Configuration
CO_99762983059485215
| Names | xxMD-CASSCF_malonaldehyde_train_state2_8571, xxMD-CASSCF_malonaldehyde_train_state1_8571, xxMD-CASSCF_malonaldehyde_train_state0_8571, xxMD-DFT_malonaldehyde_train_8571 |
|---|---|
| Chemical Formula Hill | C3H4O2 |
| Configuration Sets | |
| Data Objects |
DO_2248146541181844716 DO_1372573889223932757 DO_2087618309821332813 DO_9028538407664984 |
| ColabFit ID | CO_99762983059485215 |
| Files | colabfitspec.json |
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