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Impact of vibronic coupling effects on light-driven charge transfer in pyrene-functionalized middle and large-sized metalloid gold nanoclusters from Ehrenfest dynamics

Adrián Domínguez-Castro, Thomas Frauenheim

2021Physical Chemistry Chemical Physics11 citationsDOI

Abstract

Ehrenfest dynamics study describing the photoinduced charge transfer in metalloid gold nanoclusters.

Topics & Concepts

NanoclustersMetalloidCharge (physics)PyreneChemical physicsCoupling (piping)Materials sciencePhotochemistryMolecular physicsAtomic physicsNanotechnologyChemistryPhysicsMetalQuantum mechanicsOrganic chemistryMetallurgyNanocluster Synthesis and ApplicationsGold and Silver Nanoparticles Synthesis and ApplicationsAdvanced Nanomaterials in Catalysis
Impact of vibronic coupling effects on light-driven charge transfer in pyrene-functionalized middle and large-sized metalloid gold nanoclusters from Ehrenfest dynamics | Litcius