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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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Detalles Bibliográficos
Publicado en:J Am Chem Soc
Main Authors: Harshan, Aparna Karippara, Yu, Tao, Soudackov, Alexander V., Hammes-Schiffer, Sharon
Formato: Artigo
Idioma:Inglês
Publicado: American Chemical Society 2015
Acceso en liña: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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