Configuration
CO_123278825030294493
Names | xxMD-CASSCF_malonaldehyde_train_state2_9577, xxMD-CASSCF_malonaldehyde_train_state1_9577, xxMD-CASSCF_malonaldehyde_train_state0_9577, xxMD-DFT_malonaldehyde_train_9577 |
---|---|
Chemical Formula Hill | C3H4O2 |
Configuration Sets | |
Data Objects |
DO_1502860523089107380 DO_1183590737558981648 DO_1484990469020794893 DO_2228215728721042945 |
ColabFit ID | CO_123278825030294493 |
Files | colabfitspec.json |
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