Configuration
CO_319651972578423924
| Names | xxMD-CASSCF_malonaldehyde_train_state2_10001, xxMD-CASSCF_malonaldehyde_train_state1_10001, xxMD-CASSCF_malonaldehyde_train_state0_10001, xxMD-DFT_malonaldehyde_train_10001 |
|---|---|
| Chemical Formula Hill | C3H4O2 |
| Configuration Sets | |
| Data Objects |
DO_1634551565564692824 DO_1508920980320051266 DO_276223835144265854 DO_1441708005878812955 |
| ColabFit ID | CO_319651972578423924 |
| Files | colabfitspec.json |
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