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

No uploaded content is transferred in ownership from the original creators to ColabFit. All content is distributed under the license specified by its contributor who has stated that he or she has the authority to share it under the specified license.