05-12 11:00:52.054000,NM,15,4,mp-1223518,oxide,KBa2(BiO3)3,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Bi', 'O'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 2.0, 'Bi': 3.0, 'O': 9.0}",GGA,mp-1223518,"['mp-1223518', 'mp-1391182', 'mp-1729135', 'mp-1775199']",4.99e-05,"{'K': 1.0, 'Ba': 2.0, 'Bi': 3.0, 'O': 9.0}",251.37352739849624,[],NM,False,164,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.9850936777799505e-07,4.99e-05,0,4.99e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1223518.cif,True,,data/final/MP/graphs/Ba0.4Bi1K0.6O3-MP-mp-1223518-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Os1P1Zr1,1,0.0,4.0,False,Os4P4Zr4,Os4P4Zr4,5.3525,Other,True,Os33.333P33.333Zr33.333,Os-P-Zr,3,Supercon,Zr1Os1P1,MP-mp-1102976,Zr4P4Os4,Os-P-Zr,Os33.333P33.333Zr33.333,P n m a,orthorhombic,3.934639,6.4887,7.354989,data/final/MP/cifs/Os1P1Zr1-MP-mp-1102976.cif,data/source/MP/raw/cifs/mp-1102976.cif,mp-1102976,0.0,,2018-07-18 16:23:32,11.051318396121166,,,{'GGA': {'task_id': 'mp-1695295'}},0.0,8.1590814,520.0,-111.87568726,-9.322973938333334,"{'tags': ['Osmium zirconium phosphide (1/1/1)', 'ZrOsP rt', 'AlB2 family', 'TiNiSi']}",-111.87568726,-9.322973938333334,-0.9268508077777788,['bandstructure'],True,[647720],True,2021-05-12 10:58:20.361000,NM,12,5,mp-1102976,,ZrPOs,"{'functional': 'PBE', 'labels': ['Zr_sv', 'P', 'Os_pv'], 'pot_type': 'paw'}","{'Zr': 1.0, 'P': 1.0, 'Os': 1.0}",GGA,mp-1102976,"['mp-1102976', 'mp-1414604', 'mp-1695295', 'mp-1830787', 'mp-1597645']",4.85e-06,"{'Zr': 4.0, 'P': 4.0, 'Os': 4.0}",187.77795940563863,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.0331350953757065e-07,4.85e-06,0,1.94e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1102976.cif,False,,data/final/MP/graphs/Os1P1Zr1-MP-mp-1102976.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Cu2Gd1Nb0.2Ru0.8Sr2O8,3,0.0285714285714285,2.0,False,Cu4Gd2Nb0.4Ru1.6Sr4O16,Cu4Gd2Ru2Sr4O16,0.0,Cuprate,True,Cu14.286Gd7.143Nb1.429Ru5.714Sr14.286O57.142857142857146,Cu-Gd-Nb-Ru-Sr-O,6,Supercon,Ru0.8Nb0.2Sr2Gd1Cu2O8,MP-mp-1194240,Sr4Gd2Cu4Ru2O16,Cu-Gd-Ru-Sr-O,Cu14.286Gd7.143Ru7.143Sr14.286O57.142857142857146,P 4/m b m,tetragonal,5.472451,5.472451,11.740702,data/final/MP/cifs/Cu2Gd1Nb0.2Ru0.8Sr2O8-MP-mp-1194240-synth_doped.cif,data/source/MP/raw/cifs/mp-1194240.cif,mp-1194240,0.0,,2019-01-11 23:51:58.932000,6.504561898971391,,,{'GGA': {'task_id': 'mp-1765260'}},0.0213449239285443,3.93502801,520.0,-201.55352223,-7.198340079642857,"{'tags': ['Sr2Cu2GdRuO8 orth', 'Sr2Cu2GdRuO8', 'Ruthenium distrontium gadolinium dicopper octaoxide']}",-201.55352223,-7.198340079642857,-2.268654352380952,['bandstructure'],True,[245741],True,2021-05-12 10:58:35.561000,FiM,28,6,mp-1194240,oxide,Sr2GdCu2RuO8,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Gd', 'Cu_pv', 'Ru_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Gd': 1.0, 'Cu': 2.0, 'Ru': 1.0, 'O': 8.0}",GGA,mp-1194240,"['mp-1194240', 'mp-1396976', 'mp-1659973', 'mp-1765260', 'mp-1841948', 'mp-1638264']",4.23696715,"{'Sr': 4.0, 'Gd': 2.0, 'Cu': 4.0, 'Ru': 2.0, 'O': 16.0}",351.6072554818909,[],FiM,True,127,2,"[-0.0, -0.0, -0.0, -0.0, 6.9, 6.9, 0.0, 0.0, 0.0, 0.0, -1.8, -1.8, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0241005672319991,4.23696715,4,8.4739343,MP,data/source/MP/cleaned/cifs/MP-mp-1194240.cif,True,,data/final/MP/graphs/Cu2Gd1Nb0.2Ru0.8Sr2O8-MP-mp-1194240-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Al1Ca1Si1,1,0.0,6.0,False,Al6Ca6Si6,Al6Ca6Si6,6.183529412,Other,True,Al33.333Ca33.333Si33.333,Al-Ca-Si,3,Supercon,Ca1Al1Si1,MP-mp-570150,Ca6Al6Si6,Al-Ca-Si,Al33.333Ca33.333Si33.333,P 63/m m c,hexagonal,4.205603999027224,4.20560495,26.286037,data/final/MP/cifs/Al1Ca1Si1-MP-mp-570150.cif,data/source/MP/raw/cifs/mp-570150.cif,mp-570150,0.0,,2014-02-24 13:50:40,2.3543653793046526,10.17188/1275544,"@misc{osti_1275544,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CaAlSi (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1275544"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672879'}},0.0,5.16367584,520.0,-74.06194177,-4.114552320555556,{'tags': ['Calcium aluminium silicide (1/1/1) - 6-fold stacking']},-74.06194177,-4.114552320555556,-0.3653890772222223,"['xas', 'elasticity', 'bandstructure']",True,[155193],True,2021-05-12 10:56:27.046000,NM,18,9,mp-570150,,CaAlSi,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Al', 'Si'], 'pot_type': 'paw'}","{'Ca': 1.0, 'Al': 1.0, 'Si': 1.0}",GGA,mp-570150,"['mp-914785', 'mp-1001443', 'mp-570150', 'mp-1171271', 'mp-1418814', 'mp-1672879', 'mp-1818754', 'mp-1007939', 'mp-1605163']",0.0018822666666666,"{'Ca': 6.0, 'Al': 6.0, 'Si': 6.0}",402.636026618248,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",2.8049154207226024e-05,0.0018822666666666,0,0.0112936,MP,data/source/MP/cleaned/cifs/MP-mp-570150.cif,False,,data/final/MP/graphs/Al1Ca1Si1-MP-mp-570150.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Li1.12Ti1.88O4,2,0.0342857142857143,2.0,False,Li2.24Ti3.76O8,Li2Ti4O8,9.9,Oxide,True,Li16Ti26.857O57.142857142857146,Li-Ti-O,3,Supercon,Li1.12Ti1.88O4,MP-mp-5670,Li2Ti4O8,Li-Ti-O,Li14.286Ti28.571O57.142857142857146,F d -3 m,cubic,5.986032260000001,5.98603226,5.98603226,data/final/MP/cifs/Li1.12Ti1.88O4-MP-mp-5670-synth_doped.cif,data/source/MP/raw/cifs/mp-5670.cif,mp-5670,0.0,,2011-05-14 11:10:22,3.649565337909552,10.17188/1273637,"@misc{osti_1273637,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LiTi2O4 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1273637"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699404'}},0.0,5.03116805,520.0,-114.93444733,-8.209603380714286,"{'tags': ['Lithium titanium oxide (1/2/4)', 'Lithium titanium(III) titanium(IV) oxide', 'Lithium titanium(III) titanium oxide', 'Lithium titanium titanium(III) oxide', 'Lithium titano(III)titanate', 'Spinel-(Li,Ti)']}",-114.93444733,-8.209603380714286,-3.2462103921428564,"['bandstructure', 'elasticity']",True,"[72859, 78482, 154982, 81329, 15789, 48127]",True,2021-05-12 10:56:22.739000,NM,14,7,mp-5670,oxide,LiTi2O4,"{'functional': 'PBE', 'labels': ['Li_sv', 'Ti_pv', 'O'], 'pot_type': 'paw'}","{'Li': 1.0, 'Ti': 2.0, 'O': 4.0}",GGA,mp-5670,"['mp-923613', 'mp-922835', 'mp-908534', 'mp-5670', 'mp-1418091', 'mp-1699404', 'mp-1787951']",0.0521081,"{'Li': 2.0, 'Ti': 4.0, 'O': 8.0}",151.67086379131675,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0006871207652868,0.0521081,0,0.1042162,MP,data/source/MP/cleaned/cifs/MP-mp-5670.cif,True,,data/final/MP/graphs/Li1.12Ti1.88O4-MP-mp-5670-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ce0.6La0.4Ru2,3,0.0666666666666666,2.0,False,Ce1.2La0.8Ru4,Ce1La1Ru4,1.3,Heavy_fermion,True,Ce20La13.333Ru66.667,Ce-La-Ru,3,Supercon,La0.4Ce0.6Ru2,MP-mp-1222913,La1Ce1Ru4,Ce-La-Ru,Ce16.667La16.667Ru66.667,F -4 3 m,cubic,5.407204540000001,5.40720454,5.40720454,data/final/MP/cifs/Ce0.6La0.4Ru2-MP-mp-1222913-synth_doped.cif,data/source/MP/raw/cifs/mp-1222913.cif,mp-1222913,0.0,,2019-01-12 23:22:50.626000,10.149813335401207,,,{'GGA': {'task_id': 'mp-1717130'}},0.0,8.64426336,520.0,-49.23252279,-8.205420465,{'tags': []},-49.23252279,-8.205420465,-0.2109779849999995,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,6,5,mp-1222913,,LaCeRu4,"{'functional': 'PBE', 'labels': ['La', 'Ce', 'Ru_pv'], 'pot_type': 'paw'}","{'La': 1.0, 'Ce': 1.0, 'Ru': 4.0}",GGA,mp-1222913,"['mp-1222913', 'mp-1394759', 'mp-1717130', 'mp-1804881', 'mp-1626317']",0.0208777,"{'La': 1.0, 'Ce': 1.0, 'Ru': 4.0}",111.79011354255184,[],NM,False,216,0,"[0.0, -0.0, 0.0, 0.0, 0.0, 0.0]",0.0001867580176672,0.0208777,0,0.0208777,MP,data/source/MP/cleaned/cifs/MP-mp-1222913.cif,True,,data/final/MP/graphs/Ce0.6La0.4Ru2-MP-mp-1222913-synth_doped.json,0,True,-43m,5,0,0,0,0,0,0,0,0,0,1,1.0,False
Cu0.95La2Li0.05O4,2,0.0142857142857142,1.0,True,Cu0.95La2Li0.05O4,Cu1La2O4,0.0,Cuprate,True,Cu13.571La28.571Li0.714O57.142857142857146,Cu-La-Li-O,4,Supercon,La2Cu0.95Li0.05O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu0.95La2Li0.05O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu0.95La2Li0.05O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ce1Ge2Ni2,1,0.0,1.0,True,Ce1Ge2Ni2,Ce1Ge2Ni2,0.216666667,Heavy_fermion,True,Ce20Ge40Ni40,Ce-Ge-Ni,3,Supercon,Ce1Ni2Ge2,MP-mp-3325,Ce1Ni2Ge2,Ce-Ge-Ni,Ce20Ge40Ni40,I 4/m m m,tetragonal,4.135880002625247,4.135880002625247,5.68757024,data/final/MP/cifs/Ce1Ge2Ni2-MP-mp-3325.cif,data/source/MP/raw/cifs/mp-3325.cif,mp-3325,0.0,,2011-05-13 19:07:11,8.01557866411645,10.17188/1206529,"@misc{osti_1206529,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ce(NiGe)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1206529"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1674259'}},0.0,7.89498798,520.0,-30.07640199,-6.015280398,{'tags': ['Cerium nickel germanide (1/2/2)']},-30.07640199,-6.015280398,-0.6673967529999999,"['xas', 'bandstructure']",True,"[621229, 107210, 106849, 621233]",True,2021-05-12 10:57:06.958000,FM,5,8,mp-3325,,Ce(NiGe)2,"{'functional': 'PBE', 'labels': ['Ce', 'Ni_pv', 'Ge_d'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Ni': 2.0, 'Ge': 2.0}",GGA,mp-3325,"['mp-906745', 'mp-920377', 'mp-921400', 'mp-3325', 'mp-1438684', 'mp-1674259', 'mp-1800888', 'mp-1587618']",0.5733892,"{'Ce': 1.0, 'Ni': 2.0, 'Ge': 2.0}",83.44208232260667,[],FM,True,139,1,"[0.5, -0.0, -0.0, 0.0, 0.0]",0.006871702911046,0.5733892,1,0.5733892,MP,data/source/MP/cleaned/cifs/MP-mp-3325.cif,False,,data/final/MP/graphs/Ce1Ge2Ni2-MP-mp-3325.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
C1Cr2Ga1,1,0.0,2.0,False,C2Cr4Ga2,C2Cr4Ga2,0.0,Other,True,C25Cr50Ga25,C-Cr-Ga,3,Supercon,C1Cr2Ga1,MP-mp-20197,Cr4Ga2C2,C-Cr-Ga,C25Cr50Ga25,P 63/m m c,hexagonal,2.872553998688006,2.87255336,12.531826,data/final/MP/cifs/C1Cr2Ga1-MP-mp-20197.cif,data/source/MP/raw/cifs/mp-20197.cif,mp-20197,0.0,,2014-02-21 13:49:56,6.887637825443649,10.17188/1195337,"@misc{osti_1195337,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Cr2GaC (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195337"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697761'}},0.0,6.71101713,520.0,-64.16742067,-8.02092758375,"{'tags': ['Chromium gallium carbide (2/1/1)', 'Chromium gallium carbide(2/1/1)']}",-64.16742067,-8.02092758375,-0.1306846681249993,"['xas', 'elasticity', 'bandstructure']",True,"[419116, 76801]",True,2021-05-12 10:56:14.760000,NM,8,8,mp-20197,,Cr2GaC,"{'functional': 'PBE', 'labels': ['Cr_pv', 'Ga_d', 'C'], 'pot_type': 'paw'}","{'Cr': 2.0, 'Ga': 1.0, 'C': 1.0}",GGA,mp-20197,"['mp-926296', 'mp-910530', 'mp-926837', 'mp-20197', 'mp-1415649', 'mp-1697761', 'mp-1782881', 'mp-1589173']",0.0167566,"{'Cr': 4.0, 'Ga': 2.0, 'C': 2.0}",89.55323158548329,[],NM,False,194,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0003742265846432,0.0167566,0,0.0335132,MP,data/source/MP/cleaned/cifs/MP-mp-20197.cif,False,,data/final/MP/graphs/C1Cr2Ga1-MP-mp-20197.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Cu1Tl1.7O6,3,0.0458793542905692,2.0,False,Ba4Cu2Tl3.4O12,Ba4Cu2Tl4O12,24.0,Cuprate,True,Ba18.692Cu9.346Tl15.888O56.074766355140184,Ba-Cu-Tl-O,4,Supercon,Tl1.7Ba2Cu1O6,MP-mp-6027,Ba4Tl4Cu2O12,Ba-Cu-Tl-O,Ba18.182Cu9.091Tl18.182O54.54545454545455,C m c a,orthorhombic,5.504110002693673,5.585743,12.28312762,data/final/MP/cifs/Ba2Cu1Tl1.7O6-MP-mp-6027-synth_doped.cif,data/source/MP/raw/cifs/mp-6027.cif,mp-6027,0.0,,2011-05-19 00:05:23,7.606665315628389,10.17188/1277350,"@misc{osti_1277350,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Tl2CuO6 (SG:64) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277350"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1673478'}},0.0059215576010052,4.10961464,520.0,-115.75418737,-5.261553971363636,"{'tags': ['Dithallium dibarium cuprate', 'Dithallium(III) dibarium copper oxide']}",-115.75418737,-5.261553971363636,-1.7862630028787878,"['xas', 'bandstructure']",True,"[202723, 202724, 202722]",True,2021-05-12 10:57:28.836000,NM,22,8,mp-6027,oxide,Ba2Tl2CuO6,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Tl_d', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Tl': 2.0, 'Cu': 1.0, 'O': 6.0}",GGA,mp-6027,"['mp-925246', 'mp-909581', 'mp-924678', 'mp-6027', 'mp-1504634', 'mp-1673478', 'mp-1837163', 'mp-1605186']",2.9e-05,"{'Ba': 4.0, 'Tl': 4.0, 'Cu': 2.0, 'O': 12.0}",368.0385386017736,[],NM,False,64,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.5759219189476614e-07,2.9e-05,0,5.8e-05,MP,data/source/MP/cleaned/cifs/MP-mp-6027.cif,True,,data/final/MP/graphs/Ba2Cu1Tl1.7O6-MP-mp-6027-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Ba2Cu2Nd2Ti2O11,1,0.0,1.0,True,Ba2Cu2Nd2Ti2O11,Ba2Cu2Nd2Ti2O11,0.0,Cuprate,True,Ba10.526Cu10.526Nd10.526Ti10.526O57.89473684210527,Ba-Cu-Nd-Ti-O,5,Supercon,Nd2Ba2Cu2Ti2O11,MP-mp-557043,Ba2Nd2Ti2Cu2O11,Ba-Cu-Nd-Ti-O,Ba10.526Cu10.526Nd10.526Ti10.526O57.89473684210527,P 4/m m m,tetragonal,3.937893,3.937893,16.03637,data/final/MP/cifs/Ba2Cu2Nd2Ti2O11-MP-mp-557043.cif,data/source/MP/raw/cifs/mp-557043.cif,mp-557043,0.0,,2014-03-21 17:50:18,6.423489915304013,10.17188/1269671,"@misc{osti_1269671,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ba2Nd2Ti2Cu2O11 (SG:123) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1269671"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1705848'}},0.0219658294736904,4.03119509,520.0,-141.65509819,-7.45553148368421,{'tags': ['Dineodymium dibarium dicopper dititanium oxide']},-141.65509819,-7.45553148368421,-3.0221527200877176,"['xas', 'bandstructure']",True,[75342],True,2021-05-12 10:57:19.246000,NM,19,8,mp-557043,oxide,Ba2Nd2Ti2Cu2O11,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Nd_3', 'Ti_pv', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Nd': 2.0, 'Ti': 2.0, 'Cu': 2.0, 'O': 11.0}",GGA,mp-557043,"['mp-908761', 'mp-924365', 'mp-923779', 'mp-557043', 'mp-1425576', 'mp-1705848', 'mp-1775561', 'mp-1604704']",7.81e-05,"{'Ba': 2.0, 'Nd': 2.0, 'Ti': 2.0, 'Cu': 2.0, 'O': 11.0}",248.6760101077176,[],NM,False,123,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",3.140632663607956e-07,7.81e-05,0,7.81e-05,MP,data/source/MP/cleaned/cifs/MP-mp-557043.cif,False,,data/final/MP/graphs/Ba2Cu2Nd2Ti2O11-MP-mp-557043.