Published March 1, 1981 | Version v1
Journal article

Solving the stiff ODE's of the kinetics of chemically reacting gas flow

  • 1. Lawrence Berkeley Laboratory, University of California, Berkeley, California 94720

Description

We study the efficiency of computational methods for the stiff ordinary differential equations of chemical kinetics that arise when the partial differential equations of chemically reacting gas flow are treated by a fractional step technique. In this application, the overhead work associated with evaluating partial derivatives and decomposing matrices for the Newton-like corrector iterations used in most algorithms for stiff ODE's can be eliminated for the most part by keeping in store a small number of suitable chosen copies of the Jacobian matrix, reduced to Hessenberg form to facilitate changes of stepsize and order. Computational results in the case of ignition and propagation of one-dimensional, premixed laminar flame with different realistic chemical kinetic models are presented to show the reduction of computational work obtained by modifying a modern general-purpose ODE-code in this manner

Additional details

Publishing Information

Journal Title
J. Comput. Phys.
Journal Volume
39
Journal Issue
3
Series
J. Comput. Phys.
Journal Page Range
167-182
ISSN
0021-9991

INIS

Country of Publication
United States
Country of Input or Organization
United States
INIS RN
12630534
Subject category
S75: CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND SUPERFLUIDITY;
Descriptors DEI
ALGORITHMS; CHEMICAL REACTION KINETICS; DIFFERENTIAL EQUATIONS; FLAMES; GAS FLOW; NUMERICAL SOLUTION; ONE-DIMENSIONAL CALCULATIONS
Descriptors DEC
EQUATIONS; FLUID FLOW; KINETICS; REACTION KINETICS