Exciton energy transfer inside cavity—A benchmark study of polaritonic dynamics using the surface hopping method

Strong coupling between the molecular system and photon inside the cavity generates polaritons, which can alter reaction rates by orders of magnitude. In this work, we benchmark the surface hopping method to simulate non-adiabatic dynamics in a cavity. The comparison is made against a numerically ex...

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Veröffentlicht in:	The Journal of chemical physics 2024-08, Vol.161 (5)
Hauptverfasser:	De, Priyam Kumar, Jain, Amber
Format:	Artikel
Sprache:	eng
Schlagworte:	Benchmarks Coupling (molecular) Dipoles Energy transfer Equations of motion Excitons Parameters Polaritons Resonance
Online-Zugang:	Volltext
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