Numerical identification of selected rate constants in large chemical reaction systems

DOI10.1016/0168-9274(85)90028-5MaRDI QIDQ800696zbMATH OpenOpenAlexFDO

Authors Ulrich Nowak, Peter Deuflhard

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

chemical mass action kineticslarge chemical reaction systemsparameter identificationrate coefficientrealistic large scale problemsstiff systems

Mathematics Subject Classification ID

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

Review text

Significant progress in the development of user-oriented software for parameter identification in large chemical reaction systems is reported. The progress includes new theoretical ideas and an increased domain of applicability of the codes. The solution of several realistic large scale problems is demonstrated.

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Cites work

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Cited in

(9)

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• A quadrature technique for reaction rate identification

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Uses Software

• Larkin

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