ITERATION SCHEME FOR IMPLICIT CALCULATIONS OF KINETIC AND EQUILIBRIUM CHEMICAL-REACTIONS IN FLUID-DYNAMICS

An iteration scheme for the implicit treatment of equilibrium chemical reactions in partial equilibrium flow has previously been described (J. D. Ramshaw and A. A. Amsden, J. Comput. Phys. 59, 484 (1985); 71, 224 (1987)). Here we generalize this scheme to kinetic reactions as well as equilibrium reactions. This extends the applicability of the scheme to problems with kinetic reactions that are fast in some regions of the flow field but slow in others. The resulting scheme thereby provides a single unified framework for the implicit treatment of an arbitrary number of coupled equilibrium and kinetic reactions in chemically reacting fluid flow. (C) 1995 Academic Press, Inc.