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Fe1.7Se2Tl1,3,0.076595744680851,1.0,True,Fe1.7Se2Tl1,Fe2Se2Tl1,22.4,Ferrite,True,Fe36.17Se42.553Tl21.277,Fe-Se-Tl,3,Supercon,Tl1Fe1.7Se2,MP-mp-3021,Tl1Fe2Se2,Fe-Se-Tl,Fe40Se40Tl20,I 4/m m m,tetragonal,3.70269200228356,3.70269200228356,8.12749565,data/final/MP/cifs/Fe1.7Se2Tl1-MP-mp-3021-synth_doped.cif,data/source/MP/raw/cifs/mp-3021.cif,mp-3021,0.0,,2011-05-13 05:18:27,7.461408046575831,10.17188/1204622,"@misc{osti_1204622,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Tl(FeSe)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1204622"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1703630'}},0.031691424499999,4.8946314,520.0,-27.43246193,-5.486492386,{'tags': ['Iron thallium selenide (2/1/2)']},-27.43246193,-5.486492386,-0.4163957856041662,"['xas', 'elasticity', 'bandstructure']",True,"[633510, 53544, 604465]",True,2021-05-12 10:56:18.721000,FM,5,8,mp-3021,,Tl(FeSe)2,"{'functional': 'PBE', 'labels': ['Tl_d', 'Fe_pv', 'Se'], 'pot_type': 'paw'}","{'Tl': 1.0, 'Fe': 2.0, 'Se': 2.0}",GGA,mp-3021,"['mp-1007412', 'mp-1000942', 'mp-3021', 'mp-1441637', 'mp-1703630', 'mp-1796502', 'mp-1012173', 'mp-1588982']",5.7535461,"{'Tl': 1.0, 'Fe': 2.0, 'Se': 2.0}",105.48738080580652,[],FM,True,139,1,"[0.0, 2.7, 2.7, 0.0, 0.0]",0.0545425059950232,5.7535461,2,5.7535461,MP,data/source/MP/cleaned/cifs/MP-mp-3021.cif,True,,data/final/MP/graphs/Fe1.7Se2Tl1-MP-mp-3021-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B2C1Mn0.1Ni1.9Y1,2,0.0333333333333333,1.0,True,B2C1Mn0.1Ni1.9Y1,B2C1Ni2Y1,12.7,Other,True,B33.333C16.667Mn1.667Ni31.667Y16.667,B-C-Mn-Ni-Y,5,Supercon,Y1Ni1.9Mn0.1B2C1,MP-mp-6576,Y1Ni2B2C1,B-C-Ni-Y,B33.333C16.667Ni33.333Y16.667,I 4/m m m,tetragonal,3.548790000501972,3.548790000501972,5.76144136,data/final/MP/cifs/B2C1Mn0.1Ni1.9Y1-MP-mp-6576-synth_doped.cif,data/source/MP/raw/cifs/mp-6576.cif,mp-6576,0.0,,2011-05-13 05:21:43,6.099730998852292,10.17188/1281366,"@misc{osti_1281366,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281366"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688230'}},0.0,6.81083016,520.0,-43.677878,-7.279646333333333,{'tags': []},-43.677878,-7.279646333333333,-0.5109282141666659,"['xas', 'bandstructure']",True,"[75816, 89142, 83231, 79574, 41549]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6576,,YNi2B2C,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6576,"['mp-6576', 'mp-1007054', 'mp-1000583', 'mp-1439516', 'mp-1688230', 'mp-1794280', 'mp-1011792', 'mp-1597064']",0.0006603,"{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.3152437079014,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",1.010943177297096e-05,0.0006603,0,0.0006603,MP,data/source/MP/cleaned/cifs/MP-mp-6576.cif,True,,data/final/MP/graphs/B2C1Mn0.1Ni1.9Y1-MP-mp-6576-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ir2Sc1,1,0.0,2.0,False,Ir4Sc2,Ir4Sc2,1.55,Other,True,Ir66.667Sc33.333,Ir-Sc,2,Supercon,Ir2Sc1,MP-mp-2263,Sc2Ir4,Ir-Sc,Ir66.667Sc33.333,F d -3 m,cubic,5.2414276,5.2414276,5.2414276,data/final/MP/cifs/Ir2Sc1-MP-mp-2263.cif,data/source/MP/raw/cifs/mp-2263.cif,mp-2263,0.0,,2011-05-13 07:29:36,14.005452787989112,10.17188/1198838,"@misc{osti_1198838,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ScIr2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1198838"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695167'}},0.0059821416666654,7.34704227,520.0,-52.5840874,-8.764014566666667,{'tags': ['Iridium scandium (2/1)']},-52.5840874,-8.764014566666667,-0.7609045849999999,"['xas', 'elasticity', 'bandstructure']",True,"[104559, 104558, 657997, 640973]",True,2021-05-12 10:56:16.728000,NM,6,8,mp-2263,,ScIr2,"{'functional': 'PBE', 'labels': ['Sc_sv', 'Ir'], 'pot_type': 'paw'}","{'Sc': 1.0, 'Ir': 2.0}",GGA,mp-2263,"['mp-912592', 'mp-929386', 'mp-929009', 'mp-2263', 'mp-1441364', 'mp-1695167', 'mp-1938597', 'mp-1592501']",0.00046965,"{'Sc': 2.0, 'Ir': 4.0}",101.82016025806912,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",9.225088603468011e-06,0.00046965,0,0.0009393,MP,data/source/MP/cleaned/cifs/MP-mp-2263.cif,False,,data/final/MP/graphs/Ir2Sc1-MP-mp-2263.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
B2C1Ni2Tb0.35Y0.65,2,0.05,2.0,False,B4C2Ni4Tb0.7Y1.3,B4C2Ni4Tb1Y1,4.6,Other,True,B33.333C16.667Ni33.333Tb5.833Y10.833,B-C-Ni-Tb-Y,5,Supercon,Y0.65Tb0.35Ni2B2C1,MP-mp-1217431,Tb1Y1Ni4B4C2,B-C-Ni-Tb-Y,B33.333C16.667Ni33.333Tb8.333Y8.333,P 4/m m m,tetragonal,3.539436,3.539436,10.45541,data/final/MP/cifs/B2C1Ni2Tb0.35Y0.65-MP-mp-1217431-synth_doped.cif,data/source/MP/raw/cifs/mp-1217431.cif,mp-1217431,0.0,,2019-01-12 18:46:06.865000,6.97108030500507,,,,0.0041270833333326,6.7890327,520.0,-85.48190522,-7.123492101666667,{'tags': []},-85.48190522,-7.123492101666667,-0.5074494002777771,[],False,[],True,2021-05-12 11:00:40.103000,NM,12,2,mp-1217431,,TbYNi4(B2C)2,"{'functional': 'PBE', 'labels': ['Tb_3', 'Y_sv', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Tb': 1.0, 'Y': 1.0, 'Ni': 4.0, 'B': 4.0, 'C': 2.0}",GGA,mp-1217431,"['mp-1217431', 'mp-1878575']",0.0057348,"{'Tb': 1.0, 'Y': 1.0, 'Ni': 4.0, 'B': 4.0, 'C': 2.0}",130.98126957504488,[],NM,False,123,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",4.37833593963928e-05,0.0057348,0,0.0057348,MP,data/source/MP/cleaned/cifs/MP-mp-1217431.cif,True,,data/final/MP/graphs/B2C1Ni2Tb0.35Y0.65-MP-mp-1217431-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ti1Zn2,1,0.0,4.0,False,Ti4Zn8,Ti4Zn8,0.0,Other,True,Ti33.333Zn66.667,Ti-Zn,2,Supercon,Ti1Zn2,MP-mp-30882,Ti4Zn8,Ti-Zn,Ti33.333Zn66.667,P 63/m m c,hexagonal,5.083090004043935,5.08309081,8.171311,data/final/MP/cifs/Ti1Zn2-MP-mp-30882.cif,data/source/MP/raw/cifs/mp-30882.cif,mp-30882,0.0,,2014-02-20 22:29:34,6.491112306470398,10.17188/1205235,"@misc{osti_1205235,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TiZn2 (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1205235"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698236'}},0.0,4.01648873,520.0,-44.03559326,-3.6696327716666666,{'tags': ['Titanium zinc (1/2)']},-44.03559326,-3.6696327716666666,-0.1979730261111113,"['bandstructure', 'elasticity']",True,[106184],True,2021-05-12 10:56:18.721000,FM,12,8,mp-30882,,TiZn2,"{'functional': 'PBE', 'labels': ['Ti_pv', 'Zn'], 'pot_type': 'paw'}","{'Ti': 1.0, 'Zn': 2.0}",GGA,mp-30882,"['mp-943129', 'mp-942111', 'mp-30882', 'mp-932848', 'mp-1418260', 'mp-1698236', 'mp-1831783', 'mp-1597686']",1.16356735,"{'Ti': 4.0, 'Zn': 8.0}",182.84288368861183,[],FM,True,194,1,"[0.9, 0.9, 0.9, 0.9, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0254550207593881,1.16356735,4,4.6542694,MP,data/source/MP/cleaned/cifs/MP-mp-30882.cif,False,,data/final/MP/graphs/Ti1Zn2-MP-mp-30882.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
In0.83Te1,3,0.092896174863388,1.0,True,In0.83Te1,In1Te1,1.15,Other,True,In45.355Te54.645,In-Te,2,Supercon,In0.83Te1,MP-mp-2597,In1Te1,In-Te,In50Te50,F m -3 m,cubic,4.44363296,4.44363296,4.44363296,data/final/MP/cifs/In0.83Te1-MP-mp-2597-synth_doped.cif,data/source/MP/raw/cifs/mp-2597.cif,mp-2597,0.0,,2011-05-12 18:35:42,6.488053472608879,10.17188/1201088,"@misc{osti_1201088,
    author = ""Persson, Kristin"",
    title = ""Materials Data on InTe (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1201088"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1668520'}},0.0,6.3140604,520.0,-6.47268679,-3.236343395,"{'tags': ['Indium telluride (1/1)', 'Indium tellurium (1/1) - HP, HT', 'High pressure experimental phase', 'Indium telluride  - II']}",-6.47268679,-3.236343395,-0.4998510649999996,"['xas', 'elasticity', 'bandstructure']",True,"[169425, 44653, 169422, 59547, 169428, 640620, 640614, 169431, 169419, 640622]",True,2021-05-12 10:56:18.721000,NM,2,9,mp-2597,,InTe,"{'functional': 'PBE', 'labels': ['In_d', 'Te'], 'pot_type': 'paw'}","{'In': 1.0, 'Te': 1.0}",GGA,mp-2597,"['mp-1000805', 'mp-1007252', 'mp-2597', 'mp-1440879', 'mp-1668520', 'mp-1793575', 'mp-1011993', 'mp-1588148', 'mp-1589064']",0.0001824,"{'In': 1.0, 'Te': 1.0}",62.04396451824765,[],NM,False,225,0,"[0, 0]",2.939850820563773e-06,0.0001824,0,0.0001824,MP,data/source/MP/cleaned/cifs/MP-mp-2597.cif,True,,data/final/MP/graphs/In0.83Te1-MP-mp-2597-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
B6Sm0.01Y0.99,2,0.0028571428571428,1.0,True,B6Sm0.01Y0.99,B6Y1,0.0,Other,True,B85.714Sm0.143Y14.143,B-Sm-Y,3,Supercon,B6Sm0.01Y0.99,MP-mp-2203,Y1B6,B-Y,B85.714Y14.286,P m -3 m,cubic,4.1021,4.1021,4.1021,data/final/MP/cifs/B6Sm0.01Y0.99-MP-mp-2203-synth_doped.cif,data/source/MP/raw/cifs/mp-2203.cif,mp-2203,0.0,,2011-05-12 20:11:15,3.699194842606093,10.17188/1197299,"@misc{osti_1197299,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YB6 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197299"",
    place = ""United States"",
    year = ""2014"",
    month = ""11"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686414'}},0.0285229421428576,6.62579631,520.0,-49.33978236,-7.048540337142858,"{'tags': ['Yttrium boride (1/6)', 'Yttrium octahedro-hexaboride', 'Yttrium hexaboride']}",-49.33978236,-7.048540337142858,-0.3995658030952376,"['xas', 'elasticity', 'bandstructure']",True,"[194635, 615723, 54730, 615726, 615714, 659505, 76126, 615728, 615710]",True,2021-05-12 10:56:16.728000,NM,7,9,mp-2203,,YB6,"{'functional': 'PBE', 'labels': ['Y_sv', 'B'], 'pot_type': 'paw'}","{'Y': 1.0, 'B': 6.0}",GGA,mp-2203,"['mp-1000404', 'mp-1006875', 'mp-2203', 'mp-1077859', 'mp-1440131', 'mp-1686414', 'mp-1801281', 'mp-1011609', 'mp-1592923']",3.48e-05,"{'Y': 1.0, 'B': 6.0}",69.026957252261,[],NM,False,221,0,"[0, 0, 0, 0, 0, 0, 0]",5.041508620005138e-07,3.48e-05,0,3.48e-05,MP,data/source/MP/cleaned/cifs/MP-mp-2203.cif,True,,data/final/MP/graphs/B6Sm0.01Y0.99-MP-mp-2203-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Ir2Y3,1,0.0,14.0,False,Ir28Y42,Ir28Y42,1.61,Other,True,Ir40Y60,Ir-Y,2,Supercon,Ir2Y3,MP-mp-1204272,Y42Ir28,Ir-Y,Ir40Y60,I 4/m c m,tetragonal,11.302492000312675,11.302492000312675,14.9542356,data/final/MP/cifs/Ir2Y3-MP-mp-1204272.cif,data/source/MP/raw/cifs/mp-1204272.cif,mp-1204272,0.0,,2019-01-12 07:58:43.194000,9.375235951684328,,,,0.0168213613214298,5.04641891,520.0,-573.01968482,-8.185995497428571,"{'tags': ['Y3Ir2', 'Y3Rh2', 'Iridium yttrium (2/3)']}",-573.01968482,-8.185995497428571,-0.7707406614285706,[],False,[641179],True,2021-05-12 11:00:14.977000,NM,70,2,mp-1204272,,Y3Ir2,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ir'], 'pot_type': 'paw'}","{'Y': 3.0, 'Ir': 2.0}",GGA,mp-1204272,"['mp-1204272', 'mp-1325944']",0.0005674642857142,"{'Y': 42.0, 'Ir': 28.0}",1614.6448256601384,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.920277124569446e-06,0.0005674642857142,0,0.0079445,MP,data/source/MP/cleaned/cifs/MP-mp-1204272.cif,False,,data/final/MP/graphs/Ir2Y3-MP-mp-1204272.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ir1Sn4,1,0.0,4.0,False,Ir4Sn16,Ir4Sn16,0.93,Other,True,Ir20Sn80,Ir-Sn,2,Supercon,Ir1Sn4,MP-mp-31277,Sn16Ir4,Ir-Sn,Ir20Sn80,I 41/a c d,tetragonal,6.41742800017462,6.41742800017462,12.461457890000002,data/final/MP/cifs/Ir1Sn4-MP-mp-31277.cif,data/source/MP/raw/cifs/mp-31277.cif,mp-31277,0.0,,2014-02-21 03:24:51,9.269841022007958,10.17188/1205552,"@misc{osti_1205552,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sn4Ir (SG:142) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1205552"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1675228'}},0.0,8.28828609,520.0,-103.60325991,-5.1801629955,{'tags': ['Iridium tetrastannide - beta']},-103.60325991,-5.1801629955,-0.2048194275000007,"['xas', 'elasticity', 'bandstructure']",True,[412573],True,2021-05-12 10:56:20.740000,NM,20,8,mp-31277,,Sn4Ir,"{'functional': 'PBE', 'labels': ['Sn_d', 'Ir'], 'pot_type': 'paw'}","{'Sn': 4.0, 'Ir': 1.0}",GGA,mp-31277,"['mp-913414', 'mp-929912', 'mp-930465', 'mp-31277', 'mp-1382202', 'mp-1675228', 'mp-1824597', 'mp-1609902']",0.00531605,"{'Sn': 16.0, 'Ir': 4.0}",477.96902040465017,[],NM,False,142,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.448865740712161e-05,0.00531605,0,0.0212642,MP,data/source/MP/cleaned/cifs/MP-mp-31277.cif,False,,data/final/MP/graphs/Ir1Sn4-MP-mp-31277.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B2Co2La0.9Y0.1,2,0.0399999999999999,1.0,True,B2Co2La0.9Y0.1,B2Co2La1,4.175,Other,True,B40Co40La18Y2,B-Co-La-Y,4,Supercon,La0.9Y0.1Co2B2,MP-mp-2967,La1Co2B2,B-Co-La,B40Co40La20,I 4/m m m,tetragonal,3.601524002219649,3.601524002219649,5.71960196,data/final/MP/cifs/B2Co2La0.9Y0.1-MP-mp-2967-synth_doped.cif,data/source/MP/raw/cifs/mp-2967.cif,mp-2967,0.0,,2011-05-12 22:17:57,6.959059731671892,10.17188/1204151,"@misc{osti_1204151,
