Configuration
CO_25530236120913934
| Names | xxMD-CASSCF_malonaldehyde_train_state2_6933, xxMD-CASSCF_malonaldehyde_train_state1_6933, xxMD-CASSCF_malonaldehyde_train_state0_6933, xxMD-DFT_malonaldehyde_train_6933 |
|---|---|
| Chemical Formula Hill | C3H4O2 |
| Configuration Sets | |
| Data Objects |
DO_2130150657083840257 DO_14362247691048773 DO_835667521342785192 DO_66761008333260855 |
| ColabFit ID | CO_25530236120913934 |
| Files | colabfitspec.json |
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