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Dependence of Vibronic Coupling on Molecular Geometry and Environment: Bridging Hydrogen Atom Transfer and Electron–Proton Transfer

[Image: see text] The rate constants for typical concerted proton-coupled electron transfer (PCET) reactions depend on the vibronic coupling between the diabatic reactant and product states. The form of the vibronic coupling is different for electronically adiabatic and nonadiabatic reactions, which...

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Detalhes bibliográficos
Publicado no:J Am Chem Soc
Main Authors: Harshan, Aparna Karippara, Yu, Tao, Soudackov, Alexander V., Hammes-Schiffer, Sharon
Formato: Artigo
Idioma:Inglês
Publicado em: American Chemical Society 2015
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC4629534/
https://ncbi.nlm.nih.gov/pubmed/26412613
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/jacs.5b07327
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