Calculated Properties
PO_3966051979732342502239043
Types |
energy atomic_forces |
---|---|
Configuration | CO_7742537234801996794913188 |
Configuration Names |
xxMD-CASSCF_malonaldehyde_train_state2_4174 xxMD-CASSCF_malonaldehyde_train_state1_4174 xxMD-CASSCF_malonaldehyde_train_state0_4174 xxMD-DFT_malonaldehyde_train_4174 |
ColabFit ID | PO_3966051979732342502239043 |
Files | colabfitspec.json |
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