Configuration
CO_63657095247325796
| Names | xxMD-CASSCF_malonaldehyde_train_state2_13429, xxMD-CASSCF_malonaldehyde_train_state1_13429, xxMD-CASSCF_malonaldehyde_train_state0_13429, xxMD-DFT_malonaldehyde_train_13429 |
|---|---|
| Chemical Formula Hill | C3H4O2 |
| Configuration Sets | |
| Data Objects |
DO_1346678263844204798 DO_298590639461310631 DO_315634494366975941 DO_492534924105685347 |
| ColabFit ID | CO_63657095247325796 |
| Files | colabfitspec.json |
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