Configuration
CO_247856552773047651
| Names | xxMD-CASSCF_malonaldehyde_train_state2_3451, xxMD-CASSCF_malonaldehyde_train_state1_3451, xxMD-CASSCF_malonaldehyde_train_state0_3451, xxMD-DFT_malonaldehyde_train_3451 |
|---|---|
| Chemical Formula Hill | C3H4O2 |
| Configuration Sets | |
| Data Objects |
DO_925434867086489648 DO_1057206995610805606 DO_1301311684410436964 DO_1464650910641907408 |
| ColabFit ID | CO_247856552773047651 |
| Files | colabfitspec.json |
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