    author = ""Persson, Kristin"",
    title = ""Materials Data on La(CoB)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1204151"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672975'}},0.0,7.48878685,520.0,-34.90607271,-6.981214541999999,"{'tags': ['Lanthanum cobalt boride (1/2/2)', 'Cobalt lanthanum boride (2/1/2)']}",-34.90607271,-6.981214541999999,-0.4789292946666663,"['xas', 'elasticity', 'bandstructure']",True,"[55297, 181184, 182572, 181185, 423045, 41787, 613135, 182573]",True,2021-05-12 10:56:18.721000,NM,5,8,mp-2967,,La(CoB)2,"{'functional': 'PBE', 'labels': ['La', 'Co', 'B'], 'pot_type': 'paw'}","{'La': 1.0, 'Co': 2.0, 'B': 2.0}",GGA,mp-2967,"['mp-1007012', 'mp-1000544', 'mp-2967', 'mp-1442119', 'mp-1672975', 'mp-1782552', 'mp-1011750', 'mp-1589504']",0.0036472,"{'La': 1.0, 'Co': 2.0, 'B': 2.0}",66.42907206668119,[],NM,False,139,0,"[0.0, -0.0, -0.0, 0.0, 0.0]",5.4903672240656295e-05,0.0036472,0,0.0036472,MP,data/source/MP/cleaned/cifs/MP-mp-2967.cif,True,,data/final/MP/graphs/B2Co2La0.9Y0.1-MP-mp-2967-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
B1W2,1,0.0,2.0,False,B2W4,B2W4,2.133333333,Other,True,B33.333W66.667,B-W,2,Supercon,B1W2,MP-mp-1113,B2W4,B-W,B33.333W66.667,I 4/m c m,tetragonal,4.624722449860901,4.62472245,4.62472245,data/final/MP/cifs/B1W2-MP-mp-1113.cif,data/source/MP/raw/cifs/mp-1113.cif,mp-1113,0.0,,2011-05-13 04:56:32,16.759719411890774,10.17188/1187585,"@misc{osti_1187585,
    author = ""Persson, Kristin"",
    title = ""Materials Data on BW2 (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187585"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1671659'}},0.0,7.89423137,520.0,-66.76245649,-11.127076081666669,"{'tags': ['Tungsten boride (2/1) - gamma', 'Tungsten boride (2/1)']}",-66.76245649,-11.127076081666669,-0.2618611780555563,"['xas', 'elasticity', 'bandstructure']",True,"[615695, 615692, 24279, 108090, 42528]",True,2021-05-12 10:56:10.715000,NM,6,13,mp-1113,,BW2,"{'functional': 'PBE', 'labels': ['B', 'W_pv'], 'pot_type': 'paw'}","{'B': 1.0, 'W': 2.0}",GGA,mp-1113,"['mp-924862', 'mp-925466', 'mp-909835', 'mp-1113', 'mp-1071420', 'mp-1071433', 'mp-1071464', 'mp-1076979', 'mp-1437870', 'mp-1671659', 'mp-1802073', 'mp-1590387', 'mp-1071455']",0.0006164,"{'B': 2.0, 'W': 4.0}",75.00114726390821,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0]",1.6437081897722435e-05,0.0006164,0,0.0012328,MP,data/source/MP/cleaned/cifs/MP-mp-1113.cif,False,,data/final/MP/graphs/B1W2-MP-mp-1113.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
C0.5N0.47Nb1,2,0.0228426395939086,2.0,False,C1N0.94Nb2,C1N1Nb2,17.4,Other,True,C25.381N23.858Nb50.761,C-N-Nb,3,Supercon,Nb1C0.5N0.47,MP-mp-1220725,Nb2C1N1,C-N-Nb,C25N25Nb50,R -3 m,trigonal,3.176830066338471,3.176830066338471,5.50452744,data/final/MP/cifs/C0.5N0.47Nb1-MP-mp-1220725-synth_doped.cif,data/source/MP/raw/cifs/mp-1220725.cif,mp-1220725,0.0,,2019-01-12 21:31:38.750000,7.754501067535733,,,{'GGA': {'task_id': 'mp-1766607'}},0.0753444154166675,7.65744358,520.0,-40.59990484,-10.14997621,{'tags': []},-40.59990484,-10.14997621,-0.7987547837499989,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,4,5,mp-1220725,,Nb2CN,"{'functional': 'PBE', 'labels': ['Nb_pv', 'C', 'N'], 'pot_type': 'paw'}","{'Nb': 2.0, 'C': 1.0, 'N': 1.0}",GGA,mp-1220725,"['mp-1220725', 'mp-1422536', 'mp-1766607', 'mp-1794614', 'mp-1612365']",0.0016814,"{'Nb': 2.0, 'C': 1.0, 'N': 1.0}",45.36104297370486,[],NM,False,166,0,"[0, 0, 0, 0]",3.706704894273889e-05,0.0016814,0,0.0016814,MP,data/source/MP/cleaned/cifs/MP-mp-1220725.cif,True,,data/final/MP/graphs/C0.5N0.47Nb1-MP-mp-1220725-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
B1Ni2,1,0.0,2.0,False,B2Ni4,B2Ni4,0.0,Other,True,B33.333Ni66.667,B-Ni,2,Supercon,B1Ni2,MP-mp-2536,Ni4B2,B-Ni,B33.333Ni66.667,I 4/m c m,tetragonal,4.106782519615873,4.10678252,4.10678252,data/final/MP/cifs/B1Ni2-MP-mp-2536.cif,data/source/MP/raw/cifs/mp-2536.cif,mp-2536,0.0,,2011-05-13 15:13:22,8.108395590026472,10.17188/1200592,"@misc{osti_1200592,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Ni2B (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1200592"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686544'}},0.0,8.89423639,520.0,-38.21764562,-6.369607603333333,{'tags': ['Nickel boride (2/1)']},-38.21764562,-6.369607603333333,-0.2897192263888885,"['xas', 'elasticity', 'bandstructure']",True,"[30448, 42532, 603804, 614977, 75792, 108072, 614984]",True,2021-05-12 10:56:16.728000,NM,6,11,mp-2536,,Ni2B,"{'functional': 'PBE', 'labels': ['Ni_pv', 'B'], 'pot_type': 'paw'}","{'Ni': 2.0, 'B': 1.0}",GGA,mp-2536,"['mp-908794', 'mp-923771', 'mp-924348', 'mp-8107', 'mp-2536', 'mp-1077331', 'mp-1077764', 'mp-1439993', 'mp-1686544', 'mp-1794766', 'mp-1591709']",0.00222575,"{'Ni': 4.0, 'B': 2.0}",52.50791054497095,[],NM,False,69,0,"[-0.0, -0.0, 0.0, 0.0, 0.0, 0.0]",8.477770213666122e-05,0.00222575,0,0.0044515,MP,data/source/MP/cleaned/cifs/MP-mp-2536.cif,False,,data/final/MP/graphs/B1Ni2-MP-mp-2536.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As2Fe1.7Ni0.3Sr1,3,0.12,1.0,True,As2Fe1.7Ni0.3Sr1,As2Fe2Sr1,0.0,Ferrite,True,As40Fe34Ni6Sr20,As-Fe-Ni-Sr,4,Supercon,Sr1Fe1.7Ni0.3As2,MP-mp-4488,Sr1Fe2As2,As-Fe-Sr,As40Fe40Sr20,I 4/m m m,tetragonal,3.9729799997357778,3.9729799997357778,6.45523327,data/final/MP/cifs/As2Fe1.7Ni0.3Sr1-MP-mp-4488-synth_doped.cif,data/source/MP/raw/cifs/mp-4488.cif,mp-4488,0.0,,2011-05-13 03:37:13,6.319998834487784,10.17188/1208187,"@misc{osti_1208187,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sr(FeAs)2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1208187"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672865'}},0.0,5.13397273,520.0,-30.61898897,-6.123797794,"{'tags': ['Strontium diiron arsenide - HT', 'Strontium diiron arsenide', 'Strontium diiron diarsenide', 'Iron strontium arsenide (2/1/2)', 'Strontium diiron arsenide - LT']}",-30.61898897,-6.123797794,-0.5342483613333335,"['xas', 'elasticity', 'bandstructure']",True,"[182330, 181993, 610527, 163209, 163208, 163869]",True,2021-05-12 10:56:20.740000,NM,5,8,mp-4488,,Sr(FeAs)2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Fe': 2.0, 'As': 2.0}",GGA,mp-4488,"['mp-906356', 'mp-920135', 'mp-919110', 'mp-4488', 'mp-1439153', 'mp-1672865', 'mp-1873948', 'mp-1592272']",0.0029206,"{'Sr': 1.0, 'Fe': 2.0, 'As': 2.0}",91.7377588211838,[],NM,False,139,0,"[0.0, 0.0, 0.0, 0.0, 0.0]",3.183640016422098e-05,0.0029206,0,0.0029206,MP,data/source/MP/cleaned/cifs/MP-mp-4488.cif,True,,data/final/MP/graphs/As2Fe1.7Ni0.3Sr1-MP-mp-4488-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
La1Pt5,1,0.0,1.0,True,La1Pt5,La1Pt5,0.0,Other,True,La16.667Pt83.333,La-Pt,2,Supercon,La1Pt5,MP-mp-1832,La1Pt5,La-Pt,La16.667Pt83.333,P 6/m m m,hexagonal,4.448271,5.456941995598086,5.45694165,data/final/MP/cifs/La1Pt5-MP-mp-1832.cif,data/source/MP/raw/cifs/mp-1832.cif,mp-1832,0.0,,2011-05-13 09:09:39,16.1302332048178,10.17188/1193056,"@misc{osti_1193056,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaPt5 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1193056"",
    place = ""United States"",
    year = ""2016"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686477'}},0.0,7.38511995,520.0,-39.80382759,-6.633971265,{'tags': ['Lanthanum platinum (1/5)']},-39.80382759,-6.633971265,-0.7522136558333324,"['xas', 'bandstructure']",True,"[641705, 104702, 641698, 641697, 641694, 104703, 150749, 641690, 658353]",True,2021-05-12 10:56:55.092000,NM,6,12,mp-1832,,LaPt5,"{'functional': 'PBE', 'labels': ['La', 'Pt'], 'pot_type': 'paw'}","{'La': 1.0, 'Pt': 5.0}",GGA,mp-1832,"['mp-991706', 'mp-993616', 'mp-1832', 'mp-1072180', 'mp-1072220', 'mp-1072258', 'mp-1439968', 'mp-1686477', 'mp-1788830', 'mp-994929', 'mp-1590343', 'mp-1072261']",0.0042719,"{'La': 1.0, 'Pt': 5.0}",114.71507896672765,[],NM,False,191,0,"[0, 0, 0, 0, 0, 0]",3.723921945116768e-05,0.0042719,0,0.0042719,MP,data/source/MP/cleaned/cifs/MP-mp-1832.cif,False,,data/final/MP/graphs/La1Pt5-MP-mp-1832.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ba0.3Cu1La1.7O4,3,0.0857142857142857,1.0,True,Ba0.3Cu1La1.7O4,Cu1La2O4,9.7,Cuprate,True,Ba4.286Cu14.286La24.286O57.142857142857146,Ba-Cu-La-O,4,Supercon,La1.7Ba0.3Cu1O4,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Ba0.3Cu1La1.7O4-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Ba0.3Cu1La1.7O4-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Nd1Ru2,1,0.0,4.0,False,Nd4Ru8,Nd4Ru8,0.0,Other,True,Nd33.333Ru66.667,Nd-Ru,2,Supercon,Nd1Ru2,MP-mp-1102217,Nd4Ru8,Nd-Ru,Nd33.333Ru66.667,P 63/m m c,hexagonal,5.330790000492364,5.33079038,9.181975,data/final/MP/cifs/Nd1Ru2-MP-mp-1102217.cif,data/source/MP/raw/cifs/mp-1102217.cif,mp-1102217,0.0,,2018-07-18 13:50:36,10.181563559287392,,,{'GGA': {'task_id': 'mp-1695657'}},0.0,5.96912681,520.0,-95.14855462,-7.929046218333333,{'tags': ['Neodymium ruthenium (1/2)']},-95.14855462,-7.929046218333333,-0.156738711666667,['bandstructure'],True,"[645793, 645805]",True,2021-05-12 10:58:20.361000,NM,12,6,mp-1102217,,NdRu2,"{'functional': 'PBE', 'labels': ['Nd_3', 'Ru_pv'], 'pot_type': 'paw'}","{'Nd': 1.0, 'Ru': 2.0}",GGA,mp-1102217,"['mp-1102217', 'mp-1103435', 'mp-1426082', 'mp-1695657', 'mp-1863361', 'mp-1601053']",5.85e-05,"{'Nd': 4.0, 'Ru': 8.0}",225.9695535436201,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.035537736524446e-06,5.85e-05,0,0.000234,MP,data/source/MP/cleaned/cifs/MP-mp-1102217.cif,False,,data/final/MP/graphs/Nd1Ru2-MP-mp-1102217.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Al0.14B2Mg0.86,3,0.0933333333333333,1.0,True,Al0.14B2Mg0.86,B2Mg1,35.1,Other,True,Al4.667B66.667Mg28.667,Al-B-Mg,3,Supercon,Mg0.86Al0.14B2,MP-mp-763,Mg1B2,B-Mg,B66.667Mg33.333,P 6/m m m,hexagonal,3.0736799979435254,3.07368003,3.53435,data/final/MP/cifs/Al0.14B2Mg0.86-MP-mp-763-synth_doped.cif,data/source/MP/raw/cifs/mp-763.cif,mp-763,0.0,,2011-05-12 17:25:30,2.637300884258781,,,{'GGA': {'task_id': 'mp-1671065'}},0.0,5.98552092,520.0,-15.35008288,-5.1166942933333335,"{'tags': ['Mgnesium boride (1/2)', 'Magnesium boride (1/2)', 'Magnesium boride (1/1)', 'High pressure experimental phase', 'Magensium diboride']}",-15.35008288,-5.1166942933333335,-0.1303397627777774,"['bandstructure', 'elasticity']",True,"[193379, 186389, 94257, 237010, 181869, 96704, 96705, 248441, 96906, 150598, 92831, 155349, 181870, 94256, 182537, 236951, 108064, 93925, 186763, 26675, 248442, 96703, 155347, 153657, 191393, 96706, 92832, 94255, 155348]",True,2021-05-12 10:56:29.056000,NM,3,39,mp-763,,MgB2,"{'functional': 'PBE', 'labels': ['Mg_pv', 'B'], 'pot_type': 'paw'}","{'Mg': 1.0, 'B': 2.0}",GGA,mp-763,"['mp-905361', 'mp-919554', 'mp-918565', 'mp-763', 'mp-1061708', 'mp-1061762', 'mp-1061948', 'mp-1061909', 'mp-1061934', 'mp-1062061', 'mp-1061740', 'mp-1062105', 'mp-1062081', 'mp-1062570', 'mp-1062589', 'mp-1062612', 'mp-1062861', 'mp-1062883', 'mp-1062892', 'mp-1062941', 'mp-1062925', 'mp-1062999', 'mp-1063048', 'mp-1063024', 'mp-1062914', 'mp-1063249', 'mp-1063291', 'mp-1063269', 'mp-1440873', 'mp-1671065', 'mp-1791068', 'mp-1062931', 'mp-1063035', 'mp-1061942', 'mp-1062096', 'mp-1062604', 'mp-1061753', 'mp-1062912', 'mp-1063282']",0.0002484,"{'Mg': 1.0, 'B': 2.0}",28.91728363909158,[],NM,False,191,0,"[0, 0, 0]",8.590018450564375e-06,0.0002484,0,0.0002484,MP,data/source/MP/cleaned/cifs/MP-mp-763.cif,True,,data/final/MP/graphs/Al0.14B2Mg0.86-MP-mp-763-synth_doped.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Co1La1O3,1,0.0,4.0,False,Co4La4O12,Co4La4O12,0.0,Oxide,True,Co20La20O60,Co-La-O,3,Supercon,La1Co1O3,MP-mp-1277476,La4Co4O12,Co-La-O,Co20La20O60,P -1,triclinic,5.49830883,5.590821090000001,7.79286777,data/final/MP/cifs/Co1La1O3-MP-mp-1277476.cif,data/source/MP/raw/cifs/mp-1277476.cif,mp-1277476,0.0,,2020-04-24 21:34:06.261000,6.819846823423928,,,,0.0348765289999999,6.92484768,520.0,-144.15821954,-7.207910977,"{'tags': ['Lanthanum cobaltate', 'Lanthanum cobaltate(III)']}",-144.15821954,-7.207910977,-2.570069394,[],False,"[99370, 247225]",True,2021-05-12 11:01:19.875000,FiM,20,3,mp-1277476,oxide,LaCoO3,"{'functional': 'PBE', 'labels': ['La', 'Co', 'O'], 'pot_type': 'paw'}","{'La': 1.0, 'Co': 1.0, 'O': 3.0}",GGA+U,mp-1277476,"['mp-1277476', 'mp-1289057', 'mp-1924383']",0.99443395,"{'La': 4.0, 'Co': 4.0, 'O': 12.0}",239.43160537909029,[],FiM,True,2,10,"[0.0, 0.0, 0.0, 0.0, -0.1, -2.9, 3.0, 3.1, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.2, 0.2, 0.0]",0.0166132444950284,0.99443395,6,3.9777358,MP,data/source/MP/cleaned/cifs/MP-mp-1277476.cif,False,,data/final/MP/graphs/Co1La1O3-MP-mp-1277476.json,0,True,-1,0,0,0,0,0,2,0,1,0,0,0,1.0,False
