ArticleJournal of computational chemistry2020
Photochemistry in the strong coupling regime: A trajectory surface hopping scheme.
Article in Journal of computational chemistry, 2020. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Cited by 13 papers.
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Who cites it
13 citing papers in PubMed.
- Collectively-Modified Intermolecular Electron Correlations: The Connection of Polaritonic Chemistry and Spin Glass Physics.Chemical reviews · 2026Review
- Cavity Field-Driven Symmetry Breaking and Modulation of Vibrational Properties: Insights from the Analytical QED-HF Hessian.Journal of chemical theory and computation · 2025Article
- Dynamics of a light-driven molecular rotary motor in an optical cavity.Nature communications · 2025Article
- Understanding Polaritonic Chemistry from Ab Initio Quantum Electrodynamics.Chemical reviews · 2023Review
- The Rise and Current Status of Polaritonic Photochemistry and Photophysics.Chemical reviews · 2023Review
- Theoretical Advances in Polariton Chemistry and Molecular Cavity Quantum Electrodynamics.Chemical reviews · 2023Review
- Ab Initio Molecular Cavity Quantum Electrodynamics Simulations Using Machine Learning Models.Journal of chemical theory and computation · 2023Article
- Surface hopping modeling of charge and energy transfer in active environments.Physical chemistry chemical physics : PCCP · 2023Review
- Nonadiabatic Wave Packet Dynamics with Ab Initio Cavity-Born-Oppenheimer Potential Energy Surfaces.Journal of chemical theory and computation · 2023Article
- Suppressing non-radiative decay of photochromic organic molecular systems in the strong coupling regime.Physical chemistry chemical physics : PCCP · 2022Article
- Theoretical Challenges in Polaritonic Chemistry.ACS photonics · 2022Review
- Acid-catalysed liquid-to-solid transitioning of arylazoisoxazole photoswitches.Chemical science · 2021Article
- Photochemistry in the strong coupling regime: A trajectory surface hopping scheme.Journal of computational chemistry · 2020Article
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Authors and funding
4 authors.
Funding
Abstract
The strong coupling regime between confined light and organic molecules turned out to be promising in modifying both the ground state and the excited states properties. Under this peculiar condition, the electronic states of the molecule are mixed with the quantum states of light. The dynamical processes occurring on such hybrid states undergo several modifications accordingly. Hence, the dynamical description of chemical reactivity in polaritonic systems needs to explicitly take into account the photon degrees of freedom and nonadiabatic events. With the aim of describing photochemical polaritonic processes, in the present work, we extend the direct trajectory surface hopping scheme to investigate photochemistry under strong coupling between light and matter.
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