Configuration
CO_341372462915780524
| Names | xxMD-CASSCF_malonaldehyde_train_state2_5965, xxMD-CASSCF_malonaldehyde_train_state1_5965, xxMD-CASSCF_malonaldehyde_train_state0_5965, xxMD-DFT_malonaldehyde_train_5965 |
|---|---|
| Chemical Formula Hill | C3H4O2 |
| Configuration Sets | |
| Data Objects |
DO_1852120106567677039 DO_430430898853424361 DO_635113716543997430 DO_507745285022474231 |
| ColabFit ID | CO_341372462915780524 |
| Files | colabfitspec.json |
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