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60
SeaWolf-AI commited on
Commit
ce2ed4a
·
verified ·
1 Parent(s): c04bfb8

Discovery: add BrCl3Nb4O4 (1BrCl3Nb4O4-1)

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Files changed (1) hide show
  1. active_challenge.csv +1 -0
active_challenge.csv CHANGED
@@ -360,3 +360,4 @@ OSC-00381,1KMo2O2Br6-1,1KMo2O2Br6-1,Br6KMo2O2,discovery,light,,ok,0.15718,1.2574
360
  OSC-00382,1KO2W2Br6-1,1KO2W2Br6-1,Br6KO2W2,discovery,light,,ok,0.20357,1.62856,8.0,-3.0196,0.608,,0.3889,0.25573,gaussian_dos_scf_mesh,0.01269,,
361
  OSC-00383,1NaMo2O2Br6-1,1NaMo2O2Br6-1,Br6Mo2NaO2,discovery,light,,ok,0.16497,1.31976,8.0,-3.4962,0.545,,0.4444,0.4073,gaussian_dos_scf_mesh,0.0,,
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  OSC-00384,1NaO2W2Br6-1,1NaO2W2Br6-1,Br6NaO2W2,discovery,light,,ok,0.21249,1.69992,8.0,-3.0261,0.6109,,0.3889,0.2507,gaussian_dos_scf_mesh,0.01269,,
 
 
360
  OSC-00382,1KO2W2Br6-1,1KO2W2Br6-1,Br6KO2W2,discovery,light,,ok,0.20357,1.62856,8.0,-3.0196,0.608,,0.3889,0.25573,gaussian_dos_scf_mesh,0.01269,,
361
  OSC-00383,1NaMo2O2Br6-1,1NaMo2O2Br6-1,Br6Mo2NaO2,discovery,light,,ok,0.16497,1.31976,8.0,-3.4962,0.545,,0.4444,0.4073,gaussian_dos_scf_mesh,0.0,,
362
  OSC-00384,1NaO2W2Br6-1,1NaO2W2Br6-1,Br6NaO2W2,discovery,light,,ok,0.21249,1.69992,8.0,-3.0261,0.6109,,0.3889,0.2507,gaussian_dos_scf_mesh,0.01269,,
363
+ OSC-00385,1BrCl3Nb4O4-1,1BrCl3Nb4O4-1,BrCl3Nb4O4,discovery,light,,ok,0.1588,1.2704,8.0,0.6869,0.0895,,0.9444,0.1608,gaussian_dos_scf_mesh,0.00283,,