Configuration
CO_1175628554628281961
| Names | xxMD-CASSCF_malonaldehyde_test_state2_398, xxMD-CASSCF_malonaldehyde_test_state1_398, xxMD-CASSCF_malonaldehyde_test_state0_398, xxMD-DFT_malonaldehyde_test_398 |
|---|---|
| Chemical Formula Hill | C3H4O2 |
| Configuration Sets | |
| Data Objects |
DO_1320463506493322089 DO_1687988222791550176 DO_1155539993213514697 DO_1107214268870717736 |
| ColabFit ID | CO_1175628554628281961 |
| Files | colabfitspec.json |
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