ArticleACS omega2024
Visible Light Induced Exciton Dynamics and
Article in ACS omega, 2024. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Cited by 7 papers.
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Who cites it
7 citing papers in PubMed.
- Understanding Molecular Excited States at the Metal-Molecule Interface via Transition Density Matrix AnalysisA Case Study of Azobenzene Thiols on Gold.ACS physical chemistry Au · 2026Article
- Molecular excitons in arylazopyrazole aggregates: a quantum chemical study.Scientific reports · 2026Article
- Bidirectional Photoswitching of a Tailored Azobenzene with Red and Far-Red Light Involving Triplet Sensitization in an Aqueous System.Advanced science (Weinheim, Baden-Wurttemberg, Germany) · 2026Article
- Reversible Adsorption and Interfacial Photoisomerization of Azobenzene Surfactants Studied by QCM.Langmuir : the ACS journal of surfaces and colloids · 2025Article
- Surface Hopping Molecular Dynamics Simulations for Photochemistry Involving Pyrene and CHThe journal of physical chemistry. A · 2025Article
- Photoisomerization Dynamics of Azo-Escitalopram Using Surface Hopping and a Semiempirical Method.The journal of physical chemistry. B · 2025Article
- The Role of Double Excitations in Exciton Dynamics of Multiazobenzenes: Trisazobenzenophane as a Test Case.The journal of physical chemistry letters · 2024Article
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Authors and funding
1 author.
Funding
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Abstract
Assemblies of photochromic molecules feature exciton states, which govern photochemical and photophysical processes in multichromophoric systems. Understanding the photoinduced dynamics of the assemblies requires nonadiabatic treatment involving multiple exciton states and numerous nuclear degrees of freedom, thus posing a challenge for simulations. In this work, we address this challenge for aggregates of azobenzene, a prototypical molecular switch, performing on-the-fly surface hopping calculations combined with semiempirical configuration interaction electronic structure and augmented with transition density matrix analysis to characterize exciton evolution. Specifically, we consider excitation of azobenzene tetramers in the nπ* absorption band located in the visible (blue) part of the electromagnetic spectrum, thus extending our recent work on dynamics after ππ* excitation corresponding to the ultraviolet region [Titov,
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