Configuration
CO_2300862083443079728
Names | xxMD-CASSCF_malonaldehyde_test_state2_2310, xxMD-CASSCF_malonaldehyde_test_state1_2310, xxMD-CASSCF_malonaldehyde_test_state0_2310, xxMD-DFT_malonaldehyde_test_2310 |
---|---|
Chemical Formula Hill | C3H4O2 |
Configuration Sets | |
Data Objects |
DO_669294586654743009 DO_339957408530230655 DO_1915797029179086503 DO_2258366964744977670 |
ColabFit ID | CO_2300862083443079728 |
Files | colabfitspec.json |
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