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Preview | Title | Author(s) | Program | Method(s) | Basis Set | Energy | Solv. | Vibr. |
---|---|---|---|---|---|---|---|---|
![]() | AQME_workflow | Alegre Requena, Juan Vicente | Gaussian; 16; EM64L-G16RevA.03 | UwB97XD | 6-31+G(D) | -0.500262173673; Eh |
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