Configuration
CO_125244722367374287
| Names | xxMD-CASSCF_malonaldehyde_train_state2_10914, xxMD-CASSCF_malonaldehyde_train_state1_10914, xxMD-CASSCF_malonaldehyde_train_state0_10914, xxMD-DFT_malonaldehyde_train_10914 |
|---|---|
| Chemical Formula Hill | C3H4O2 |
| Configuration Sets | |
| Data Objects |
DO_2050443762029386781 DO_284743374622582405 DO_2054385751305141910 DO_27855051146690538 |
| ColabFit ID | CO_125244722367374287 |
| Files | colabfitspec.json |
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