Configuration

CO_6414014861823747042657337




Chemical Formula Hill C12H10N2
Configuration Sets CS_k3k3tmavdrdc_0
CS_ytpahucbezma_0
Calculated Properties PO_1100163029786265594811562
PO_1925987579532667025630833
PO_2858189607720964268913395
PO_6968617127945092813137781
ColabFit ID CO_6414014861823747042657337
Names xxMD-CASSCF_azobenzene_test_state2_1794
xxMD-CASSCF_azobenzene_test_state1_1794
xxMD-CASSCF_azobenzene_test_state0_1794
xxMD-DFT_azobenzene_test_1785
Files colabfitspec.json

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