Er0.2Pd2Sn1Y0.8,3,0.0999999999999999,1.0,True,Er0.2Pd2Sn1Y0.8,Pd2Sn1Y1,4.055,Other,True,Er5Pd50Sn25Y20,Er-Pd-Sn-Y,4,Supercon,Pd2Y0.8Er0.2Sn1,MP-mp-5538,Y1Sn1Pd2,Pd-Sn-Y,Pd50Sn25Y25,F m -3 m,cubic,4.81595014,4.81595014,4.81595014,data/final/MP/cifs/Er0.2Pd2Sn1Y0.8-MP-mp-5538-synth_doped.cif,data/source/MP/raw/cifs/mp-5538.cif,mp-5538,0.0,,2011-05-13 01:04:13,8.839720826473608,10.17188/1267618,"@misc{osti_1267618,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YSnPd2 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1267618"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687523'}},0.0,6.33853657,520.0,-24.32859047,-6.0821476175,"{'tags': ['Palladium yttrium stannide (2/1/1)', 'Palladium tin yttrium (2/1/1)']}",-24.32859047,-6.0821476175,-0.873195970416667,"['xas', 'elasticity', 'bandstructure']",True,"[105699, 648949, 105700, 424011, 648950]",True,2021-05-12 10:56:22.739000,NM,4,12,mp-5538,,YSnPd2,"{'functional': 'PBE', 'labels': ['Y_sv', 'Sn_d', 'Pd'], 'pot_type': 'paw'}","{'Y': 1.0, 'Sn': 1.0, 'Pd': 2.0}",GGA,mp-5538,"['mp-1008093', 'mp-1001657', 'mp-5538', 'mp-1065654', 'mp-1065644', 'mp-1065683', 'mp-1439031', 'mp-1687523', 'mp-1801498', 'mp-1012418', 'mp-1593849', 'mp-1065696']",0.0001592,"{'Y': 1.0, 'Sn': 1.0, 'Pd': 2.0}",78.98251295612837,[],NM,False,225,0,"[0, 0, 0, 0]",2.015636044505563e-06,0.0001592,0,0.0001592,MP,data/source/MP/cleaned/cifs/MP-mp-5538.cif,True,,data/final/MP/graphs/Er0.2Pd2Sn1Y0.8-MP-mp-5538-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Re2U1,1,0.0,4.0,False,Re8U4,Re8U4,0.0,Heavy_fermion,True,Re66.667U33.333,Re-U,2,Supercon,Re2U1,MP-mp-569480,U4Re8,Re-U,Re66.667U33.333,C m c m,orthorhombic,5.37157667,5.37157667,8.296652,data/final/MP/cifs/Re2U1-MP-mp-569480.cif,data/source/MP/raw/cifs/mp-569480.cif,mp-569480,0.0,,2014-02-16 07:57:58,18.52902560239168,10.17188/1275117,"@misc{osti_1275117,
    author = ""Persson, Kristin"",
    title = ""Materials Data on URe2 (SG:63) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1275117"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1695401'}},0.0,9.53300115,520.0,-144.94940922,-12.079117435,"{'tags': ['Uranium rhenium (1/2)', 'Rhenium uranium (2/1)']}",-144.94940922,-12.079117435,-0.018962641666666,['bandstructure'],True,"[650183, 650184, 601402, 105898]",True,2021-05-12 10:58:51.532000,FM,12,10,mp-569480,,URe2,"{'functional': 'PBE', 'labels': ['U', 'Re_pv'], 'pot_type': 'paw'}","{'U': 1.0, 'Re': 2.0}",GGA,mp-569480,"['mp-912824', 'mp-569480', 'mp-929272', 'mp-930092', 'mp-1102588', 'mp-1103197', 'mp-1436580', 'mp-1695401', 'mp-1828186', 'mp-1602544']",0.18918465,"{'U': 4.0, 'Re': 8.0}",218.8273299926029,[],FM,True,63,1,"[0.2, 0.2, 0.2, 0.2, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.00345815397019,0.18918465,4,0.7567386,MP,data/source/MP/cleaned/cifs/MP-mp-569480.cif,False,,data/final/MP/graphs/Re2U1-MP-mp-569480.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
C0.985Hf1,2,0.0075566750629723,1.0,True,C0.985Hf1,C1Hf1,0.0,Other,True,C49.622Hf50.378,C-Hf,2,Supercon,C0.985Hf1,MP-mp-21075,Hf1C1,C-Hf,C50Hf50,F m -3 m,cubic,3.28897426,3.28897426,3.28897426,data/final/MP/cifs/C0.985Hf1-MP-mp-21075-synth_doped.cif,data/source/MP/raw/cifs/mp-21075.cif,mp-21075,0.0,,2014-02-15 06:54:13,12.57416771071356,10.17188/1196352,"@misc{osti_1196352,
    author = ""Persson, Kristin"",
    title = ""Materials Data on HfC (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1196352"",
    place = ""United States"",
    year = ""2015"",
    month = ""1"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686608'}},0.0,5.97796141,520.0,-21.06360483,-10.531802415,"{'tags': ['Hafnium carbide (1/1)', 'Hafnium carbide']}",-21.06360483,-10.531802415,-0.9398176399999992,"['xas', 'elasticity', 'bandstructure']",True,"[618012, 618010, 618002, 658336, 618020, 618017, 180600, 618008, 185978, 618018, 181793, 618016, 108134, 618005, 22262, 618000, 618013, 617997, 618011, 658398, 618001, 617998, 618015, 618004, 159873, 192046, 618009, 618003]",True,2021-05-12 10:56:16.728000,NM,2,17,mp-21075,,HfC,"{'functional': 'PBE', 'labels': ['Hf_pv', 'C'], 'pot_type': 'paw'}","{'Hf': 1.0, 'C': 1.0}",GGA,mp-21075,"['mp-919916', 'mp-906043', 'mp-918940', 'mp-21075', 'mp-1058491', 'mp-1058503', 'mp-1058524', 'mp-1061352', 'mp-1061374', 'mp-1061411', 'mp-1440553', 'mp-1686608', 'mp-1791532', 'mp-1590031', 'mp-1595311', 'mp-1058520', 'mp-1061403']",5.9e-05,"{'Hf': 1.0, 'C': 1.0}",25.1574387937518,[],NM,False,225,0,"[0, 0]",2.345230787748293e-06,5.9e-05,0,5.9e-05,MP,data/source/MP/cleaned/cifs/MP-mp-21075.cif,True,,data/final/MP/graphs/C0.985Hf1-MP-mp-21075-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ce0.9Cu2Eu1.1Ru1Sr2O10,2,0.0117647058823529,1.0,True,Ce0.9Cu2Eu1.1Ru1Sr2O10,Ce1Cu2Eu1Ru1Sr2O10,0.0,Cuprate,True,Ce5.294Cu11.765Eu6.471Ru5.882Sr11.765O58.82352941176471,Ce-Cu-Eu-Ru-Sr-O,6,Supercon,Eu1.1Ce0.9Sr2Ru1Cu2O10,MP-mp-1218883,Sr2Ce1Eu1Cu2Ru1O10,Ce-Cu-Eu-Ru-Sr-O,Ce5.882Cu11.765Eu5.882Ru5.882Sr11.765O58.82352941176471,C 1 m 1,monoclinic,3.89765054,3.89765054,14.72856415,data/final/MP/cifs/Ce0.9Cu2Eu1.1Ru1Sr2O10-MP-mp-1218883-synth_doped.cif,data/source/MP/raw/cifs/mp-1218883.cif,mp-1218883,0.0,,2019-01-12 19:58:44.354000,6.461952007932866,,,,0.0307225061764704,4.2426979,520.0,-121.19651369,-7.129206687647059,{'tags': []},-121.19651369,-7.129206687647059,-2.441763594607844,[],False,[],True,2021-05-12 11:00:42.526000,FiM,17,2,mp-1218883,oxide,Sr2CeEuCu2RuO10,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Ce', 'Eu', 'Cu_pv', 'Ru_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Ce': 1.0, 'Eu': 1.0, 'Cu': 2.0, 'Ru': 1.0, 'O': 10.0}",GGA,mp-1218883,"['mp-1218883', 'mp-1331028']",3.9050614,"{'Sr': 2.0, 'Ce': 1.0, 'Eu': 1.0, 'Cu': 2.0, 'Ru': 1.0, 'O': 10.0}",219.83315827706463,[],FiM,True,8,5,"[-0.0, -0.0, 0.1, 6.3, -0.1, -0.1, -1.2, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0177637506125363,3.9050614,5,3.9050614,MP,data/source/MP/cleaned/cifs/MP-mp-1218883.cif,True,,data/final/MP/graphs/Ce0.9Cu2Eu1.1Ru1Sr2O10-MP-mp-1218883-synth_doped.json,0,True,m,0,0,5,0,0,0,0,0,1,0,0,1.0,False
Gd0.05La0.95Ru2,2,0.0333333333333333,2.0,False,Gd0.1La1.9Ru4,La2Ru4,1.61,Other,True,Gd1.667La31.667Ru66.667,Gd-La-Ru,3,Supercon,La0.95Gd0.05Ru2,MP-mp-2019,La2Ru4,La-Ru,La33.333Ru66.667,F d -3 m,cubic,5.46409128,5.464091279999999,5.464091279999999,data/final/MP/cifs/Gd0.05La0.95Ru2-MP-mp-2019-synth_doped.cif,data/source/MP/raw/cifs/mp-2019.cif,mp-2019,0.0,,2011-05-13 21:42:56,9.818667150990734,10.17188/1195329,"@misc{osti_1195329,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaRu2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195329"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686817'}},0.0017745359523804,8.6251779,520.0,-47.76122776,-7.960204626666666,"{'tags': ['Lanthanum ruthenium hydride (1/2/4)', 'Lanthanum ruthenium (1/2)']}",-47.76122776,-7.960204626666666,-0.1319424883333321,"['xas', 'elasticity', 'bandstructure']",True,"[104712, 641760, 641778, 638256, 641771, 641766, 641774, 638255, 641762, 104713, 641761, 641775, 641777]",True,2021-05-12 10:56:14.760000,NM,6,14,mp-2019,,LaRu2,"{'functional': 'PBE', 'labels': ['La', 'Ru_pv'], 'pot_type': 'paw'}","{'La': 1.0, 'Ru': 2.0}",GGA,mp-2019,"['mp-935098', 'mp-941760', 'mp-941909', 'mp-2019', 'mp-1072861', 'mp-1072969', 'mp-1072939', 'mp-1077306', 'mp-1442150', 'mp-1686817', 'mp-1803378', 'mp-1590466', 'mp-1596026', 'mp-1072974']",0.000191,"{'La': 2.0, 'Ru': 4.0}",115.35564200581236,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",3.311498192526659e-06,0.000191,0,0.000382,MP,data/source/MP/cleaned/cifs/MP-mp-2019.cif,True,,data/final/MP/graphs/Gd0.05La0.95Ru2-MP-mp-2019-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Ni0.3Th0.7,2,1.6653345369377348e-16,20.0,False,Ni6Th14,Ni6Th14,1.9775,Other,True,Ni30Th70,Ni-Th,2,Supercon,Ni0.3Th0.7,MP-mp-30809,Th14Ni6,Ni-Th,Ni30Th70,P 63 m c,hexagonal,6.214559,9.826367997383215,9.82636859,data/final/MP/cifs/Ni0.3Th0.7-MP-mp-30809.cif,data/source/MP/raw/cifs/mp-30809.cif,mp-30809,0.0,,2014-02-20 07:42:51,11.50557133965162,10.17188/1205171,"@misc{osti_1205171,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Th7Ni3 (SG:186) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1205171"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1711551'}},0.0,7.74894139,520.0,-144.03656432,-7.201828216,"{'tags': ['Nickel thorium (3/7)', 'Thorium nickel (7/3)']}",-144.03656432,-7.201828216,-0.2780864370000003,"['xas', 'bandstructure']",True,"[646939, 646929, 105406]",True,2021-05-12 10:57:04.957000,NM,20,10,mp-30809,,Th7Ni3,"{'functional': 'PBE', 'labels': ['Th', 'Ni_pv'], 'pot_type': 'paw'}","{'Th': 7.0, 'Ni': 3.0}",GGA,mp-30809,"['mp-912715', 'mp-929098', 'mp-929549', 'mp-30809', 'mp-1189629', 'mp-1190345', 'mp-1475800', 'mp-1711551', 'mp-1928461', 'mp-1584243']",0.00847395,"{'Th': 14.0, 'Ni': 6.0}",519.6692641639447,[],NM,False,156,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, 0.0, 0.0, -0.0, -0.0, 0.0]",3.261285815559277e-05,0.00847395,0,0.0169479,MP,data/source/MP/cleaned/cifs/MP-mp-30809.cif,False,,data/final/MP/graphs/Ni0.3Th0.7-MP-mp-30809.json,0,True,6mm,0,5,0,0,0,0,0,1,0,0,0,1.0,False
Cu2Gd1Rh0.2Ru0.8Sr2O8,3,0.0285714285714285,2.0,False,Cu4Gd2Rh0.4Ru1.6Sr4O16,Cu4Gd2Ru2Sr4O16,12.9,Cuprate,True,Cu14.286Gd7.143Rh1.429Ru5.714Sr14.286O57.142857142857146,Cu-Gd-Rh-Ru-Sr-O,6,Supercon,Ru0.8Rh0.2Sr2Gd1Cu2O8,MP-mp-1194240,Sr4Gd2Cu4Ru2O16,Cu-Gd-Ru-Sr-O,Cu14.286Gd7.143Ru7.143Sr14.286O57.142857142857146,P 4/m b m,tetragonal,5.472451,5.472451,11.740702,data/final/MP/cifs/Cu2Gd1Rh0.2Ru0.8Sr2O8-MP-mp-1194240-synth_doped.cif,data/source/MP/raw/cifs/mp-1194240.cif,mp-1194240,0.0,,2019-01-11 23:51:58.932000,6.504561898971391,,,{'GGA': {'task_id': 'mp-1765260'}},0.0213449239285443,3.93502801,520.0,-201.55352223,-7.198340079642857,"{'tags': ['Sr2Cu2GdRuO8 orth', 'Sr2Cu2GdRuO8', 'Ruthenium distrontium gadolinium dicopper octaoxide']}",-201.55352223,-7.198340079642857,-2.268654352380952,['bandstructure'],True,[245741],True,2021-05-12 10:58:35.561000,FiM,28,6,mp-1194240,oxide,Sr2GdCu2RuO8,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Gd', 'Cu_pv', 'Ru_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Gd': 1.0, 'Cu': 2.0, 'Ru': 1.0, 'O': 8.0}",GGA,mp-1194240,"['mp-1194240', 'mp-1396976', 'mp-1659973', 'mp-1765260', 'mp-1841948', 'mp-1638264']",4.23696715,"{'Sr': 4.0, 'Gd': 2.0, 'Cu': 4.0, 'Ru': 2.0, 'O': 16.0}",351.6072554818909,[],FiM,True,127,2,"[-0.0, -0.0, -0.0, -0.0, 6.9, 6.9, 0.0, 0.0, 0.0, 0.0, -1.8, -1.8, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0241005672319991,4.23696715,4,8.4739343,MP,data/source/MP/cleaned/cifs/MP-mp-1194240.cif,True,,data/final/MP/graphs/Cu2Gd1Rh0.2Ru0.8Sr2O8-MP-mp-1194240-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Gd0.08La0.92Sn3,2,0.0399999999999999,1.0,True,Gd0.08La0.92Sn3,La1Sn3,4.28,Other,True,Gd2La23Sn75,Gd-La-Sn,3,Supercon,La0.92Gd0.08Sn3,MP-mp-633,La1Sn3,La-Sn,La25Sn75,P m -3 m,cubic,4.820061,4.820061,4.820061,data/final/MP/cifs/Gd0.08La0.92Sn3-MP-mp-633-synth_doped.cif,data/source/MP/raw/cifs/mp-633.cif,mp-633,0.0,,2011-05-13 04:30:54,7.340536659909055,10.17188/1279358,"@misc{osti_1279358,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaSn3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1279358"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688008'}},0.0,8.68748013,520.0,-19.26482408,-4.81620602,"{'tags': ['Lanthanum stannide (1/3)', 'Lanthanum tin (1/3)']}",-19.26482408,-4.81620602,-0.5750253525,"['xas', 'bandstructure']",True,"[641991, 104721, 641986, 261870, 104720, 151359, 642000, 641998, 191074]",True,2021-05-12 10:57:30.779000,NM,4,12,mp-633,,LaSn3,"{'functional': 'PBE', 'labels': ['La', 'Sn_d'], 'pot_type': 'paw'}","{'La': 1.0, 'Sn': 3.0}",GGA,mp-633,"['mp-991111', 'mp-993073', 'mp-633', 'mp-1066557', 'mp-1066573', 'mp-1066594', 'mp-1442023', 'mp-1688008', 'mp-1787436', 'mp-994393', 'mp-1590336', 'mp-1066601']",0.0055557,"{'La': 1.0, 'Sn': 3.0}",111.98441958300587,[],NM,False,221,0,"[0, 0, 0, 0]",4.961136576577034e-05,0.0055557,0,0.0055557,MP,data/source/MP/cleaned/cifs/MP-mp-633.cif,True,,data/final/MP/graphs/Gd0.08La0.92Sn3-MP-mp-633-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Mo6S8Sn1,1,0.0,1.0,True,Mo6S8Sn1,Mo6S8Sn1,12.6,Chevrel,True,Mo40S53.333Sn6.667,Mo-S-Sn,3,Supercon,Sn1Mo6S8,MP-mp-5336,Sn1Mo6S8,Mo-S-Sn,Mo40S53.333Sn6.667,R -3,trigonal,6.58066409,6.58066409,6.58066353,data/final/MP/cifs/Mo6S8Sn1-MP-mp-5336.cif,data/source/MP/raw/cifs/mp-5336.cif,mp-5336,0.0,,2011-05-15 17:45:00,5.541219299874331,10.17188/1263487,"@misc{osti_1263487,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Sn(Mo3S4)2 (SG:148) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1263487"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700085'}},0.0527309536666669,6.12708465,520.0,-111.77875897,-7.451917264666666,"{'tags': ['Tin(IV) octathiomolybdate(II)', 'Molybdenum tin sulfide (6/1/8)', 'Tin molybdenum sulfide (1/6/8)', 'Tin(IV) molybdenum(II) sulfide  (1/6/8)']}",-111.77875897,-7.451917264666666,-0.9085153333333332,"['xas', 'bandstructure']",True,"[644277, 644289, 200814, 644281, 200672, 600722, 644284]",True,2021-05-12 10:57:10.838000,NM,15,13,mp-5336,,Sn(Mo3S4)2,"{'functional': 'PBE', 'labels': ['Sn_d', 'Mo_pv', 'S'], 'pot_type': 'paw'}","{'Sn': 1.0, 'Mo': 6.0, 'S': 8.0}",GGA,mp-5336,"['mp-909482', 'mp-925170', 'mp-924598', 'mp-5336', 'mp-1103971', 'mp-1104002', 'mp-1104482', 'mp-1104917', 'mp-1237423', 'mp-1504237', 'mp-1700085', 'mp-1874112', 'mp-1598244']",0.0018094,"{'Sn': 1.0, 'Mo': 6.0, 'S': 8.0}",284.9475353364468,[],NM,False,148,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.349940868460514e-06,0.0018094,0,0.0018094,MP,data/source/MP/cleaned/cifs/MP-mp-5336.cif,False,,data/final/MP/graphs/Mo6S8Sn1-MP-mp-5336.json,0,True,-3,0,0,0,0,0,0,2,1,0,0,0,1.0,False
