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61
SeaWolf-AI commited on
Commit
e5e063d
·
verified ·
1 Parent(s): 2291e94

Discovery: add Br3C2ClO6SeTi7 (1ClSeC2Br3O6Ti7-1)

Browse files
Files changed (1) hide show
  1. active_challenge.csv +1 -0
active_challenge.csv CHANGED
@@ -656,3 +656,4 @@ OSC-00874,1YBi2O4-1,1YBi2O4-1,Bi2O4Y,discovery,light,,ok,0.30914,2.47312,8.0,0.3
656
  OSC-00876,2BrCuO-1,2BrCuO-1,Br2Cu2O2,discovery,light,,ok,0.14166,1.13328,8.0,-1.722,1.4997,,0.5,1.00564,gaussian_dos_scf_mesh,0.0,,
657
  OSC-00881,2BrORh-1,2BrORh-1,Br2O2Rh2,discovery,light,,ok,0.11109,0.88872,8.0,-0.3909,1.9315,,0.9444,0.2024,gaussian_dos_scf_mesh,0.00283,,
658
  OSC-00882,2BrORu-1,2BrORu-1,Br2O2Ru2,discovery,light,,ok,0.16459,1.31672,8.0,0.4763,1.0644,,0.0556,0.93785,gaussian_dos_scf_mesh,0.04523,,
 
 
656
  OSC-00876,2BrCuO-1,2BrCuO-1,Br2Cu2O2,discovery,light,,ok,0.14166,1.13328,8.0,-1.722,1.4997,,0.5,1.00564,gaussian_dos_scf_mesh,0.0,,
657
  OSC-00881,2BrORh-1,2BrORh-1,Br2O2Rh2,discovery,light,,ok,0.11109,0.88872,8.0,-0.3909,1.9315,,0.9444,0.2024,gaussian_dos_scf_mesh,0.00283,,
658
  OSC-00882,2BrORu-1,2BrORu-1,Br2O2Ru2,discovery,light,,ok,0.16459,1.31672,8.0,0.4763,1.0644,,0.0556,0.93785,gaussian_dos_scf_mesh,0.04523,,
659
+ OSC-00884,1ClSeC2Br3O6Ti7-1,1ClSeC2Br3O6Ti7-1,Br3C2ClO6SeTi7,discovery,light,,ok,0.05944,0.47552,8.0,-0.7045,1.3253,,0.3333,0.31794,gaussian_dos_scf_mesh,0.04299,,