Configuration
CO_87024981350849613
| Names | xxMD-CASSCF_malonaldehyde_train_state2_12067, xxMD-CASSCF_malonaldehyde_train_state1_12067, xxMD-CASSCF_malonaldehyde_train_state0_12067, xxMD-DFT_malonaldehyde_train_12067 |
|---|---|
| Chemical Formula Hill | C3H4O2 |
| Configuration Sets | |
| Data Objects |
DO_1055474042946924128 DO_302168909744512732 DO_1236461973027524674 DO_784132070249246347 |
| ColabFit ID | CO_87024981350849613 |
| Files | colabfitspec.json |
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