Configuration

CO_1290397088373372940407818




Chemical Formula Hill C12H10N2
Configuration Sets CS_b5o2eqszavli_0
CS_tilb6xee23xc_0
Calculated Properties PO_1644092893336280281123827
PO_6002630524422840030511630
PO_6095477842603036893885478
PO_6844552583169744915319500
ColabFit ID CO_1290397088373372940407818
Names xxMD-CASSCF_azobenzene_train_state2_2248
xxMD-CASSCF_azobenzene_train_state1_2248
xxMD-CASSCF_azobenzene_train_state0_2248
xxMD-DFT_azobenzene_train_2244
Files colabfitspec.json

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