Configuration
CO_768005267777404631
| Names | xxMD-CASSCF_malonaldehyde_train_state2_6338, xxMD-CASSCF_malonaldehyde_train_state1_6338, xxMD-CASSCF_malonaldehyde_train_state0_6338, xxMD-DFT_malonaldehyde_train_6338 |
|---|---|
| Chemical Formula Hill | C3H4O2 |
| Configuration Sets | |
| Data Objects |
DO_1106146171759307675 DO_2134475268299339471 DO_2159179114866089094 DO_1433757049044436219 |
| ColabFit ID | CO_768005267777404631 |
| Files | colabfitspec.json |
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