Configuration
CO_43370346011621590
| Names | xxMD-CASSCF_malonaldehyde_val_state2_5650, xxMD-CASSCF_malonaldehyde_val_state1_5650, xxMD-CASSCF_malonaldehyde_val_state0_5650, xxMD-DFT_malonaldehyde_val_5650 |
|---|---|
| Chemical Formula Hill | C3H4O2 |
| Configuration Sets | |
| Data Objects |
DO_457554323402746758 DO_328243303576414934 DO_1338303915754637268 DO_2091264652916673661 |
| ColabFit ID | CO_43370346011621590 |
| Files | colabfitspec.json |
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