Configuration
CO_270733767337712818
| Names | xxMD-CASSCF_malonaldehyde_train_state2_2245, xxMD-CASSCF_malonaldehyde_train_state1_2245, xxMD-CASSCF_malonaldehyde_train_state0_2245, xxMD-DFT_malonaldehyde_train_2245 |
|---|---|
| Chemical Formula Hill | C3H4O2 |
| Configuration Sets | |
| Data Objects |
DO_1500812051145177508 DO_866149080668411990 DO_1084582062750373237 DO_1815531780494327021 |
| ColabFit ID | CO_270733767337712818 |
| Files | colabfitspec.json |
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