Configuration

CO_3249606910158144543080568




Chemical Formula Hill C12H10N2
Configuration Sets CS_k3k3tmavdrdc_0
CS_ytpahucbezma_0
Calculated Properties PO_2106431038299266265078034
PO_6626488756366439121109834
PO_7363492182437825477084653
PO_8472280380525514179737108
ColabFit ID CO_3249606910158144543080568
Names xxMD-CASSCF_azobenzene_test_state2_204
xxMD-CASSCF_azobenzene_test_state1_204
xxMD-CASSCF_azobenzene_test_state0_204
xxMD-DFT_azobenzene_test_204
Files colabfitspec.json

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