C1Ti1,1,0.0,1.0,True,C1Ti1,C1Ti1,0.0,Other,True,C50Ti50,C-Ti,2,Supercon,C1Ti1,MP-mp-631,Ti1C1,C-Ti,C50Ti50,F m -3 m,cubic,3.06576752,3.06576752,3.06576752,data/final/MP/cifs/C1Ti1-MP-mp-631.cif,data/source/MP/raw/cifs/mp-631.cif,mp-631,0.0,,2011-05-12 17:27:06,4.879907058924726,10.17188/1279030,"@misc{osti_1279030,
    author = ""Persson, Kristin"",
    title = ""Materials Data on TiC (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1279030"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672261'}},0.0,7.31044973,520.0,-18.74228076,-9.37114038,"{'tags': ['Titanium carbide (1/1)', 'Khamrabaevite', 'Titanium carbide']}",-18.74228076,-9.37114038,-0.810004021666666,"['xas', 'elasticity', 'bandstructure']",True,"[159871, 618935, 618942, 93504, 618941, 618925, 618940, 618932, 618948, 618950, 618926, 26952, 180598, 618944, 151365, 618928, 618934, 618946, 618927, 618945, 618936, 618929, 618951, 181681, 658392, 618931, 618930, 424343, 658339, 181783, 618947, 618933, 192036, 184912, 1546, 618922, 44494]",True,2021-05-12 10:56:27.046000,NM,2,25,mp-631,,TiC,"{'functional': 'PBE', 'labels': ['Ti_pv', 'C'], 'pot_type': 'paw'}","{'Ti': 1.0, 'C': 1.0}",GGA,mp-631,"['mp-919615', 'mp-918624', 'mp-905509', 'mp-631', 'mp-1057920', 'mp-1057881', 'mp-1057898', 'mp-1060446', 'mp-1060380', 'mp-1060866', 'mp-1060882', 'mp-1060888', 'mp-1060404', 'mp-1060916', 'mp-1060937', 'mp-1060964', 'mp-1440902', 'mp-1672261', 'mp-1795312', 'mp-1593670', 'mp-1592621', 'mp-1057913', 'mp-1060945', 'mp-1060434', 'mp-1060923']",4.44e-05,"{'Ti': 1.0, 'C': 1.0}",20.375236427159287,[],NM,False,225,0,"[0, 0]",2.179115818298764e-06,4.44e-05,0,4.44e-05,MP,data/source/MP/cleaned/cifs/MP-mp-631.cif,False,,data/final/MP/graphs/C1Ti1-MP-mp-631.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
C1Cd1Ni3,1,0.0,1.0,True,C1Cd1Ni3,C1Cd1Ni3,3.133333333,Other,True,C20Cd20Ni60,C-Cd-Ni,3,Supercon,Cd1C1Ni3,MP-mp-1206343,Cd1Ni3C1,C-Cd-Ni,C20Cd20Ni60,P m -3 m,cubic,3.866162,3.866162,3.866162,data/final/MP/cifs/C1Cd1Ni3-MP-mp-1206343.cif,data/source/MP/raw/cifs/mp-1206343.cif,mp-1206343,0.0,,2019-01-12 09:40:25.197000,8.634877406888368,,,{'GGA': {'task_id': 'mp-1766356'}},0.0246627226666662,6.39735859,520.0,-27.39174468,-5.478348936,"{'tags': ['perovskite', 'CdNi3C', 'CaTiO3']}",-27.39174468,-5.478348936,0.0196671640000012,['bandstructure'],True,[],True,2021-05-12 10:58:37.524000,NM,5,5,mp-1206343,,CdNi3C,"{'functional': 'PBE', 'labels': ['Cd', 'Ni_pv', 'C'], 'pot_type': 'paw'}","{'Cd': 1.0, 'Ni': 3.0, 'C': 1.0}",GGA,mp-1206343,"['mp-1206343', 'mp-1414415', 'mp-1766356', 'mp-1784541', 'mp-1613589']",0.0009654,"{'Cd': 1.0, 'Ni': 3.0, 'C': 1.0}",57.78832993499817,[],NM,False,221,0,"[0, 0, 0, 0, 0]",1.6705795116174968e-05,0.0009654,0,0.0009654,MP,data/source/MP/cleaned/cifs/MP-mp-1206343.cif,False,,data/final/MP/graphs/C1Cd1Ni3-MP-mp-1206343.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
B4Er0.88Rh4Y0.12,2,0.0266666666666668,2.0,False,B8Er1.76Rh8Y0.24,B8Er2Rh8,8.74,Other,True,B44.444Er9.778Rh44.444Y1.333,B-Er-Rh-Y,4,Supercon,Y0.12Er0.88Rh4B4,MP-mp-8408,Er2B8Rh8,B-Er-Rh,B44.444Er11.111Rh44.444,P 42/n m c,tetragonal,5.336304,5.336304,7.44528,data/final/MP/cifs/B4Er0.88Rh4Y0.12-MP-mp-8408-synth_doped.cif,data/source/MP/raw/cifs/mp-8408.cif,mp-8408,0.0,,2011-06-07 02:27:50,9.745285939793032,10.17188/1308086,"@misc{osti_1308086,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Er(BRh)4 (SG:137) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1308086"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1673724'}},0.0133402750000009,6.84272912,520.0,-131.92031901,-7.328906611666666,{'tags': ['Erbium rhodium boride (1/4/4)']},-131.92031901,-7.328906611666666,-0.5797380146296286,"['xas', 'bandstructure']",True,"[613809, 601530, 49631]",True,2021-05-12 10:57:51.871000,NM,18,8,mp-8408,,Er(BRh)4,"{'functional': 'PBE', 'labels': ['Er_3', 'B', 'Rh_pv'], 'pot_type': 'paw'}","{'Er': 1.0, 'B': 4.0, 'Rh': 4.0}",GGA,mp-8408,"['mp-932384', 'mp-931412', 'mp-8408', 'mp-915879', 'mp-1434188', 'mp-1673724', 'mp-1785064', 'mp-1597242']",7.985e-05,"{'Er': 2.0, 'B': 8.0, 'Rh': 8.0}",212.01283845150363,[],NM,False,137,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",7.532562705467018e-07,7.985e-05,0,0.0001597,MP,data/source/MP/cleaned/cifs/MP-mp-8408.cif,True,,data/final/MP/graphs/B4Er0.88Rh4Y0.12-MP-mp-8408-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Cu1La2O4.12,2,0.014446227929374,0.9709579288025888,True,Cu0.971La1.942O4,Cu1La2O4,43.0,Cuprate,True,Cu14.045La28.09O57.86516853932584,Cu-La-O,3,Supercon,La2Cu1O4.12,MP-mp-1077929,La2Cu1O4,Cu-La-O,Cu14.286La28.571O57.142857142857146,I 4/m m m,tetragonal,4.008631997283413,4.0086319972834135,6.92423226,data/final/MP/cifs/Cu1La2O4.12-MP-mp-1077929-synth_doped.cif,data/source/MP/raw/cifs/mp-1077929.cif,mp-1077929,0.0,,2018-04-10 02:46:14,6.630535012320788,,,{'GGA': {'task_id': 'mp-1699222'}},0.0,6.19298461,520.0,-52.30921997,-7.47274571,"{'tags': ['Dilanthanum tetraoxocuprate(II) - T', ""Dilanthanum copper tetraoxide - T'"", 'Dilanthanum tetraoxocuprate(II) - T phase, HT']}",-52.30921997,-7.47274571,-3.0420221528571423,['bandstructure'],True,"[180586, 261659, 261660, 421550]",True,2021-05-12 10:58:14.654000,NM,7,8,mp-1077929,oxide,La2CuO4,"{'functional': 'PBE', 'labels': ['La', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",GGA,mp-1077929,"['mp-1077929', 'mp-1078177', 'mp-1078187', 'mp-1078189', 'mp-1442004', 'mp-1699222', 'mp-1924066', 'mp-1589927']",0.0003131,"{'La': 2.0, 'Cu': 1.0, 'O': 4.0}",101.5162499320058,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0, 0]",3.084235284594438e-06,0.0003131,0,0.0003131,MP,data/source/MP/cleaned/cifs/MP-mp-1077929.cif,True,,data/final/MP/graphs/Cu1La2O4.12-MP-mp-1077929-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ba0.575Bi1K0.425O3,2,0.0366666666666666,3.0,False,Ba1.725Bi3K1.275O9,Ba2Bi3K1O9,27.3,Oxide,True,Ba11.5Bi20K8.5O60,Ba-Bi-K-O,4,Supercon,Ba0.575K0.425Bi1O3,MP-mp-1223518,K1Ba2Bi3O9,Ba-Bi-K-O,Ba13.333Bi20K6.667O60,P -3 m 1,trigonal,6.18756400330999,6.187564340000001,7.581401,data/final/MP/cifs/Ba0.575Bi1K0.425O3-MP-mp-1223518-synth_doped.cif,data/source/MP/raw/cifs/mp-1223518.cif,mp-1223518,0.0,,2019-01-12 23:54:06.965000,7.16530091201999,,,{'GGA': {'task_id': 'mp-1729135'}},0.001551682833333,3.46143017,520.0,-85.22271396,-5.681514264,{'tags': []},-85.22271396,-5.681514264,-2.0170414252000004,[],False,[],True,2021-05-12 11:00:52.054000,NM,15,4,mp-1223518,oxide,KBa2(BiO3)3,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Bi', 'O'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 2.0, 'Bi': 3.0, 'O': 9.0}",GGA,mp-1223518,"['mp-1223518', 'mp-1391182', 'mp-1729135', 'mp-1775199']",4.99e-05,"{'K': 1.0, 'Ba': 2.0, 'Bi': 3.0, 'O': 9.0}",251.37352739849624,[],NM,False,164,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.9850936777799505e-07,4.99e-05,0,4.99e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1223518.cif,True,,data/final/MP/graphs/Ba0.575Bi1K0.425O3-MP-mp-1223518-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Si1Zr2,1,0.0,2.0,False,Si2Zr4,Si2Zr4,0.0,Other,True,Si33.333Zr66.667,Si-Zr,2,Supercon,Si1Zr2,MP-mp-1278,Zr4Si2,Si-Zr,Si33.333Zr66.667,I 4/m c m,tetragonal,5.331424001414847,5.39128342054249,5.39128342,data/final/MP/cifs/Si1Zr2-MP-mp-1278.cif,data/source/MP/raw/cifs/mp-1278.cif,mp-1278,0.0,,2011-05-13 06:34:55,5.972090741082197,10.17188/1189187,"@misc{osti_1189187,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Zr2Si (SG:140) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189187"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700568'}},0.0,5.44747811,520.0,-49.70100783,-8.283501305,{'tags': ['Zirconium silicide (2/1)']},-49.70100783,-8.283501305,-0.7529295450000006,"['xas', 'elasticity', 'bandstructure']",True,"[652615, 652618, 24717, 42522]",True,2021-05-12 10:56:12.755000,NM,6,11,mp-1278,,Zr2Si,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Si'], 'pot_type': 'paw'}","{'Zr': 2.0, 'Si': 1.0}",GGA,mp-1278,"['mp-924871', 'mp-909848', 'mp-925446', 'mp-1278', 'mp-1077237', 'mp-1138639', 'mp-1146294', 'mp-1438369', 'mp-1700568', 'mp-1803238', 'mp-1590560']",0.0012039,"{'Zr': 4.0, 'Si': 2.0}",117.07762548654128,[],NM,False,140,0,"[0, 0, 0, 0, 0, 0]",2.0565842448494056e-05,0.0012039,0,0.0024078,MP,data/source/MP/cleaned/cifs/MP-mp-1278.cif,False,,data/final/MP/graphs/Si1Zr2-MP-mp-1278.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ga0.45V0.55,3,0.1,2.0,False,Ga0.9V1.1,Ga1V1,0.0,Other,True,Ga45V55,Ga-V,2,Supercon,Ga0.45V0.55,MP-mp-1216325,V1Ga1,Ga-V,Ga50V50,P -6 m 2,hexagonal,2.7763720047105647,2.77637228,4.354836,data/final/MP/cifs/Ga0.45V0.55-MP-mp-1216325-synth_doped.cif,data/source/MP/raw/cifs/mp-1216325.cif,mp-1216325,0.0,,2019-01-12 17:51:14.917000,6.892405334732054,,,{'GGA': {'task_id': 'mp-1674487'}},0.090812388125002,5.19604973,520.0,-12.3629232,-6.1814616,{'tags': []},-12.3629232,-6.1814616,-0.1254605537499999,['bandstructure'],True,[],True,2021-05-12 10:58:39.488000,NM,2,5,mp-1216325,,VGa,"{'functional': 'PBE', 'labels': ['V_pv', 'Ga_d'], 'pot_type': 'paw'}","{'V': 1.0, 'Ga': 1.0}",GGA,mp-1216325,"['mp-1216325', 'mp-1428232', 'mp-1674487', 'mp-1863376', 'mp-1611175']",0.0001645,"{'V': 1.0, 'Ga': 1.0}",29.070855016617376,[],NM,False,187,0,"[0, 0]",5.658588297659945e-06,0.0001645,0,0.0001645,MP,data/source/MP/cleaned/cifs/MP-mp-1216325.cif,True,,data/final/MP/graphs/Ga0.45V0.55-MP-mp-1216325-synth_doped.json,0,True,-62m,0,6,0,0,0,0,0,1,0,0,0,1.0,False
As1Pt1Sr1,1,0.0,2.0,False,As2Pt2Sr2,As2Pt2Sr2,2.425,Other,True,As33.333Pt33.333Sr33.333,As-Pt-Sr,3,Supercon,Sr1Pt1As1,MP-mp-8456,Sr2As2Pt2,As-Pt-Sr,As33.333Pt33.333Sr33.333,P 63/m m c,hexagonal,4.301650004096013,4.30164985,9.099085,data/final/MP/cifs/As1Pt1Sr1-MP-mp-8456.cif,data/source/MP/raw/cifs/mp-8456.cif,mp-8456,0.0,,2011-05-28 04:12:29,8.145339988869129,10.17188/1308114,"@misc{osti_1308114,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SrAsPt (SG:194) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1308114"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1702434'}},0.0,4.02083374,520.0,-30.90670828,-5.151118046666666,{'tags': ['Strontium platinum arsenide (1/1/1)']},-30.90670828,-5.151118046666666,-1.0112781905555557,"['bandstructure', 'elasticity']",True,[59187],True,2021-05-12 10:56:31.128000,NM,6,8,mp-8456,,SrAsPt,"{'functional': 'PBE', 'labels': ['Sr_sv', 'As', 'Pt'], 'pot_type': 'paw'}","{'Sr': 1.0, 'As': 1.0, 'Pt': 1.0}",GGA,mp-8456,"['mp-922235', 'mp-921981', 'mp-907622', 'mp-8456', 'mp-1414319', 'mp-1702434', 'mp-1922198', 'mp-1594821']",0.00183945,"{'Sr': 2.0, 'As': 2.0, 'Pt': 2.0}",145.81374892337996,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0]",2.523013108958013e-05,0.00183945,0,0.0036789,MP,data/source/MP/cleaned/cifs/MP-mp-8456.cif,False,,data/final/MP/graphs/As1Pt1Sr1-MP-mp-8456.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Ba2Cu4Eu0.8Pr0.2O8,3,0.0266666666666666,1.0,True,Ba2Cu4Eu0.8Pr0.2O8,Ba2Cu4Eu1O8,63.5,Cuprate,True,Ba13.333Cu26.667Eu5.333Pr1.333O53.333333333333336,Ba-Cu-Eu-Pr-O,5,Supercon,Eu0.8Pr0.2Ba2Cu4O8,MP-mp-1214709,Ba2Eu1Cu4O8,Ba-Cu-Eu-O,Ba13.333Cu26.667Eu6.667O53.333333333333336,C m m m,orthorhombic,3.881293999182026,3.913904,13.99946854,data/final/MP/cifs/Ba2Cu4Eu0.8Pr0.2O8-MP-mp-1214709-synth_doped.cif,data/source/MP/raw/cifs/mp-1214709.cif,mp-1214709,0.0,,2019-01-12 16:30:25.075000,6.376815622180337,,,{'GGA': {'task_id': 'mp-1738155'}},0.0,3.04640135,520.0,-93.66742595,-6.244495063333333,"{'tags': ['Ba2Cu4YO8', 'Ba2Cu4EuO8', 'high-Tc cuprate family']}",-93.66742595,-6.244495063333333,-1.9368617396666656,[],False,[],True,2021-05-12 11:00:37.845000,FM,15,4,mp-1214709,oxide,Ba2Eu(CuO2)4,"{'functional': 'PBE', 'labels': ['Ba_sv', 'Eu', 'Cu_pv', 'O'], 'pot_type': 'paw'}","{'Ba': 2.0, 'Eu': 1.0, 'Cu': 4.0, 'O': 8.0}",GGA,mp-1214709,"['mp-1214709', 'mp-1443436', 'mp-1738155', 'mp-1830136']",6.2348337,"{'Ba': 2.0, 'Eu': 1.0, 'Cu': 4.0, 'O': 8.0}",210.6128555583808,[],FM,True,65,1,"[0.0, 0.0, 6.3, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",0.0296032912305855,6.2348337,1,6.2348337,MP,data/source/MP/cleaned/cifs/MP-mp-1214709.cif,True,,data/final/MP/graphs/Ba2Cu4Eu0.8Pr0.2O8-MP-mp-1214709-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
