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Analysis of Kinetic Isotope Effects for Proton-Coupled Electron Transfer Reactions

A series of rate constant expressions for nonadiabatic proton-coupled electron transfer (PCET) reactions are analyzed and compared. The approximations underlying each expression are enumerated, and the regimes of validity for each expression are illustrated by calculations on model systems. In addit...

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Bibliographic Details
Main Authors: Edwards, Sarah, Soudackov, Alexander V., Hammes-Schiffer, Sharon
Format: Artigo
Language:Inglês
Published: 2009
Subjects:
Online Access:https://ncbi.nlm.nih.gov/pmc/articles/PMC2880663/
https://ncbi.nlm.nih.gov/pubmed/19182970
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/jp809122y
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