Configuration
CO_294517936405255187
| Names | xxMD-CASSCF_malonaldehyde_test_state2_336, xxMD-CASSCF_malonaldehyde_test_state1_336, xxMD-CASSCF_malonaldehyde_test_state0_336, xxMD-DFT_malonaldehyde_test_336 |
|---|---|
| Chemical Formula Hill | C3H4O2 |
| Configuration Sets | |
| Data Objects |
DO_1647449577364864630 DO_2133845511241137769 DO_173195226478213988 DO_886616296338324716 |
| ColabFit ID | CO_294517936405255187 |
| Files | colabfitspec.json |
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