Configuration
CO_12516772818165705
| Names | xxMD-CASSCF_malonaldehyde_train_state2_3921, xxMD-CASSCF_malonaldehyde_train_state1_3921, xxMD-CASSCF_malonaldehyde_train_state0_3921, xxMD-DFT_malonaldehyde_train_3921 |
|---|---|
| Chemical Formula Hill | C3H4O2 |
| Configuration Sets | |
| Data Objects |
DO_878048009113960265 DO_1718829828253603540 DO_1306156594697708374 DO_1365096372369723182 |
| ColabFit ID | CO_12516772818165705 |
| Files | colabfitspec.json |
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