Configuration

CO_1807807652289871965710068




Chemical Formula Hill C12H10N2
Configuration Sets CS_k3k3tmavdrdc_0
CS_ytpahucbezma_0
Calculated Properties PO_1211543786839657480073721
PO_1240232903392357386710795
PO_5270667423926012956587368
PO_8676038956075328475045014
ColabFit ID CO_1807807652289871965710068
Names xxMD-CASSCF_azobenzene_test_state2_507
xxMD-CASSCF_azobenzene_test_state1_507
xxMD-CASSCF_azobenzene_test_state0_507
xxMD-DFT_azobenzene_test_507
Files colabfitspec.json

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