SeaWolf-AI commited on
Commit
a5d7d0b
·
verified ·
1 Parent(s): 829ac3e

Discovery: add C2F2Se2Zr3 (1C2F2Se2Zr3-1)

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Files changed (1) hide show
  1. active_challenge.csv +1 -0
active_challenge.csv CHANGED
@@ -922,3 +922,4 @@ OSC-01733,1BrCoINiS2-1,1BrCoINiS2-1,BrCoINiS2,discovery,light,,ok,0.19432,1.5545
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  OSC-01734,1BrSIr2Pd2I3Se3-1,1BrSIr2Pd2I3Se3-1,BrI3Ir2Pd2SSe3,discovery,light,,ok,0.17859,1.42872,8.0,-0.2445,1.003,,0.0,0.29319,gaussian_dos_scf_mesh,0.03844,,
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  OSC-01735,1BrIrI3Ni5S6-1,1BrIrI3Ni5S6-1,BrI3IrNi5S6,discovery,light,,ok,0.04936,0.39488,8.0,-0.9383,0.5221,,0.5,0.46185,gaussian_dos_scf_mesh,0.0,,
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  OSC-01738,1C2F2S2Zr3-1,1C2F2S2Zr3-1,C2F2S2Zr3,discovery,light,,ok,0.17666,1.41328,8.0,2.7581,1.963,,0.9444,0.10735,gaussian_dos_scf_mesh,0.00283,,
 
 
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  OSC-01734,1BrSIr2Pd2I3Se3-1,1BrSIr2Pd2I3Se3-1,BrI3Ir2Pd2SSe3,discovery,light,,ok,0.17859,1.42872,8.0,-0.2445,1.003,,0.0,0.29319,gaussian_dos_scf_mesh,0.03844,,
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  OSC-01735,1BrIrI3Ni5S6-1,1BrIrI3Ni5S6-1,BrI3IrNi5S6,discovery,light,,ok,0.04936,0.39488,8.0,-0.9383,0.5221,,0.5,0.46185,gaussian_dos_scf_mesh,0.0,,
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  OSC-01738,1C2F2S2Zr3-1,1C2F2S2Zr3-1,C2F2S2Zr3,discovery,light,,ok,0.17666,1.41328,8.0,2.7581,1.963,,0.9444,0.10735,gaussian_dos_scf_mesh,0.00283,,
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+ OSC-01739,1C2F2Se2Zr3-1,1C2F2Se2Zr3-1,C2F2Se2Zr3,discovery,light,,ok,0.13782,1.10256,8.0,2.4751,0.0955,,0.9444,0.21879,gaussian_dos_scf_mesh,0.00283,,