Configuration
CO_2020487086924829161
| Names | xxMD-CASSCF_malonaldehyde_test_state2_5009, xxMD-CASSCF_malonaldehyde_test_state1_5009, xxMD-CASSCF_malonaldehyde_test_state0_5009, xxMD-DFT_malonaldehyde_test_5009 |
|---|---|
| Chemical Formula Hill | C3H4O2 |
| Configuration Sets | |
| Data Objects |
DO_825069511643735776 DO_760074924805085226 DO_1516171720954223250 DO_580262709673255040 |
| ColabFit ID | CO_2020487086924829161 |
| Files | colabfitspec.json |
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