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63
SeaWolf-AI commited on
Commit
9751fb7
·
verified ·
1 Parent(s): 18f1f22

Discovery: add BO2Zr2 (1BO2Zr2-1)

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Files changed (1) hide show
  1. active_challenge.csv +1 -0
active_challenge.csv CHANGED
@@ -650,3 +650,4 @@ OSC-00864,1AuBa2I2O2-1,1AuBa2I2O2-1,AuBa2I2O2,discovery,light,,ok,0.44922,3.5937
650
  OSC-00867,1B2H2O2Zr3-1,1B2H2O2Zr3-1,B2H2O2Zr3,discovery,light,,ok,0.15449,1.23592,8.0,4.1481,1.9599,,0.9444,0.20231,gaussian_dos_scf_mesh,0.00283,,
651
  OSC-00868,1BNb2O2-1,1BNb2O2-1,BNb2O2,discovery,light,,ok,0.21611,1.72888,8.0,1.3153,0.9799,,0.0556,0.37915,gaussian_dos_scf_mesh,0.04523,,
652
  OSC-00869,1BO2Ta2-1,1BO2Ta2-1,BO2Ta2,discovery,light,,ok,0.27259,2.18072,8.0,1.6932,0.9706,,0.0556,0.37123,gaussian_dos_scf_mesh,0.04523,,
 
 
650
  OSC-00867,1B2H2O2Zr3-1,1B2H2O2Zr3-1,B2H2O2Zr3,discovery,light,,ok,0.15449,1.23592,8.0,4.1481,1.9599,,0.9444,0.20231,gaussian_dos_scf_mesh,0.00283,,
651
  OSC-00868,1BNb2O2-1,1BNb2O2-1,BNb2O2,discovery,light,,ok,0.21611,1.72888,8.0,1.3153,0.9799,,0.0556,0.37915,gaussian_dos_scf_mesh,0.04523,,
652
  OSC-00869,1BO2Ta2-1,1BO2Ta2-1,BO2Ta2,discovery,light,,ok,0.27259,2.18072,8.0,1.6932,0.9706,,0.0556,0.37123,gaussian_dos_scf_mesh,0.04523,,
653
+ OSC-00870,1BO2Zr2-1,1BO2Zr2-1,BO2Zr2,discovery,light,,ok,0.41635,3.3308,8.0,0.9822,1.1347,,0.1111,0.23515,gaussian_dos_scf_mesh,0.04726,,