2 papers
physics.chem-ph2018
Role of enviromental dynamic polarizability in static excited state properties of embedded molecular systems: Application to disordered fluorographene systems
Vladislav Sláma, Frank Müh, Thomas Renger +1
We present an extension of the standard polarizable quantum mechanic/molecular mechanics (QM/MM) approach for treating environmental effects on excited state properties of embedded…
physics.chem-ph2018
Fluorographene with Impurities as a Biomimetic Light-Harvesting Medium
Vladislav Sláma, Sayeh Rajabi, Tomáš Mančal
We investigate the prospect of using a two-dimensional material, fluorographene, to mimic light-harvesting function of natural photosynthetic antennae. We show by quantum chemical…