Configuration
CO_679936043012144327
| Names | xxMD-CASSCF_malonaldehyde_train_state2_3061, xxMD-CASSCF_malonaldehyde_train_state1_3061, xxMD-CASSCF_malonaldehyde_train_state0_3061, xxMD-DFT_malonaldehyde_train_3061 |
|---|---|
| Chemical Formula Hill | C3H4O2 |
| Configuration Sets | |
| Data Objects |
DO_1974822003354454379 DO_1251782487793000351 DO_1984838333994931920 DO_328711037650753546 |
| ColabFit ID | CO_679936043012144327 |
| Files | colabfitspec.json |
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