Configuration

CO_1039575152210421137454686




Chemical Formula Hill C3H4O2
Configuration Sets CS_rexx7dmeb1aw_0
CS_346fs8xtkrfh_0
Calculated Properties PO_2942501840334412483732228
PO_3408980698465107068012208
PO_5836273103512629813804045
PO_6626127947531785922516900
ColabFit ID CO_1039575152210421137454686
Names xxMD-CASSCF_malonaldehyde_val_state2_4173
xxMD-CASSCF_malonaldehyde_val_state1_4173
xxMD-CASSCF_malonaldehyde_val_state0_4173
xxMD-DFT_malonaldehyde_val_4173
Files colabfitspec.json

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