Time-dependent Stokes shift and its calculation from solvent dielectric dispersion data

被引:106
作者
Hsu, CP [1 ]
Song, XY [1 ]
Marcus, RA [1 ]
机构
[1] CALTECH, ARTHUR AMOS NOYES LAB CHEM PHYS, PASADENA, CA 91125 USA
关键词
D O I
10.1021/jp9630885
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
The time-dependent solvation correlation function (the Stokes shift response function), which describes the solvent response to a sudden change in the charge distribution of a solute molecule, is calculated here directly from experimentally measured dielectric dispersion data, epsilon(omega), of the solvent. In the calculation a reaction field with the dielectric continuum assumption is used. This simple model is applied to the experimental results of Jimenez et al. for photoexcited coumarin and water as a solvent, and encouraging agreement is obtained using the experimental data on epsilon(omega).
引用
收藏
页码:2546 / 2551
页数:6
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