Method of invariant manifold for chemical kinetics

Details Method of invariant manifold for chemical kinetics Method of invariant manifold for chemical kinetics

2002-07-09

arxiv.org/abs/cond-mat/0207231v1

Chemical Engineering Science, Volume 58, Issue 21, November 2003, Pages 4751-4768

Physics

Condensed Matter

Statistical Mechanics

41 pages, 1 figure

Scientific paper

10.1016/j.ces.2002.12.001

In this paper, we review the construction of low-dimensional manifolds of reduced description for equations of chemical kinetics from the standpoint of the method of invariant manifold (MIM). MIM is based on a formulation of the condition of invariance as an equation, and its solution by Newton iterations. A review of existing alternative methods is extended by a thermodynamically consistent version of the method of intrinsic low-dimensional manifolds. A grid-based version of MIM is developed, and model extensions of low-dimensional dynamics are described. Generalizations to open systems are suggested. The set of methods covered makes it possible to effectively reduce description in chemical kinetics.

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