Global controllability of chemical reactions

DOI10.1007/S10910-016-0626-7MaRDI QIDQ298095zbMATHOpenAlexFDO

Authors Dániel A. Drexler, J. Tóth

Publication date 20 June 2016

Published in Journal of Mathematical Chemistry (Search for Journal in Brave)

Full work available at URL https://arxiv.org/abs/1508.03228

zbMATH Keywords

controllabilitychemical reactionskineticsLie-algebra

Mathematics Subject Classification ID

Controllability (93B05) Classical flows, reactions, etc. in chemistry (92E20)

Abstract: Controllability of chemical reactions is an important problem in chemical engineering science. In control theory, analysis of the controllability of linear systems is well-founded, however the dynamics of chemical reactions is usually nonlinear. Global controllability properties of chemical reactions are analyzed here based on the Lie-algebra of the vector fields associated to elementary reactions. A chemical reaction is controllable almost everywhere if all the reaction rate coefficients can be used as control inputs. The problem where one can not control all the reaction rate coefficients is also analyzed. The reaction steps whose reaction rate coefficients need to be control inputs are identified. A general definition of consecutive reactions is given, and it turns out that they are controllable almost everywhere by using the reaction rate coefficient of only one reaction step as control input.

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(6)

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