Configuration
CO_815344453086450975
| Names | xxMD-CASSCF_malonaldehyde_train_state2_4910, xxMD-CASSCF_malonaldehyde_train_state1_4910, xxMD-CASSCF_malonaldehyde_train_state0_4910, xxMD-DFT_malonaldehyde_train_4910 |
|---|---|
| Chemical Formula Hill | C3H4O2 |
| Configuration Sets | |
| Data Objects |
DO_1568733124844056027 DO_2046333421611221658 DO_1252567070715910299 DO_1039601038147611819 |
| ColabFit ID | CO_815344453086450975 |
| Files | colabfitspec.json |
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