Configuration
CO_1015039158147517700275579
Chemical Formula Hill | C3H4O2 |
---|---|
Configuration Sets |
CS_qz8z9nf1qkli_0 CS_2lnm02nz5xx2_0 |
Calculated Properties |
PO_1119299513731398213056486 PO_3682330561983343917692777 PO_7580928582516923741081616 PO_8542051807059923712601167 |
ColabFit ID | CO_1015039158147517700275579 |
Names |
xxMD-CASSCF_malonaldehyde_test_state2_817 xxMD-CASSCF_malonaldehyde_test_state1_817 xxMD-CASSCF_malonaldehyde_test_state0_817 xxMD-DFT_malonaldehyde_test_817 |
Files | colabfitspec.json |
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