Intermolecular-Type Conical Intersections in Benzene Dimer
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DOI: 10.3390/ijms24032906
Abstract: The equilibrium and conical intersection geometries of the benzene dimer were computed in the framework of the conventional, linear-response time-dependent and spin-flipped time-dependent density functional theories (known as DFT, TDDFT and SF-TDDFT) as well as… read more here.
Keywords: benzene dimer; intermolecular type; intersections benzene; type conical ... See more keywords