Configuration
CO_70917025519368151
| Names | xxMD-CASSCF_malonaldehyde_train_state2_979, xxMD-CASSCF_malonaldehyde_train_state1_979, xxMD-CASSCF_malonaldehyde_train_state0_979, xxMD-DFT_malonaldehyde_train_979 |
|---|---|
| Chemical Formula Hill | C3H4O2 |
| Configuration Sets | |
| Data Objects |
DO_1475617093369369141 DO_2200463142987400717 DO_375459569028795615 DO_2042631251310968367 |
| ColabFit ID | CO_70917025519368151 |
| Files | colabfitspec.json |
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