Configuration

CO_5620204695582496021670733




Chemical Formula Hill C12H10N2
Configuration Sets CS_b5o2eqszavli_0
CS_tilb6xee23xc_0
Calculated Properties PO_1027065716073576190521454
PO_1101182956282842616812578
PO_1143154458573756149438293
PO_1841673217996996498747527
ColabFit ID CO_5620204695582496021670733
Names xxMD-CASSCF_azobenzene_train_state2_1752
xxMD-CASSCF_azobenzene_train_state1_1752
xxMD-CASSCF_azobenzene_train_state0_1752
xxMD-DFT_azobenzene_train_1748
Files colabfitspec.json

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