La0.908Sn3Tm0.092,2,0.0459999999999999,1.0,True,La0.908Sn3Tm0.092,La1Sn3,4.18,Other,True,La22.7Sn75Tm2.3,La-Sn-Tm,3,Supercon,La0.908Tm0.092Sn3,MP-mp-633,La1Sn3,La-Sn,La25Sn75,P m -3 m,cubic,4.820061,4.820061,4.820061,data/final/MP/cifs/La0.908Sn3Tm0.092-MP-mp-633-synth_doped.cif,data/source/MP/raw/cifs/mp-633.cif,mp-633,0.0,,2011-05-13 04:30:54,7.340536659909055,10.17188/1279358,"@misc{osti_1279358,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LaSn3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1279358"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688008'}},0.0,8.68748013,520.0,-19.26482408,-4.81620602,"{'tags': ['Lanthanum stannide (1/3)', 'Lanthanum tin (1/3)']}",-19.26482408,-4.81620602,-0.5750253525,"['xas', 'bandstructure']",True,"[641991, 104721, 641986, 261870, 104720, 151359, 642000, 641998, 191074]",True,2021-05-12 10:57:30.779000,NM,4,12,mp-633,,LaSn3,"{'functional': 'PBE', 'labels': ['La', 'Sn_d'], 'pot_type': 'paw'}","{'La': 1.0, 'Sn': 3.0}",GGA,mp-633,"['mp-991111', 'mp-993073', 'mp-633', 'mp-1066557', 'mp-1066573', 'mp-1066594', 'mp-1442023', 'mp-1688008', 'mp-1787436', 'mp-994393', 'mp-1590336', 'mp-1066601']",0.0055557,"{'La': 1.0, 'Sn': 3.0}",111.98441958300587,[],NM,False,221,0,"[0, 0, 0, 0]",4.961136576577034e-05,0.0055557,0,0.0055557,MP,data/source/MP/cleaned/cifs/MP-mp-633.cif,True,,data/final/MP/graphs/La0.908Sn3Tm0.092-MP-mp-633-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
As2Ba0.5Cu0.2Fe1.8K0.5,3,0.0799999999999999,2.0,False,As4Ba1Cu0.4Fe3.6K1,As4Ba1Fe4K1,11.83,Ferrite,True,As40Ba10Cu4Fe36K10,As-Ba-Cu-Fe-K,5,Supercon,Ba0.5K0.5Fe1.8Cu0.2As2,MP-mp-1223517,K1Ba1Fe4As4,As-Ba-Fe-K,As40Ba10Fe40K10,C m m m,orthorhombic,5.479027,5.480024002658328,7.13170472,data/final/MP/cifs/As2Ba0.5Cu0.2Fe1.8K0.5-MP-mp-1223517-synth_doped.cif,data/source/MP/raw/cifs/mp-1223517.cif,mp-1223517,0.0,,2019-01-12 23:54:03.876000,5.87534599912672,,,{'GGA': {'task_id': 'mp-1743010'}},0.0132513644999994,4.21185628,520.0,-59.66633886,-5.966633886,{'tags': []},-59.66633886,-5.966633886,-0.4120461663000007,[],False,[],True,2021-05-12 11:00:52.054000,FM,10,4,mp-1223517,,KBa(FeAs)4,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Fe_pv', 'As'], 'pot_type': 'paw'}","{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",GGA,mp-1223517,"['mp-1223517', 'mp-1396881', 'mp-1743010', 'mp-1827585']",0.9947188,"{'K': 1.0, 'Ba': 1.0, 'Fe': 4.0, 'As': 4.0}",197.6961518155852,[],FM,True,65,1,"[0.0, 0.0, 0.3, 0.3, 0.3, 0.3, 0.0, 0.0, 0.0, 0.0]",0.0050315536790412,0.9947188,4,0.9947188,MP,data/source/MP/cleaned/cifs/MP-mp-1223517.cif,True,,data/final/MP/graphs/As2Ba0.5Cu0.2Fe1.8K0.5-MP-mp-1223517-synth_doped.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Pd17Se15,1,0.0,2.0,False,Pd34Se30,Pd34Se30,1.1,Other,True,Pd53.125Se46.875,Pd-Se,2,Supercon,Pd17Se15,MP-mp-21765,Pd34Se30,Pd-Se,Pd53.125Se46.875,P m -3 m,cubic,10.778299,10.778299,10.778299,data/final/MP/cifs/Pd17Se15-MP-mp-21765.cif,data/source/MP/raw/cifs/mp-21765.cif,mp-21765,0.0,,2014-02-18 06:27:45,7.939871563298293,10.17188/1197156,"@misc{osti_1197156,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Pd17Se15 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1197156"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1684561'}},0.0,4.30016596,520.0,-301.50847438,-4.7110699121875,"{'tags': ['Palladium selenide (17/15)', 'Palladseite']}",-301.50847438,-4.7110699121875,-0.541799195473633,"['xas', 'elasticity', 'bandstructure']",True,"[23907, 648825, 648834, 108785]",True,2021-05-12 10:56:16.728000,NM,64,8,mp-21765,,Pd17Se15,"{'functional': 'PBE', 'labels': ['Pd', 'Se'], 'pot_type': 'paw'}","{'Pd': 17.0, 'Se': 15.0}",GGA,mp-21765,"['mp-990601', 'mp-914339', 'mp-21765', 'mp-1198932', 'mp-1201796', 'mp-1348753', 'mp-1684561', 'mp-992729']",0.20433085,"{'Pd': 34.0, 'Se': 30.0}",1252.1336341024669,[],NM,False,221,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",0.0003263722727909,0.20433085,0,0.4086617,MP,data/source/MP/cleaned/cifs/MP-mp-21765.cif,False,,data/final/MP/graphs/Pd17Se15-MP-mp-21765.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
B2C1Er0.85Ni2Tb0.15,2,0.05,1.0,True,B2C1Er0.85Ni2Tb0.15,B2C1Er1Ni2,7.225,Other,True,B33.333C16.667Er14.167Ni33.333Tb2.5,B-C-Er-Ni-Tb,5,Supercon,Er0.85Tb0.15Ni2B2C1,MP-mp-6098,Er1Ni2B2C1,B-C-Er-Ni,B33.333C16.667Er16.667Ni33.333,I 4/m m m,tetragonal,3.5122880026935177,3.5122880026935173,5.77805085,data/final/MP/cifs/B2C1Er0.85Ni2Tb0.15-MP-mp-6098-synth_doped.cif,data/source/MP/raw/cifs/mp-6098.cif,mp-6098,0.0,,2011-05-13 04:24:02,8.212015229638553,10.17188/1277667,"@misc{osti_1277667,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ErNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277667"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700042'}},0.0,6.72687579,520.0,-41.84324782,-6.973874636666667,{'tags': []},-41.84324782,-6.973874636666667,-0.5216152347222227,"['xas', 'elasticity', 'bandstructure']",True,"[246431, 79576, 56651]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-6098,,ErNi2B2C,"{'functional': 'PBE', 'labels': ['Er_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Er': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6098,"['mp-1006980', 'mp-1000513', 'mp-6098', 'mp-1441533', 'mp-1700042', 'mp-1793903', 'mp-1011723', 'mp-1589040']",0.0020747,"{'Er': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",64.35860973581151,[],NM,False,139,0,"[0.0, -0.0, -0.0, 0.0, 0.0, 0.0]",3.2236557136900987e-05,0.0020747,0,0.0020747,MP,data/source/MP/cleaned/cifs/MP-mp-6098.cif,True,,data/final/MP/graphs/B2C1Er0.85Ni2Tb0.15-MP-mp-6098-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Pd2Sn1Y0.7Yb0.3,3,0.15,1.0,True,Pd2Sn1Y0.7Yb0.3,Pd2Sn1Y1,4.03,Other,True,Pd50Sn25Y17.5Yb7.5,Pd-Sn-Y-Yb,4,Supercon,Pd2Y0.7Yb0.3Sn1,MP-mp-5538,Y1Sn1Pd2,Pd-Sn-Y,Pd50Sn25Y25,F m -3 m,cubic,4.81595014,4.81595014,4.81595014,data/final/MP/cifs/Pd2Sn1Y0.7Yb0.3-MP-mp-5538-synth_doped.cif,data/source/MP/raw/cifs/mp-5538.cif,mp-5538,0.0,,2011-05-13 01:04:13,8.839720826473608,10.17188/1267618,"@misc{osti_1267618,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YSnPd2 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1267618"",
    place = ""United States"",
    year = ""2014"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687523'}},0.0,6.33853657,520.0,-24.32859047,-6.0821476175,"{'tags': ['Palladium yttrium stannide (2/1/1)', 'Palladium tin yttrium (2/1/1)']}",-24.32859047,-6.0821476175,-0.873195970416667,"['xas', 'elasticity', 'bandstructure']",True,"[105699, 648949, 105700, 424011, 648950]",True,2021-05-12 10:56:22.739000,NM,4,12,mp-5538,,YSnPd2,"{'functional': 'PBE', 'labels': ['Y_sv', 'Sn_d', 'Pd'], 'pot_type': 'paw'}","{'Y': 1.0, 'Sn': 1.0, 'Pd': 2.0}",GGA,mp-5538,"['mp-1008093', 'mp-1001657', 'mp-5538', 'mp-1065654', 'mp-1065644', 'mp-1065683', 'mp-1439031', 'mp-1687523', 'mp-1801498', 'mp-1012418', 'mp-1593849', 'mp-1065696']",0.0001592,"{'Y': 1.0, 'Sn': 1.0, 'Pd': 2.0}",78.98251295612837,[],NM,False,225,0,"[0, 0, 0, 0]",2.015636044505563e-06,0.0001592,0,0.0001592,MP,data/source/MP/cleaned/cifs/MP-mp-5538.cif,True,,data/final/MP/graphs/Pd2Sn1Y0.7Yb0.3-MP-mp-5538-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
H2Zr1,1,0.0,1.0,True,H2Zr1,H2Zr1,0.0,Other,True,H66.667Zr33.333,H-Zr,2,Supercon,H2Zr1,MP-mp-24286,Zr1H2,H-Zr,H66.667Zr33.333,I 4/m m m,tetragonal,3.350975170421079,3.35097517,3.35097517,data/final/MP/cifs/H2Zr1-MP-mp-24286.cif,data/source/MP/raw/cifs/mp-24286.cif,mp-24286,0.0,,2014-02-19 10:33:55,5.543621890878481,10.17188/1200012,"@misc{osti_1200012,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ZrH2 (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1200012"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1686765'}},0.0,4.56038872,520.0,-16.98438249,-5.66146083,"{'tags': ['Zirconium deuteride (1/2) - tetragonal', 'Zirconium deuteride (1/2)', 'Zirconium hydride (1/2)', 'Zirconium deuteride (1/2) - epsilon', 'Zirconium deuteride (2.1/3.9)']}",-16.98438249,-5.66146083,-0.6697432566666676,"['xas', 'elasticity', 'bandstructure']",True,"[24624, 638555, 604280, 659813, 108539, 90164, 181664, 169457, 638551, 181663, 656539, 56199, 181662, 638554]",True,2021-05-12 10:56:16.728000,NM,3,10,mp-24286,,ZrH2,"{'functional': 'PBE', 'labels': ['Zr_sv', 'H'], 'pot_type': 'paw'}","{'Zr': 1.0, 'H': 2.0}",GGA,mp-24286,"['mp-934543', 'mp-935746', 'mp-935831', 'mp-24286', 'mp-1440740', 'mp-1686765', 'mp-1795188', 'mp-1868818', 'mp-1592922', 'mp-1591328']",0.0002344,"{'Zr': 1.0, 'H': 2.0}",27.92911680355617,[],NM,False,139,0,"[0, 0, 0]",8.392674986777751e-06,0.0002344,0,0.0002344,MP,data/source/MP/cleaned/cifs/MP-mp-24286.cif,False,,data/final/MP/graphs/H2Zr1-MP-mp-24286.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Os1Si1Zr1,1,0.0,4.0,False,Os4Si4Zr4,Os4Si4Zr4,1.72,Other,True,Os33.333Si33.333Zr33.333,Os-Si-Zr,3,Supercon,Zr1Os1Si1,MP-mp-1103293,Zr4Si4Os4,Os-Si-Zr,Os33.333Si33.333Zr33.333,P n m a,orthorhombic,4.080406,6.439958,7.507221,data/final/MP/cifs/Os1Si1Zr1-MP-mp-1103293.cif,data/source/MP/raw/cifs/mp-1103293.cif,mp-1103293,0.0,,2018-07-18 17:58:03,10.422203579199651,,,{'GGA': {'task_id': 'mp-1704430'}},0.0,7.14354574,520.0,-110.78320634,-9.231933861666668,"{'tags': ['AlB2 family', 'ZrOsSi', 'TiNiSi', 'Osmium zirconium silicide (1/1/1)']}",-110.78320634,-9.231933861666668,-0.808140226666667,['bandstructure'],True,[647807],True,2021-05-12 10:58:20.361000,NM,12,5,mp-1103293,,ZrSiOs,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Si', 'Os_pv'], 'pot_type': 'paw'}","{'Zr': 1.0, 'Si': 1.0, 'Os': 1.0}",GGA,mp-1103293,"['mp-1103293', 'mp-1416498', 'mp-1704430', 'mp-1787139', 'mp-1600162']",6.5175e-05,"{'Zr': 4.0, 'Si': 4.0, 'Os': 4.0}",197.2720753341117,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",1.3215251046477964e-06,6.5175e-05,0,0.0002607,MP,data/source/MP/cleaned/cifs/MP-mp-1103293.cif,False,,data/final/MP/graphs/Os1Si1Zr1-MP-mp-1103293.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
B2C1Er1Fe0.04Ni1.96,2,0.0133333333333333,1.0,True,B2C1Er1Fe0.04Ni1.96,B2C1Er1Ni2,8.355,Other,True,B33.333C16.667Er16.667Fe0.667Ni32.667,B-C-Er-Fe-Ni,5,Supercon,Er1Ni1.96Fe0.04B2C1,MP-mp-6098,Er1Ni2B2C1,B-C-Er-Ni,B33.333C16.667Er16.667Ni33.333,I 4/m m m,tetragonal,3.5122880026935177,3.5122880026935173,5.77805085,data/final/MP/cifs/B2C1Er1Fe0.04Ni1.96-MP-mp-6098-synth_doped.cif,data/source/MP/raw/cifs/mp-6098.cif,mp-6098,0.0,,2011-05-13 04:24:02,8.212015229638553,10.17188/1277667,"@misc{osti_1277667,
    author = ""Persson, Kristin"",
    title = ""Materials Data on ErNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1277667"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1700042'}},0.0,6.72687579,520.0,-41.84324782,-6.973874636666667,{'tags': []},-41.84324782,-6.973874636666667,-0.5216152347222227,"['xas', 'elasticity', 'bandstructure']",True,"[246431, 79576, 56651]",True,2021-05-12 10:56:27.046000,NM,6,8,mp-6098,,ErNi2B2C,"{'functional': 'PBE', 'labels': ['Er_3', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Er': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6098,"['mp-1006980', 'mp-1000513', 'mp-6098', 'mp-1441533', 'mp-1700042', 'mp-1793903', 'mp-1011723', 'mp-1589040']",0.0020747,"{'Er': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",64.35860973581151,[],NM,False,139,0,"[0.0, -0.0, -0.0, 0.0, 0.0, 0.0]",3.2236557136900987e-05,0.0020747,0,0.0020747,MP,data/source/MP/cleaned/cifs/MP-mp-6098.cif,True,,data/final/MP/graphs/B2C1Er1Fe0.04Ni1.96-MP-mp-6098-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
