SeaWolf-AI commited on
Commit
2e691c9
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verified ·
1 Parent(s): f6d32c9

Discovery: add BrINZr2 (1BrINZr2-1)

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Files changed (1) hide show
  1. active_challenge.csv +1 -0
active_challenge.csv CHANGED
@@ -433,3 +433,4 @@ OSC-00471,2BrOsSe-1,2BrOsSe-1,Br2Os2Se2,discovery,light,,ok,0.22322,1.78576,8.0,
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  OSC-00472,2BrRuS-1,2BrRuS-1,Br2Ru2S2,discovery,light,,ok,0.22054,1.76432,8.0,-0.5302,0.9555,,0.0556,0.56158,gaussian_dos_scf_mesh,0.04523,,
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  OSC-00473,2BrRuSe-1,2BrRuSe-1,Br2Ru2Se2,discovery,light,,ok,0.17791,1.42328,8.0,-0.6527,0.961,,0.0556,0.89003,gaussian_dos_scf_mesh,0.04523,,
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  OSC-00475,1BrNTeSe2C3Cl4Ta8-1,1BrNTeSe2C3Cl4Ta8-1,BrC3Cl4NSe2Ta8Te,discovery,light,,ok,0.11762,0.94096,8.0,3.003,1.2755,,0.2778,0.27834,gaussian_dos_scf_mesh,0.05849,,
 
 
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  OSC-00472,2BrRuS-1,2BrRuS-1,Br2Ru2S2,discovery,light,,ok,0.22054,1.76432,8.0,-0.5302,0.9555,,0.0556,0.56158,gaussian_dos_scf_mesh,0.04523,,
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  OSC-00473,2BrRuSe-1,2BrRuSe-1,Br2Ru2Se2,discovery,light,,ok,0.17791,1.42328,8.0,-0.6527,0.961,,0.0556,0.89003,gaussian_dos_scf_mesh,0.04523,,
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  OSC-00475,1BrNTeSe2C3Cl4Ta8-1,1BrNTeSe2C3Cl4Ta8-1,BrC3Cl4NSe2Ta8Te,discovery,light,,ok,0.11762,0.94096,8.0,3.003,1.2755,,0.2778,0.27834,gaussian_dos_scf_mesh,0.05849,,
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+ OSC-00476,1BrINZr2-1,1BrINZr2-1,BrINZr2,discovery,light,,ok,0.25703,2.05624,8.0,3.1792,0.9155,,0.1111,0.51535,gaussian_dos_scf_mesh,0.04726,,