Configuration
CO_88791326639532204
| Names | xxMD-CASSCF_malonaldehyde_train_state2_8288, xxMD-CASSCF_malonaldehyde_train_state1_8288, xxMD-CASSCF_malonaldehyde_train_state0_8288, xxMD-DFT_malonaldehyde_train_8288 |
|---|---|
| Chemical Formula Hill | C3H4O2 |
| Configuration Sets | |
| Data Objects |
DO_175284855287826932 DO_1100305632379461492 DO_1638216633461577021 DO_671452466368865252 |
| ColabFit ID | CO_88791326639532204 |
| Files | colabfitspec.json |
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