Configuration
CO_45629827216031323
| Names | xxMD-CASSCF_malonaldehyde_train_state2_10956, xxMD-CASSCF_malonaldehyde_train_state1_10956, xxMD-CASSCF_malonaldehyde_train_state0_10956, xxMD-DFT_malonaldehyde_train_10956 |
|---|---|
| Chemical Formula Hill | C3H4O2 |
| Configuration Sets | |
| Data Objects |
DO_2162896799618216877 DO_879697295773661658 DO_1965720868464243017 DO_1517936515385862777 |
| ColabFit ID | CO_45629827216031323 |
| Files | colabfitspec.json |
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