A semiclassical theory of electron transfer reactions in Condon approximation and beyond

A. M. Kuznetsov, V. V. Sokolov, Jens Ulstrup

Research output: Contribution to journalJournal articleResearchpeer-review

Abstract

The effect of the modulation of the electronic wave functions by configurational fluctuations of the molecular environment on the kinetic parameters of electron transfer reactions is discussed. A self-consistent algorithm for the calculation of the potential profile along the reaction coordinate of adiabatic electron transfer reactions is elaborated. A new formula for the transition probability of non-adiabatic electron transfer reactions is obtained in an improved Condon approximation A regular method for the calculation of non-Condon corrections is suggested. The importance of these effects for some specific biological and electrochemical electron transfer systems is discussed.
Original languageEnglish
JournalJournal of Electroanalytical Chemistry
Volume502
Issue number1-2
Pages (from-to)36-46
ISSN1572-6657
Publication statusPublished - 2001

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