EXPERIMENTAL AND THEORETICAL ESTIMATIONS OF THE SOLVENT INDEPENDENCE OF THE ELECTRONIC COUPLING MATRIX ELEMENT FOR AN ORGANIC HOMOGENEOUS ELECTRON SELF-EXCHANGE REACTION

Authors
Citation
G. Grampp et G. Rauhut, EXPERIMENTAL AND THEORETICAL ESTIMATIONS OF THE SOLVENT INDEPENDENCE OF THE ELECTRONIC COUPLING MATRIX ELEMENT FOR AN ORGANIC HOMOGENEOUS ELECTRON SELF-EXCHANGE REACTION, Journal of physical chemistry, 99(7), 1995, pp. 1815-1817
Citations number
17
Categorie Soggetti
Chemistry Physical
ISSN journal
00223654
Volume
99
Issue
7
Year of publication
1995
Pages
1815 - 1817
Database
ISI
SICI code
0022-3654(1995)99:7<1815:EATEOT>2.0.ZU;2-4
Abstract
The solvent dependence of the electronic coupling matrix element V wit hin electron transfer theory has been investigated for the homogeneous electron self-exchange reaction of the 1,4-diaminobenzene/1,4-diamino benzene radical cation couple. Experimental results from both ESR line broadening effects and semi-empirical MO calculations within the fram ework of self-consistent reaction field theory show that V is solvent- independent.