The Kramers approach to solving a problem in diffusion with a sink

Citation
Am. Berezhkovskii et Vy. Zitserman, The Kramers approach to solving a problem in diffusion with a sink, CHEM PHYS R, 17(5), 1998, pp. 971-986
Citations number
18
Categorie Soggetti
Physical Chemistry/Chemical Physics
Journal title
CHEMICAL PHYSICS REPORTS
ISSN journal
10741550 → ACNP
Volume
17
Issue
5
Year of publication
1998
Pages
971 - 986
Database
ISI
SICI code
1074-1550(1998)17:5<971:TKATSA>2.0.ZU;2-4
Abstract
A new method is proposed for calculating rate constants for liquid-phase re actions governed by a diffusion equation with a sink. Mathematically, the m ethod consists in the generalized Kramers approach to calculating the proce ss of high-barrier surmounting and applies when the reagents arrive in the reaction zone by the activation mechanism. For two typical cases of S-shape d and delocalized steeply growing sinks, simple mathematical manipulation y ields expressions for the distribution function and the rate constant. The derived expressions are valid over a wide range of values of the parameters and apply at an arbitrary ratio of the rates of diffusion-controlled relax ation and chemical conversion. The models considered adequately describe a great many processes, namely, charge transfer reactions, overbarrier transi tions during slow relaxation of the medium, biochemical reactions of ligand binding, etc.