Configuration
CO_482117156919509246
| Names | xxMD-CASSCF_malonaldehyde_train_state2_1650, xxMD-CASSCF_malonaldehyde_train_state1_1650, xxMD-CASSCF_malonaldehyde_train_state0_1650, xxMD-DFT_malonaldehyde_train_1650 |
|---|---|
| Chemical Formula Hill | C3H4O2 |
| Configuration Sets | |
| Data Objects |
DO_1350538546575996853 DO_1646330149185601744 DO_431700953641988422 DO_640623950521336386 |
| ColabFit ID | CO_482117156919509246 |
| Files | colabfitspec.json |
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