As1F0.09Fe1Sm1O0.91,2,0.0449999999999999,2.0,False,As2F0.18Fe2Sm2O1.82,As2Fe2Sm2O2,42.0,Ferrite,True,As25F2.25Fe25Sm25O22.75,As-F-Fe-Sm-O,5,Supercon,Sm1Fe1As1F0.09O0.91,MP-mp-20349,Sm2Fe2As2O2,As-Fe-Sm-O,As25Fe25Sm25O25,P 4/n m m,tetragonal,4.026492,4.026492,9.046755,data/final/MP/cifs/As1F0.09Fe1Sm1O0.91-MP-mp-20349-synth_doped.cif,data/source/MP/raw/cifs/mp-20349.cif,mp-20349,0.0,,2014-02-19 11:24:42,6.727802583283198,,,{'GGA+U': {'task_id': 'mp-1695938'}},0.3015723809374986,3.77685593,520.0,-52.73407138,-6.5917589225,{'tags': ['Samarium iron arsenic oxide (1/1/1/1)']},-52.73407138,-6.5917589225,-1.6285904237499995,"['xas', 'elasticity', 'bandstructure']",True,"[236652, 236653, 422002, 163457, 163458]",True,2021-05-12 10:56:16.728000,FM,8,10,mp-20349,oxide,SmFeAsO,"{'functional': 'PBE', 'labels': ['Sm_3', 'Fe_pv', 'As', 'O'], 'pot_type': 'paw'}","{'Sm': 1.0, 'Fe': 1.0, 'As': 1.0, 'O': 1.0}",GGA+U,mp-20349,"['mp-24944', 'mp-1078897', 'mp-1079866', 'mp-1173321', 'mp-20349', 'mp-1425472', 'mp-1695938', 'mp-1772503', 'mp-1789694', 'mp-1588381']",3.75729895,"{'Sm': 2.0, 'Fe': 2.0, 'As': 2.0, 'O': 2.0}",146.67176231613362,[],FM,True,129,1,"[0.0, 0.0, 3.5, 3.5, -0.0, -0.0, -0.0, -0.0]",0.0512341147425717,3.75729895,2,7.5145979,MP,data/source/MP/cleaned/cifs/MP-mp-20349.cif,True,,data/final/MP/graphs/As1F0.09Fe1Sm1O0.91-MP-mp-20349-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B2Rh3Y1,1,0.0,1.0,True,B2Rh3Y1,B2Rh3Y1,0.0,Other,True,B33.333Rh50Y16.667,B-Rh-Y,3,Supercon,Y1Rh3B2,MP-mp-1024941,Y1B2Rh3,B-Rh-Y,B33.333Rh50Y16.667,P 6/m m m,hexagonal,3.13289,5.449527999004044,5.44952827,data/final/MP/cifs/B2Rh3Y1-MP-mp-1024941.cif,data/source/MP/raw/cifs/mp-1024941.cif,mp-1024941,0.0,,2016-09-26 01:07:43,8.640178846995385,10.17188/1355578,"@article{osti_1355578,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YB2Rh3 (SG:191) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1355578"",
    place = ""United States"",
    year = ""2017"",
    month = ""5""
}
",{'GGA': {'task_id': 'mp-1696070'}},0.0,6.41238729,520.0,-46.10382696,-7.68397116,"{'tags': ['ErIr3B2', 'YRh3B2', 'Yttrium rhodium boride (1/3/2)']}",-46.10382696,-7.68397116,-0.6976081158333329,['bandstructure'],True,[615340],True,2021-05-12 10:58:09.072000,NM,6,5,mp-1024941,,YB2Rh3,"{'functional': 'PBE', 'labels': ['Y_sv', 'B', 'Rh_pv'], 'pot_type': 'paw'}","{'Y': 1.0, 'B': 2.0, 'Rh': 3.0}",GGA,mp-1024941,"['mp-1024941', 'mp-1414459', 'mp-1696070', 'mp-1860711', 'mp-1595434']",7.22e-05,"{'Y': 1.0, 'B': 2.0, 'Rh': 3.0}",80.57375130243013,[],NM,False,191,0,"[0, 0, 0, 0, 0, 0]",8.96073458575863e-07,7.22e-05,0,7.22e-05,MP,data/source/MP/cleaned/cifs/MP-mp-1024941.cif,False,,data/final/MP/graphs/B2Rh3Y1-MP-mp-1024941.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Co0.9Rh0.1V3,2,0.0499999999999999,2.0,False,Co1.8Rh0.2V6,Co2V6,0.0,Other,True,Co22.5Rh2.5V75,Co-Rh-V,3,Supercon,Co0.9Rh0.1V3,MP-mp-1585,V6Co2,Co-V,Co25V75,P m -3 n,cubic,4.652111,4.652111,4.652111,data/final/MP/cifs/Co0.9Rh0.1V3-MP-mp-1585-synth_doped.cif,data/source/MP/raw/cifs/mp-1585.cif,mp-1585,0.0,,2011-05-14 00:56:01,6.985026990677996,10.17188/1191419,"@misc{osti_1191419,
    author = ""Persson, Kristin"",
    title = ""Materials Data on V3Co (SG:223) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1191419"",
    place = ""United States"",
    year = ""2015"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1698792'}},0.0,6.09531255,520.0,-70.28982049,-8.78622756125,{'tags': ['Cobalt vanadium (1/3)']},-70.28982049,-8.78622756125,-0.1962185600000001,"['xas', 'elasticity', 'bandstructure']",True,"[102716, 625530]",True,2021-05-12 10:56:12.755000,NM,8,8,mp-1585,,V3Co,"{'functional': 'PBE', 'labels': ['V_pv', 'Co'], 'pot_type': 'paw'}","{'V': 3.0, 'Co': 1.0}",GGA,mp-1585,"['mp-941517', 'mp-941229', 'mp-934751', 'mp-1585', 'mp-1418424', 'mp-1698792', 'mp-1796546', 'mp-1589027']",0.00021955,"{'V': 6.0, 'Co': 2.0}",100.68162246758524,[],NM,False,223,0,"[0.0, 0.0, 0.0, 0.0, 0.0, 0.0, -0.0, -0.0]",4.361272586179962e-06,0.00021955,0,0.0004391,MP,data/source/MP/cleaned/cifs/MP-mp-1585.cif,True,,data/final/MP/graphs/Co0.9Rh0.1V3-MP-mp-1585-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Pt2Sb2Sr1,3,0.1,1.5,False,Pt3Sb3Sr1.5,Pt3Sb3Sr2,2.1,Other,True,Pt40Sb40Sr20,Pt-Sb-Sr,3,Supercon,Sr1Pt2Sb2,MP-mp-1206150,Sr2Sb3Pt3,Pt-Sb-Sr,Pt37.5Sb37.5Sr25,P 4/m m m,tetragonal,5.884219,5.884219,21.635248,data/final/MP/cifs/Pt2Sb2Sr1-MP-mp-1206150-synth_doped.cif,data/source/MP/raw/cifs/mp-1206150.cif,mp-1206150,0.0,,2019-01-12 09:31:09.616000,2.49551397581143,,,,1.9079694393749995,-1.64158316,520.0,-24.87168933,-3.10896116625,"{'tags': ['CaBe2Ge2', 'SrPt2Sb2']}",-24.87168933,-3.10896116625,1.0663780533333331,[],False,[],True,2021-05-12 11:00:17.126000,FM,8,3,mp-1206150,,Sr2(SbPt)3,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Sb', 'Pt'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Sb': 3.0, 'Pt': 3.0}",GGA,mp-1206150,"['mp-1206150', 'mp-1374329', 'mp-1936523']",1.014416,"{'Sr': 2.0, 'Sb': 3.0, 'Pt': 3.0}",749.0995459067998,[],FM,True,123,2,"[0.0, 0.0, 0.0, 0.0, 0.3, 0.0, 0.0, 0.0]",0.0013541805031693,1.014416,1,1.014416,MP,data/source/MP/cleaned/cifs/MP-mp-1206150.cif,True,,data/final/MP/graphs/Pt2Sb2Sr1-MP-mp-1206150-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
Ba0.257Bi1K0.743O3,2,0.0305333333333333,3.0,False,Ba0.771Bi3K2.229O9,Ba1Bi3K2O9,0.0,Oxide,True,Ba5.14Bi20K14.86O60,Ba-Bi-K-O,4,Supercon,Ba0.257K0.743Bi1O3,MP-mp-1223672,K2Ba1Bi3O9,Ba-Bi-K-O,Ba6.667Bi20K13.333O60,P -3 m 1,trigonal,6.104433996276926,6.1044332,7.481113,data/final/MP/cifs/Ba0.257Bi1K0.743O3-MP-mp-1223672-synth_doped.cif,data/source/MP/raw/cifs/mp-1223672.cif,mp-1223672,0.0,,2019-01-13 00:02:05.715000,6.784857598202287,,,{'GGA': {'task_id': 'mp-1736675'}},0.0209399281666646,2.58339382,520.0,-80.80971432,-5.387314288,{'tags': []},-80.80971432,-5.387314288,-1.7767462414000008,[],False,[],True,2021-05-12 11:00:52.054000,NM,15,4,mp-1223672,oxide,K2Ba(BiO3)3,"{'functional': 'PBE', 'labels': ['K_sv', 'Ba_sv', 'Bi', 'O'], 'pot_type': 'paw'}","{'K': 2.0, 'Ba': 1.0, 'Bi': 3.0, 'O': 9.0}",GGA,mp-1223672,"['mp-1223672', 'mp-1408017', 'mp-1736675', 'mp-1774751']",0.001083,"{'K': 2.0, 'Ba': 1.0, 'Bi': 3.0, 'O': 9.0}",241.4279662625217,[],NM,False,164,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",4.485810060721703e-06,0.001083,0,0.001083,MP,data/source/MP/cleaned/cifs/MP-mp-1223672.cif,True,,data/final/MP/graphs/Ba0.257Bi1K0.743O3-MP-mp-1223672-synth_doped.json,0,True,-3m,0,0,0,0,0,0,6,1,0,0,0,1.0,False
Li1Zn1,1,0.0,2.0,False,Li2Zn2,Li2Zn2,0.0,Other,True,Li50Zn50,Li-Zn,2,Supercon,Li1Zn1,MP-mp-1934,Li2Zn2,Li-Zn,Li50Zn50,F d -3 m,cubic,4.36608597,4.36608597,4.36608597,data/final/MP/cifs/Li1Zn1-MP-mp-1934.cif,data/source/MP/raw/cifs/mp-1934.cif,mp-1934,0.0,,2011-05-12 20:23:15,4.082778097815391,10.17188/1194345,"@misc{osti_1194345,
    author = ""Persson, Kristin"",
    title = ""Materials Data on LiZn (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1194345"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687739'}},0.0,1.47710759,520.0,-7.21203075,-1.8030076875,{'tags': ['Lithium zinc (1/1)']},-7.21203075,-1.8030076875,-0.2186744491666667,"['xas', 'elasticity', 'bandstructure']",True,"[642409, 642412, 104791, 104792]",True,2021-05-12 10:56:14.760000,NM,4,7,mp-1934,,LiZn,"{'functional': 'PBE', 'labels': ['Li_sv', 'Zn'], 'pot_type': 'paw'}","{'Li': 1.0, 'Zn': 1.0}",GGA,mp-1934,"['mp-929052', 'mp-929416', 'mp-912649', 'mp-1934', 'mp-1439277', 'mp-1687739', 'mp-1793473']",0.00023,"{'Li': 2.0, 'Zn': 2.0}",58.85208482567025,[],NM,False,227,0,"[0, 0, 0, 0]",7.816205685195304e-06,0.00023,0,0.00046,MP,data/source/MP/cleaned/cifs/MP-mp-1934.cif,False,,data/final/MP/graphs/Li1Zn1-MP-mp-1934.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Au0.7Nb3Pt0.3,3,0.0999999999999999,2.0,False,Au1.4Nb6Pt0.6,Au1Nb6Pt1,12.283333333333331,Other,True,Au17.5Nb75Pt7.5,Au-Nb-Pt,3,Supercon,Au0.7Nb3Pt0.3,MP-mp-1220356,Nb6Pt1Au1,Au-Nb-Pt,Au12.5Nb75Pt12.5,P m -3,cubic,5.228583,5.228583,5.228583,data/final/MP/cifs/Au0.7Nb3Pt0.3-MP-mp-1220356-synth_doped.cif,data/source/MP/raw/cifs/mp-1220356.cif,mp-1220356,0.0,,2019-01-12 21:12:58.665000,11.030290401850849,,,{'GGA': {'task_id': 'mp-1752668'}},0.0126696025000008,5.68232518,520.0,-71.74630402,-8.9682880025,{'tags': []},-71.74630402,-8.9682880025,-0.2242105662499991,['bandstructure'],True,[],True,2021-05-12 10:58:43.502000,NM,8,5,mp-1220356,,Nb6PtAu,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Pt', 'Au'], 'pot_type': 'paw'}","{'Nb': 6.0, 'Pt': 1.0, 'Au': 1.0}",GGA,mp-1220356,"['mp-1220356', 'mp-1406885', 'mp-1752668', 'mp-1781082', 'mp-1620053']",0.5829539,"{'Nb': 6.0, 'Pt': 1.0, 'Au': 1.0}",142.93942132303326,[],NM,False,200,0,"[0, 0, 0, 0, 0, 0, 0, 0]",0.0040783283897768,0.5829539,0,0.5829539,MP,data/source/MP/cleaned/cifs/MP-mp-1220356.cif,True,,data/final/MP/graphs/Au0.7Nb3Pt0.3-MP-mp-1220356-synth_doped.json,0,True,m-3,2,0,0,0,0,0,0,1,0,0,0,1.0,False
Fe1.6K0.8Se2,3,0.109090909090909,1.0,True,Fe1.6K0.8Se2,Fe2K1Se2,0.0,Ferrite,True,Fe36.364K18.182Se45.455,Fe-K-Se,3,Supercon,K0.8Fe1.6Se2,MP-mp-1070735,K1Fe2Se2,Fe-K-Se,Fe40K20Se40,I 4/m m m,tetragonal,3.783558000712664,3.783558000712664,7.91886339,data/final/MP/cifs/Fe1.6K0.8Se2-MP-mp-1070735-synth_doped.cif,data/source/MP/raw/cifs/mp-1070735.cif,mp-1070735,0.0,,2018-03-22 03:52:22,4.804538531009527,,,{'GGA': {'task_id': 'mp-1761650'}},0.0327827750000011,3.42423866,520.0,-27.50456218,-5.500912436,{'tags': ['Potassium iron selenide (1/2/2)']},-27.50456218,-5.500912436,-0.6812646755374999,['bandstructure'],True,[186573],True,2021-05-12 10:58:14.654000,FM,5,8,mp-1070735,,K(FeSe)2,"{'functional': 'PBE', 'labels': ['K_sv', 'Fe_pv', 'Se'], 'pot_type': 'paw'}","{'K': 1.0, 'Fe': 2.0, 'Se': 2.0}",GGA,mp-1070735,"['mp-1070735', 'mp-1070765', 'mp-1070841', 'mp-1416829', 'mp-1761650', 'mp-1797161', 'mp-1585994', 'mp-1070830']",6.0503851,"{'K': 1.0, 'Fe': 2.0, 'Se': 2.0}",106.69540665041993,[],FM,True,139,1,"[0.0, 2.8, 2.8, 0.0, 0.0]",0.0567070813069176,6.0503851,2,6.0503851,MP,data/source/MP/cleaned/cifs/MP-mp-1070735.cif,True,,data/final/MP/graphs/Fe1.6K0.8Se2-MP-mp-1070735-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ce1Mo6S8,1,0.0,1.0,True,Ce1Mo6S8,Ce1Mo6S8,0.0,Heavy_fermionChevrel,False,Ce6.667Mo40S53.333,Ce-Mo-S,3,Supercon,Ce1Mo6S8,MP-mp-38564,Ce1Mo6S8,Ce-Mo-S,Ce6.667Mo40S53.333,R -3,trigonal,6.53606757,6.53606757,6.53606814,data/final/MP/cifs/Ce1Mo6S8-MP-mp-38564.cif,data/source/MP/raw/cifs/mp-38564.cif,mp-38564,0.2046000000000001,,2013-11-14 11:55:06,5.785595127094986,,,{'GGA': {'task_id': 'mp-1705675'}},0.0,6.63314112,520.0,-117.90912039,-7.860608025999999,"{'tags': ['Cerium molybdenum sulfide (1/6/8)', 'Cerium(III) molybdenum(II/III) sulfide  (1/6/8)']}",-117.90912039,-7.860608025999999,-1.188971607999999,"['xas', 'bandstructure']",True,"[621542, 603456]",True,2021-05-12 10:57:34.594000,FM,15,9,mp-38564,,Ce(Mo3S4)2,"{'functional': 'PBE', 'labels': ['Ce', 'Mo_pv', 'S'], 'pot_type': 'paw'}","{'Ce': 1.0, 'Mo': 6.0, 'S': 8.0}",GGA,mp-38564,"['mp-938120', 'mp-676489', 'mp-948514', 'mp-949112', 'mp-38564', 'mp-1414007', 'mp-1705675', 'mp-1866151', 'mp-1599087']",0.0002776,"{'Ce': 1.0, 'Mo': 6.0, 'S': 8.0}",279.05552428938137,[],FM,True,148,1,"[0.3, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0, 0.0]",9.947841050877317e-07,0.0002776,1,0.0002776,MP,data/source/MP/cleaned/cifs/MP-mp-38564.cif,False,,data/final/MP/graphs/Ce1Mo6S8-MP-mp-38564.json,0,True,-3,0,0,0,0,0,0,2,1,0,0,0,1.0,False
Ir3Nb1,1,0.0,2.0,False,Ir6Nb2,Ir6Nb2,0.0,Other,True,Ir75Nb25,Ir-Nb,2,Supercon,Ir3Nb1,MP-mp-1186231,Nb2Ir6,Ir-Nb,Ir75Nb25,P 63/m m c,hexagonal,4.491002,5.593268004712253,5.593267850000001,data/final/MP/cifs/Ir3Nb1-MP-mp-1186231.cif,data/source/MP/raw/cifs/mp-1186231.cif,mp-1186231,0.0,,2019-01-11 14:10:01.667000,18.275184593206426,,,{'GGA': {'task_id': 'mp-1753068'}},0.0,8.54066821,520.0,-78.13001429,-9.76625178625,{'tags': []},-78.13001429,-9.76625178625,-0.6121027112500013,['bandstructure'],True,[],True,2021-05-12 10:58:29.672000,NM,8,5,mp-1186231,,NbIr3,"{'functional': 'PBE', 'labels': ['Nb_pv', 'Ir'], 'pot_type': 'paw'}","{'Nb': 1.0, 'Ir': 3.0}",GGA,mp-1186231,"['mp-1186231', 'mp-1323510', 'mp-1753068', 'mp-1803030', 'mp-1619413']",0.0001867,"{'Nb': 2.0, 'Ir': 6.0}",121.67605543460824,[],NM,False,194,0,"[0, 0, 0, 0, 0, 0, 0, 0]",3.068804282537533e-06,0.0001867,0,0.0003734,MP,data/source/MP/cleaned/cifs/MP-mp-1186231.cif,False,,data/final/MP/graphs/Ir3Nb1-MP-mp-1186231.json,0,True,6/mmm,0,7,0,0,0,0,0,1,0,0,0,1.0,False
Sb4Sn3Sr1,1,0.0,4.0,False,Sb16Sn12Sr4,Sb16Sn12Sr4,3.9,Other,True,Sb50Sn37.5Sr12.5,Sb-Sn-Sr,3,Supercon,Sr1Sn3Sb4,MP-mp-866805,Sr4Sn12Sb16,Sb-Sn-Sr,Sb50Sn37.5Sr12.5,P n m a,orthorhombic,4.445517,10.17618,23.284242,data/final/MP/cifs/Sb4Sn3Sr1-MP-mp-866805.cif,data/source/MP/raw/cifs/mp-866805.cif,mp-866805,0.0,,2014-09-05 17:29:02,5.869372021246913,10.17188/1311686,"@misc{osti_1311686,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SrSn3Sb4 (SG:62) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1311686"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1054623'}},0.0,5.66308256,520.0,-129.62966474,-4.050927023125,{'tags': ['Strontium tin antimonide (1/3/4)']},-129.62966474,-4.050927023125,-0.3676502758333337,['xas'],False,[165617],True,2021-05-12 10:57:53.781000,NM,32,6,mp-866805,,SrSn3Sb4,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Sn_d', 'Sb'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Sn': 3.0, 'Sb': 4.0}",GGA,mp-866805,"['mp-866805', 'mp-1054623', 'mp-1054571', 'mp-1326500', 'mp-1846326', 'mp-1054868']",0.014891675,"{'Sr': 4.0, 'Sn': 12.0, 'Sb': 16.0}",1053.3414152011835,[],NM,False,62,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",5.6550230666305866e-05,0.014891675,0,0.0595667,MP,data/source/MP/cleaned/cifs/MP-mp-866805.cif,False,,data/final/MP/graphs/Sb4Sn3Sr1-MP-mp-866805.json,0,True,mmm,0,0,0,7,0,0,0,1,0,0,0,1.0,False
