Calculated Properties
PO_8431045693384940501682450
| Types |
energy atomic_forces |
|---|---|
| Configuration | CO_1138738645202136960497136 |
| Configuration Names |
xxMD-CASSCF_azobenzene_test_state2_772 xxMD-CASSCF_azobenzene_test_state1_772 xxMD-CASSCF_azobenzene_test_state0_772 xxMD-DFT_azobenzene_test_772 |
| ColabFit ID | PO_8431045693384940501682450 |
| Files | colabfitspec.json |
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