Calculated Properties
PO_1623177464327997738720431
| Types |
energy atomic_forces |
|---|---|
| Configuration | CO_7408316483882471091133665 |
| Configuration Names |
xxMD-CASSCF_dithiophene_test_state1_410 xxMD-CASSCF_dithiophene_test_state0_410 xxMD-CASSCF_dithiophene_test_state2_410 xxMD-DFT_dithiophene_test_410 |
| ColabFit ID | PO_1623177464327997738720431 |
| Files | colabfitspec.json |
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