Configuration
CO_956753611379544248
| Names | xxMD-CASSCF_malonaldehyde_test_state2_2658, xxMD-CASSCF_malonaldehyde_test_state1_2658, xxMD-CASSCF_malonaldehyde_test_state0_2658, xxMD-DFT_malonaldehyde_test_2658 |
|---|---|
| Chemical Formula Hill | C3H4O2 |
| Configuration Sets | |
| Data Objects |
DO_2009503416944983917 DO_2086062633702131402 DO_2270152326600421018 DO_838240432013739292 |
| ColabFit ID | CO_956753611379544248 |
| Files | colabfitspec.json |
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