Calculated Properties
PO_4437851859076675381464576
Types |
energy atomic_forces |
---|---|
Configuration | CO_7971962287956087766579443 |
Configuration Names |
xxMD-CASSCF_malonaldehyde_train_state2_2986 xxMD-CASSCF_malonaldehyde_train_state1_2986 xxMD-CASSCF_malonaldehyde_train_state0_2986 xxMD-DFT_malonaldehyde_train_2986 |
ColabFit ID | PO_4437851859076675381464576 |
Files | colabfitspec.json |
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