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Dynamics of electron transfer for a nonsuperexchange coherent mechanism. 2. Numerical calculations

Almeida, R. and Marcus, R. A. (1990) Dynamics of electron transfer for a nonsuperexchange coherent mechanism. 2. Numerical calculations. Journal of Physical Chemistry, 94 (7). pp. 2978-2985. ISSN 0022-3654. https://resolver.caltech.edu/CaltechAUTHORS:20150514-152741359

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Abstract

The expressions in part 1 are used to treat the dynamics of electron transfer in the donor-acceptor system D*BA via a molecular bridge B. By use of a fast Fourier transform method, results are obtained for the maximum "population" of B^- and for other properties for this coherent but nonsuperexchange model. Several approximate ideas on rate populations and energy distributions are tested by using various values for the numerical parameters.


Item Type:Article
Related URLs:
URLURL TypeDescription
http://dx.doi.org/10.1021/j100370a045DOIArticle
http://pubs.acs.org/doi/abs/10.1021/j100370a045PublisherArticle
ORCID:
AuthorORCID
Marcus, R. A.0000-0001-6547-1469
Additional Information:© 1990 American Chemical Society. Received August 15, 1989; In Final Form October 13, 1989. Acknowledgment is made to the Office of Naval Research and to the donors of the Petroleum Research Fund, administered by the American Chemical Society, for the support of this research. R.A. expresses his appreciation to Prof. Horia Metiu for his hospitality and support while he was at the University of California at Santa Barbara.
Funders:
Funding AgencyGrant Number
Office of Naval Research (ONR)UNSPECIFIED
American Chemical Society Petroleum Research FundUNSPECIFIED
Other Numbering System:
Other Numbering System NameOther Numbering System ID
Caltech Noyes Laboratory of Chemical Physics8001
Issue or Number:7
Record Number:CaltechAUTHORS:20150514-152741359
Persistent URL:https://resolver.caltech.edu/CaltechAUTHORS:20150514-152741359
Official Citation:Almeida, R., & Marcus, R. A. (1990). Dynamics of electron transfer for a nonsuperexchange coherent mechanism. 2. Numerical calculations. The Journal of Physical Chemistry, 94(7), 2978-2985. doi: 10.1021/j100370a045
Usage Policy:No commercial reproduction, distribution, display or performance rights in this work are provided.
ID Code:57543
Collection:CaltechAUTHORS
Deposited By: Joanne McCole
Deposited On:14 May 2015 23:27
Last Modified:22 Nov 2019 09:58

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