Configuration

CO_4826802633981869316035676




Chemical Formula Hill C12H10N2
Configuration Sets CS_k3k3tmavdrdc_0
CS_ytpahucbezma_0
Calculated Properties PO_1221713790957874202416219
PO_1339591365426153606177073
PO_7403532041003817521865979
PO_9196738889779544219151408
ColabFit ID CO_4826802633981869316035676
Names xxMD-CASSCF_azobenzene_test_state2_1435
xxMD-CASSCF_azobenzene_test_state1_1435
xxMD-CASSCF_azobenzene_test_state0_1435
xxMD-DFT_azobenzene_test_1428
Files colabfitspec.json

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