Numerical identification of selected rate constants in large chemical reaction systems

DOI10.1016/0168-9274(85)90028-5zbMath0551.65051OpenAlexW2035141712MaRDI QIDQ800696

Peter Deuflhard, Ulrich Nowak

Publication date: 1985

Published in: Applied Numerical Mathematics (Search for Journal in Brave)

Full work available at URL: https://doi.org/10.1016/0168-9274(85)90028-5

zbMATH Keywords

parameter identificationstiff systemsrate coefficientchemical mass action kineticslarge chemical reaction systemsrealistic large scale problems

Mathematics Subject Classification ID

Numerical methods for initial value problems involving ordinary differential equations (65L05) Chemical kinetics in thermodynamics and heat transfer (80A30) Inverse problems involving ordinary differential equations (34A55)

Related Items (6)

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Uses Software

• Larkin

Cites Work

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• A semi-implicit mid-point rule for stiff systems of ordinary differential equations
• A stepsize control for continuation methods and its special application to multiple shooting techniques
• On rank-deficient pseudoinverses
• Handbook series linear algebra. Linear least squares solutions by Householder transformations
• A Program for Fitting Rate Constants in Gas Phase Chemical Kinetics Models
• Recent Progress in Extrapolation Methods for Ordinary Differential Equations

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