Benchmarking semiclassical and perturbative methods for real-time simulations of cavity-bound emission and interference

Norah M. Hoffmann, Christian Schäfer, Niko Säkkinen, Angel Rubio, Heiko Appel, Aaron Kelly

Research output: Contribution to journalArticlepeer-review

Abstract

We benchmark a selection of semiclassical and perturbative dynamics techniques by investigating the correlated evolution of a cavity-bound atomic system to assess their applicability to study problems involving strong light-matter interactions in quantum cavities. The model system of interest features spontaneous emission, interference, and strong coupling behavior and necessitates the consideration of vacuum fluctuations and correlated light-matter dynamics. We compare a selection of approximate dynamics approaches including fewest switches surface hopping (FSSH), multitrajectory Ehrenfest dynamics, linearized semiclassical dynamics, and partially linearized semiclassical dynamics. Furthermore, investigating self-consistent perturbative methods, we apply the Bogoliubov-Born-Green-Kirkwood-Yvon hierarchy in the second Born approximation. With the exception of fewest switches surface hopping, all methods provide a reasonable level of accuracy for the correlated light-matter dynamics, with most methods lacking the capacity to fully capture interference effects.

Original languageEnglish (US)
Article number244113
JournalJournal of Chemical Physics
Volume151
Issue number24
DOIs
StatePublished - Dec 28 2019

ASJC Scopus subject areas

  • General Physics and Astronomy
  • Physical and Theoretical Chemistry

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