Master equation methods in gas phase chemical kinetics

被引：376

作者：

Miller, James A. ^{[1
]}

Klippenstein, Stephen J.

机构：

[1] Sandia Natl Labs, Combust Res Facil, Livermore, CA 94551 USA

[2] Argonne Natl Lab, Div Chem, Argonne, IL 60439 USA

来源：

JOURNAL OF PHYSICAL CHEMISTRY A | 2006年 / 110卷 / 36期

关键词：

D O I：

10.1021/jp062693x

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：

In this article, we discuss the application of master equation methods to problems in gas phase chemical kinetics. The focus is on reactions that take place over multiple, interconnected potential wells and on the dissociation of weakly bound free radicals. These problems are of paramount importance in combustion chemistry. To illustrate specific points, we draw on our experience with reactions we have studied previously.

引用

页码：10528 / 10544

页数：17

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