SeaWolf-AI commited on
Commit
84ec376
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verified ·
1 Parent(s): 76e2b6c

Discovery: add Ni3Se4 (1Ni3Se4-1)

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Files changed (1) hide show
  1. active_challenge.csv +1 -0
active_challenge.csv CHANGED
@@ -580,3 +580,4 @@ OSC-00753,2NiTe-4,2NiTe-4,Ni2Te2,discovery,light,,ok,0.26964,2.15712,8.0,-0.166,
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  OSC-00754,2NiTe-5,2NiTe-5,Ni2Te2,discovery,light,,ok,0.24796,1.98368,8.0,-0.3644,0.8419,,0.1667,1.4494,gaussian_dos_scf_mesh,0.05569,,
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  OSC-00755,2NiTe3-1,2NiTe3-1,Ni2Te6,discovery,light,,ok,0.25417,2.03336,8.0,1.3485,1.349,,0.3333,0.48685,gaussian_dos_scf_mesh,0.04299,,
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  OSC-00756,2NiTe3-3,2NiTe3-3,Ni2Te6,discovery,light,,ok,0.20392,1.63136,8.0,0.4303,0.5185,,0.5,0.33189,gaussian_dos_scf_mesh,0.0,,
 
 
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  OSC-00754,2NiTe-5,2NiTe-5,Ni2Te2,discovery,light,,ok,0.24796,1.98368,8.0,-0.3644,0.8419,,0.1667,1.4494,gaussian_dos_scf_mesh,0.05569,,
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  OSC-00755,2NiTe3-1,2NiTe3-1,Ni2Te6,discovery,light,,ok,0.25417,2.03336,8.0,1.3485,1.349,,0.3333,0.48685,gaussian_dos_scf_mesh,0.04299,,
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  OSC-00756,2NiTe3-3,2NiTe3-3,Ni2Te6,discovery,light,,ok,0.20392,1.63136,8.0,0.4303,0.5185,,0.5,0.33189,gaussian_dos_scf_mesh,0.0,,
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+ OSC-00757,1Ni3Se4-1,1Ni3Se4-1,Ni3Se4,discovery,light,,ok,0.16189,1.29512,8.0,-0.8474,0.5129,,0.5,0.90434,gaussian_dos_scf_mesh,0.0,,