Ni18Zr82,3,0.04,0.0975582655826558,False,Ni1.756Zr8,Ni2Zr8,2.98,Other,True,Ni18Zr82,Ni-Zr,2,Supercon,Ni18Zr82,MP-mp-1207489,Zr8Ni2,Ni-Zr,Ni20Zr80,F d -3 m,cubic,6.93639791,6.936397909999999,6.936397909999999,data/final/MP/cifs/Ni18Zr82-MP-mp-1207489-synth_doped.cif,data/source/MP/raw/cifs/mp-1207489.cif,mp-1207489,0.0,,2019-01-12 10:35:20.488000,5.961247843081591,,,,0.6438371240000009,3.76356076,520.0,-75.44189697,-7.544189697,"{'tags': ['ZrNi2', 'MgCu2', 'Friauf-Laves phase, Frank-Kasper phase']}",-75.44189697,-7.544189697,0.4499981429999991,[],False,[],True,2021-05-12 11:00:19.396000,NM,10,2,mp-1207489,,Zr4Ni,"{'functional': 'PBE', 'labels': ['Zr_sv', 'Ni_pv'], 'pot_type': 'paw'}","{'Zr': 4.0, 'Ni': 1.0}",GGA,mp-1207489,"['mp-1207489', 'mp-1879293']",0.00107465,"{'Zr': 8.0, 'Ni': 2.0}",235.9864127152436,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",9.107727751230676e-06,0.00107465,0,0.0021493,MP,data/source/MP/cleaned/cifs/MP-mp-1207489.cif,True,,data/final/MP/graphs/Ni18Zr82-MP-mp-1207489-synth_doped.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Nb0.5Ti0.5,1,0.0,2.0,False,Nb1Ti1,Nb1Ti1,10.3,Other,True,Nb50Ti50,Nb-Ti,2,Supercon,Nb0.5Ti0.5,MP-mp-1216634,Ti1Nb1,Nb-Ti,Nb50Ti50,C m m m,orthorhombic,2.84206986,2.84206986,4.639391,data/final/MP/cifs/Nb0.5Ti0.5-MP-mp-1216634.cif,data/source/MP/raw/cifs/mp-1216634.cif,mp-1216634,0.0,,2019-01-12 18:06:33.983000,6.618459515539193,,,{'GGA': {'task_id': 'mp-1674940'}},0.0348580583333326,5.3368817,520.0,-17.92708094,-8.96354047,{'tags': []},-17.92708094,-8.96354047,0.0348580583333326,['bandstructure'],True,[],True,2021-05-12 10:58:41.460000,NM,2,5,mp-1216634,,TiNb,"{'functional': 'PBE', 'labels': ['Ti_pv', 'Nb_pv'], 'pot_type': 'paw'}","{'Ti': 1.0, 'Nb': 1.0}",GGA,mp-1216634,"['mp-1216634', 'mp-1435191', 'mp-1674940', 'mp-1792381', 'mp-1637901']",0.0224333,"{'Ti': 1.0, 'Nb': 1.0}",35.31935135033959,[],NM,False,65,0,"[0, 0]",0.0006351560587135,0.0224333,0,0.0224333,MP,data/source/MP/cleaned/cifs/MP-mp-1216634.cif,False,,data/final/MP/graphs/Nb0.5Ti0.5-MP-mp-1216634.json,0,True,mmm,0,0,0,7,0,0,0,0,1,0,0,1.0,False
Bi3Ca1,1,0.0,1.0,True,Bi3Ca1,Bi3Ca1,1.85,Other,True,Bi75Ca25,Bi-Ca,2,Supercon,Bi3Ca1,MP-mp-866006,Ca1Bi3,Bi-Ca,Bi75Ca25,P m -3 m,cubic,4.996892,4.996892,4.996892,data/final/MP/cifs/Bi3Ca1-MP-mp-866006.cif,data/source/MP/raw/cifs/mp-866006.cif,mp-866006,0.0,,2014-09-01 06:32:12,8.877435872359444,10.17188/1311177,"@misc{osti_1311177,
    author = ""Persson, Kristin"",
    title = ""Materials Data on CaBi3 (SG:221) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1311177"",
    place = ""United States"",
    year = ""2016"",
    month = ""8"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1760869'}},0.0232400587499999,5.78023216,520.0,-15.1831818,-3.79579545,{'tags': []},-15.1831818,-3.79579545,-0.3768697475000002,"['bandstructure', 'elasticity']",True,[],True,2021-05-12 10:56:33.121000,NM,4,11,mp-866006,,CaBi3,"{'functional': 'PBE', 'labels': ['Ca_sv', 'Bi'], 'pot_type': 'paw'}","{'Ca': 1.0, 'Bi': 3.0}",GGA,mp-866006,"['mp-866006', 'mp-1005026', 'mp-1003528', 'mp-1053916', 'mp-1053909', 'mp-1384486', 'mp-1760869', 'mp-1802943', 'mp-1010676', 'mp-1626939', 'mp-1053918']",0.0013047,"{'Ca': 1.0, 'Bi': 3.0}",124.76704486493776,[],NM,False,221,0,"[0, 0, 0, 0]",1.0457088259262354e-05,0.0013047,0,0.0013047,MP,data/source/MP/cleaned/cifs/MP-mp-866006.cif,False,,data/final/MP/graphs/Bi3Ca1-MP-mp-866006.json,0,True,m-3m,6,0,0,0,0,0,0,1,0,0,0,1.0,False
Al1Ni2V1,1,0.0,1.0,True,Al1Ni2V1,Al1Ni2V1,0.0,Other,True,Al25Ni50V25,Al-Ni-V,3,Supercon,Ni2V1Al1,MP-mp-10899,Al1V1Ni2,Al-Ni-V,Al25Ni50V25,F m -3 m,cubic,4.09628655,4.096286549999999,4.096286549999999,data/final/MP/cifs/Al1Ni2V1-MP-mp-10899.cif,data/source/MP/raw/cifs/mp-10899.cif,mp-10899,0.0,,2011-05-28 03:07:27,6.6729401042553365,10.17188/1187440,"@misc{osti_1187440,
    author = ""Persson, Kristin"",
    title = ""Materials Data on AlVNi2 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1187440"",
    place = ""United States"",
    year = ""2015"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1699685'}},0.0462688798958321,8.15318567,520.0,-25.93841485,-6.4846037125,{'tags': ['Aluminium nickel vanadium (1/2/1)']},-25.93841485,-6.4846037125,-0.3871648974999999,"['xas', 'elasticity', 'bandstructure']",True,[58071],True,2021-05-12 10:56:10.715000,NM,4,9,mp-10899,,AlVNi2,"{'functional': 'PBE', 'labels': ['Al', 'V_pv', 'Ni_pv'], 'pot_type': 'paw'}","{'Al': 1.0, 'V': 1.0, 'Ni': 2.0}",GGA,mp-10899,"['mp-927462', 'mp-10899', 'mp-911569', 'mp-927913', 'mp-1248552', 'mp-1438624', 'mp-1699685', 'mp-1860765', 'mp-1595309']",0.0002926,"{'Al': 1.0, 'V': 1.0, 'Ni': 2.0}",48.60220712603457,[],NM,False,225,0,"[0, 0, 0, 0]",6.020302724961312e-06,0.0002926,0,0.0002926,MP,data/source/MP/cleaned/cifs/MP-mp-10899.cif,False,,data/final/MP/graphs/Al1Ni2V1-MP-mp-10899.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Cu2Gd0.9Ru1Sr2Y0.1O8,2,0.0142857142857142,2.0,False,Cu4Gd1.8Ru2Sr4Y0.2O16,Cu4Gd2Ru2Sr4O16,32.2,Cuprate,True,Cu14.286Gd6.429Ru7.143Sr14.286Y0.714O57.142857142857146,Cu-Gd-Ru-Sr-Y-O,6,Supercon,Ru1Sr2Gd0.9Y0.1Cu2O8,MP-mp-1194240,Sr4Gd2Cu4Ru2O16,Cu-Gd-Ru-Sr-O,Cu14.286Gd7.143Ru7.143Sr14.286O57.142857142857146,P 4/m b m,tetragonal,5.472451,5.472451,11.740702,data/final/MP/cifs/Cu2Gd0.9Ru1Sr2Y0.1O8-MP-mp-1194240-synth_doped.cif,data/source/MP/raw/cifs/mp-1194240.cif,mp-1194240,0.0,,2019-01-11 23:51:58.932000,6.504561898971391,,,{'GGA': {'task_id': 'mp-1765260'}},0.0213449239285443,3.93502801,520.0,-201.55352223,-7.198340079642857,"{'tags': ['Sr2Cu2GdRuO8 orth', 'Sr2Cu2GdRuO8', 'Ruthenium distrontium gadolinium dicopper octaoxide']}",-201.55352223,-7.198340079642857,-2.268654352380952,['bandstructure'],True,[245741],True,2021-05-12 10:58:35.561000,FiM,28,6,mp-1194240,oxide,Sr2GdCu2RuO8,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Gd', 'Cu_pv', 'Ru_pv', 'O'], 'pot_type': 'paw'}","{'Sr': 2.0, 'Gd': 1.0, 'Cu': 2.0, 'Ru': 1.0, 'O': 8.0}",GGA,mp-1194240,"['mp-1194240', 'mp-1396976', 'mp-1659973', 'mp-1765260', 'mp-1841948', 'mp-1638264']",4.23696715,"{'Sr': 4.0, 'Gd': 2.0, 'Cu': 4.0, 'Ru': 2.0, 'O': 16.0}",351.6072554818909,[],FiM,True,127,2,"[-0.0, -0.0, -0.0, -0.0, 6.9, 6.9, 0.0, 0.0, 0.0, 0.0, -1.8, -1.8, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0, -0.0]",0.0241005672319991,4.23696715,4,8.4739343,MP,data/source/MP/cleaned/cifs/MP-mp-1194240.cif,True,,data/final/MP/graphs/Cu2Gd0.9Ru1Sr2Y0.1O8-MP-mp-1194240-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,1,0,0,0,1.0,False
B1Li2Pd3,1,0.0,4.0,False,B4Li8Pd12,B4Li8Pd12,7.5535,Other,True,B16.667Li33.333Pd50,B-Li-Pd,3,Supercon,Li2Pd3B1,MP-mp-20657,Li8B4Pd12,B-Li-Pd,B16.667Li33.333Pd50,P 43 3 2,cubic,6.834153,6.834153,6.834153,data/final/MP/cifs/B1Li2Pd3-MP-mp-20657.cif,data/source/MP/raw/cifs/mp-20657.cif,mp-20657,0.0,,2014-02-22 22:20:25,7.157380380013985,10.17188/1195787,"@misc{osti_1195787,
    author = ""Persson, Kristin"",
    title = ""Materials Data on Li2BPd3 (SG:212) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1195787"",
    place = ""United States"",
    year = ""2016"",
    month = ""2"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1672514'}},0.0,3.54739631,520.0,-115.20693246,-4.8002888525000005,{'tags': ['Lithium palladium boride (2/3/1)']},-115.20693246,-4.8002888525000005,-0.4608083634722219,"['xas', 'bandstructure']",True,"[156465, 246447, 84931]",True,2021-05-12 10:56:57.051000,NM,24,9,mp-20657,,Li2BPd3,"{'functional': 'PBE', 'labels': ['Li_sv', 'B', 'Pd'], 'pot_type': 'paw'}","{'Li': 2.0, 'B': 1.0, 'Pd': 3.0}",GGA,mp-20657,"['mp-921382', 'mp-906713', 'mp-920352', 'mp-20657', 'mp-1116014', 'mp-1415525', 'mp-1672514', 'mp-1806936', 'mp-1654311']",4.895e-05,"{'Li': 8.0, 'B': 4.0, 'Pd': 12.0}",319.1935391161389,[],NM,False,212,0,"[0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0]",6.134209374731673e-07,4.895e-05,0,0.0001958,MP,data/source/MP/cleaned/cifs/MP-mp-20657.cif,False,,data/final/MP/graphs/B1Li2Pd3-MP-mp-20657.json,0,True,432,4,0,0,0,0,0,0,1,0,0,0,1.0,False
B2C1Ni2Pr0.15Y0.85,2,0.05,1.0,True,B2C1Ni2Pr0.15Y0.85,B2C1Ni2Y1,12.0,Other,True,B33.333C16.667Ni33.333Pr2.5Y14.167,B-C-Ni-Pr-Y,5,Supercon,Y0.85Pr0.15Ni2B2C1,MP-mp-6576,Y1Ni2B2C1,B-C-Ni-Y,B33.333C16.667Ni33.333Y16.667,I 4/m m m,tetragonal,3.548790000501972,3.548790000501972,5.76144136,data/final/MP/cifs/B2C1Ni2Pr0.15Y0.85-MP-mp-6576-synth_doped.cif,data/source/MP/raw/cifs/mp-6576.cif,mp-6576,0.0,,2011-05-13 05:21:43,6.099730998852292,10.17188/1281366,"@misc{osti_1281366,
    author = ""Persson, Kristin"",
    title = ""Materials Data on YNi2B2C (SG:139) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1281366"",
    place = ""United States"",
    year = ""2016"",
    month = ""7"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1688230'}},0.0,6.81083016,520.0,-43.677878,-7.279646333333333,{'tags': []},-43.677878,-7.279646333333333,-0.5109282141666659,"['xas', 'bandstructure']",True,"[75816, 89142, 83231, 79574, 41549]",True,2021-05-12 10:57:32.679000,NM,6,8,mp-6576,,YNi2B2C,"{'functional': 'PBE', 'labels': ['Y_sv', 'Ni_pv', 'B', 'C'], 'pot_type': 'paw'}","{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",GGA,mp-6576,"['mp-6576', 'mp-1007054', 'mp-1000583', 'mp-1439516', 'mp-1688230', 'mp-1794280', 'mp-1011792', 'mp-1597064']",0.0006603,"{'Y': 1.0, 'Ni': 2.0, 'B': 2.0, 'C': 1.0}",65.3152437079014,[],NM,False,139,0,"[0, 0, 0, 0, 0, 0]",1.010943177297096e-05,0.0006603,0,0.0006603,MP,data/source/MP/cleaned/cifs/MP-mp-6576.cif,True,,data/final/MP/graphs/B2C1Ni2Pr0.15Y0.85-MP-mp-6576-synth_doped.json,0,True,4/mmm,0,0,0,0,7,0,0,0,0,1,0,1.0,False
Ho1Pd2Sn1,1,0.0,1.0,True,Ho1Pd2Sn1,Ho1Pd2Sn1,0.0,Other,True,Ho25Pd50Sn25,Ho-Pd-Sn,3,Supercon,Pd2Ho1Sn1,MP-mp-30731,Ho1Sn1Pd2,Ho-Pd-Sn,Ho25Pd50Sn25,F m -3 m,cubic,4.796760669999999,4.796760669999999,4.796760669999999,data/final/MP/cifs/Ho1Pd2Sn1-MP-mp-30731.cif,data/source/MP/raw/cifs/mp-30731.cif,mp-30731,0.0,,2014-02-24 03:49:19,10.563844059582577,10.17188/1205091,"@misc{osti_1205091,
    author = ""Persson, Kristin"",
    title = ""Materials Data on HoSnPd2 (SG:225) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1205091"",
    place = ""United States"",
    year = ""2016"",
    month = ""4"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1697786'}},0.0,6.53064753,520.0,-22.48980771,-5.6224519275,{'tags': ['Holmium palladium tin (1/2/1)']},-22.48980771,-5.6224519275,-0.8845158412499998,"['xas', 'elasticity', 'bandstructure']",True,[104437],True,2021-05-12 10:56:18.721000,NM,4,8,mp-30731,,HoSnPd2,"{'functional': 'PBE', 'labels': ['Ho_3', 'Sn_d', 'Pd'], 'pot_type': 'paw'}","{'Ho': 1.0, 'Sn': 1.0, 'Pd': 2.0}",GGA,mp-30731,"['mp-993652', 'mp-991935', 'mp-30731', 'mp-1441436', 'mp-1697786', 'mp-1801784', 'mp-994966', 'mp-1587776']",0.0007791,"{'Ho': 1.0, 'Sn': 1.0, 'Pd': 2.0}",78.04213717166948,[],NM,False,225,0,"[0, 0, 0, 0]",9.983068483711714e-06,0.0007791,0,0.0007791,MP,data/source/MP/cleaned/cifs/MP-mp-30731.cif,False,,data/final/MP/graphs/Ho1Pd2Sn1-MP-mp-30731.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False
Pt2Sr1,1,0.0,2.0,False,Pt4Sr2,Pt4Sr2,0.35,Other,True,Pt66.667Sr33.333,Pt-Sr,2,Supercon,Pt2Sr1,MP-mp-1349,Sr2Pt4,Pt-Sr,Pt66.667Sr33.333,F d -3 m,cubic,5.58125746,5.58125746,5.58125746,data/final/MP/cifs/Pt2Sr1-MP-mp-1349.cif,data/source/MP/raw/cifs/mp-1349.cif,mp-1349,0.0,,2011-05-13 08:26:51,12.907233236122485,10.17188/1189619,"@misc{osti_1189619,
    author = ""Persson, Kristin"",
    title = ""Materials Data on SrPt2 (SG:227) by Materials Project"",
    abstractNote = ""Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations"",
    doi = ""10.17188/1189619"",
    place = ""United States"",
    year = ""2015"",
    month = ""3"",
    note = ""An optional note""
}
",{'GGA': {'task_id': 'mp-1687630'}},0.0,5.39613291,520.0,-32.77729313,-5.4628821883333325,"{'tags': ['Platinum stontium (2/1)', 'Strontium platinum (1/2)']}",-32.77729313,-5.4628821883333325,-0.8524458972222213,"['xas', 'elasticity', 'bandstructure']",True,"[108713, 108148]",True,2021-05-12 10:56:12.755000,NM,6,8,mp-1349,,SrPt2,"{'functional': 'PBE', 'labels': ['Sr_sv', 'Pt'], 'pot_type': 'paw'}","{'Sr': 1.0, 'Pt': 2.0}",GGA,mp-1349,"['mp-944126', 'mp-944758', 'mp-934071', 'mp-1349', 'mp-1300277', 'mp-1687630', 'mp-1804367', 'mp-1595768']",0.00070175,"{'Sr': 2.0, 'Pt': 4.0}",122.93659300000763,[],NM,False,227,0,"[0, 0, 0, 0, 0, 0]",1.1416454334308032e-05,0.00070175,0,0.0014035,MP,data/source/MP/cleaned/cifs/MP-mp-1349.cif,False,,data/final/MP/graphs/Pt2Sr1-MP-mp-1349.json,0,True,m-3m,6,0,0,0,0,0,0,0,0,0,1,1.0,False