Calculated Properties
PO_6280608040472618093607645
| Types |
energy atomic_forces |
|---|---|
| Configuration | CO_1216969609471249749068007 |
| Configuration Names |
xxMD-CASSCF_dithiophene_test_state1_1413 xxMD-CASSCF_dithiophene_test_state0_1413 xxMD-CASSCF_dithiophene_test_state2_1413 xxMD-DFT_dithiophene_test_1413 |
| ColabFit ID | PO_6280608040472618093607645 |
| Files | colabfitspec.json |
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