Configuration
CO_19363162712058822
| Names | xxMD-CASSCF_malonaldehyde_train_state2_12065, xxMD-CASSCF_malonaldehyde_train_state1_12065, xxMD-CASSCF_malonaldehyde_train_state0_12065, xxMD-DFT_malonaldehyde_train_12065 |
|---|---|
| Chemical Formula Hill | C3H4O2 |
| Configuration Sets | |
| Data Objects |
DO_272688574355638264 DO_1349424015912783929 DO_453672448146021238 DO_2262652231039429399 |
| ColabFit ID | CO_19363162712058822 |
| Files | colabfitspec.json |
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