Configuration
CO_2008509503387714026
| Names | xxMD-CASSCF_malonaldehyde_test_state2_4649, xxMD-CASSCF_malonaldehyde_test_state1_4649, xxMD-CASSCF_malonaldehyde_test_state0_4649, xxMD-DFT_malonaldehyde_test_4649 |
|---|---|
| Chemical Formula Hill | C3H4O2 |
| Configuration Sets | |
| Data Objects |
DO_223076457066208417 DO_1692026505928544813 DO_1658241403325805257 DO_377644339294687306 |
| ColabFit ID | CO_2008509503387714026 |
| Files | colabfitspec.json |
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