Configuration
CO_17184874122353380
| Names | xxMD-CASSCF_malonaldehyde_val_state2_6727, xxMD-CASSCF_malonaldehyde_val_state1_6727, xxMD-CASSCF_malonaldehyde_val_state0_6727, xxMD-DFT_malonaldehyde_val_6725 |
|---|---|
| Chemical Formula Hill | C3H4O2 |
| Configuration Sets | |
| Data Objects |
DO_2285426035959457775 DO_1155419857851502040 DO_994757918412366374 DO_654226881405727988 |
| ColabFit ID | CO_17184874122353380 |
| Files | colabfitspec.json |
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