Configuration

CO_1560817081817559267121522




Chemical Formula Hill C12H10N2
Configuration Sets CS_b5o2eqszavli_0
CS_tilb6xee23xc_0
Calculated Properties PO_2574823813784751857876241
PO_3399562488696564148506877
PO_4366387482944563926886531
PO_9829083412652430744184132
ColabFit ID CO_1560817081817559267121522
Names xxMD-CASSCF_azobenzene_train_state2_551
xxMD-CASSCF_azobenzene_train_state1_551
xxMD-CASSCF_azobenzene_train_state0_551
xxMD-DFT_azobenzene_train_548
Files colabfitspec.json

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