Configuration
CO_31871615443680703
| Names | xxMD-CASSCF_malonaldehyde_train_state2_7017, xxMD-CASSCF_malonaldehyde_train_state1_7017, xxMD-CASSCF_malonaldehyde_train_state0_7017, xxMD-DFT_malonaldehyde_train_7017 |
|---|---|
| Chemical Formula Hill | C3H4O2 |
| Configuration Sets | |
| Data Objects |
DO_250389787587232926 DO_1312743855166721442 DO_1464552159088640476 DO_523464621034519038 |
| ColabFit ID | CO_31871615443680703 |
| Files | colabfitspec.json |
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