Non-adiabatic dynamics of photochemistry in plasmonic environments

Yu Zhang

doi:10.1117/12.2675085

5 October 2023 Non-adiabatic dynamics of photochemistry in plasmonic environments

Yu Zhang

Proceedings Volume PC12650, Physical Chemistry of Semiconductor Materials and Interfaces XXII; PC126500J (2023) https://doi.org/10.1117/12.2675085
Event: SPIE Nanoscience + Engineering, 2023, San Diego, California, United States

Abstract

Light-Matter interaction is essential in chemistry, physics, and material science. Modifying potential energy surfaces due to light-matter interactions leads to new chemical reaction pathways. A deep understanding of the fundamental details of light-matter interactions usually requires simulations of non-adiabatic transitions among a dense manifold of excited states. We recently developed several formalisms to address the light-matter interaction-induced non-adiabatic phenomena. First, I will discuss our recent developments in theory and numerical methods for simulating plasmon-mediated chemical reactions and the physical insights obtained. Then, we will present our recent developments of theoretical methods for calculating polariton states and simulating polariton dynamics, including QED coupled-cluster theory and ab-initio multiple cloning methods.

Conference Presentation

Citation Download Citation

Yu Zhang "Non-adiabatic dynamics of photochemistry in plasmonic environments", Proc. SPIE PC12650, Physical Chemistry of Semiconductor Materials and Interfaces XXII, PC126500J (5 October 2023); https://doi.org/10.1117/12.2675085

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