Configuration
CO_209936537151395578
| Names | xxMD-CASSCF_malonaldehyde_train_state2_11603, xxMD-CASSCF_malonaldehyde_train_state1_11603, xxMD-CASSCF_malonaldehyde_train_state0_11603, xxMD-DFT_malonaldehyde_train_11603 |
|---|---|
| Chemical Formula Hill | C3H4O2 |
| Configuration Sets | |
| Data Objects |
DO_1214699691384445837 DO_2084905954890854531 DO_989217384265920407 DO_1760641657399646477 |
| ColabFit ID | CO_209936537151395578 |
| Files | colabfitspec.json |
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