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The Kinetic Model of n ‐Decane Oxidation in the Presence of Inhibitory Composition
Author(s) -
Tikhonova M. V.,
Garifullina G. G.,
Gerchikov A. Ya.,
Spivak S. I.
Publication year - 2014
Publication title -
international journal of chemical kinetics
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 0.341
H-Index - 68
eISSN - 1097-4601
pISSN - 0538-8066
DOI - 10.1002/kin.20848
Subject(s) - decane , chemistry , inverse , kinetics , composition (language) , kinetic energy , range (aeronautics) , minification , domain (mathematical analysis) , alcohol , order (exchange) , thermodynamics , biological system , organic chemistry , mathematical optimization , mathematics , linguistics , physics , philosophy , materials science , quantum mechanics , composite material , biology , finance , economics , mathematical analysis , geometry
ABSTRACT This article addresses mathematical modeling of the reaction of inhibited organic compounds oxidation. It was proposed to solve the inverse problems of chemical kinetics by using the index method of constrained global minimization of the deviation between the calculated and experimental data. This approach allows us to use more complete information about the chemical process which, in its turn, reduces the range of possible solutions, narrows down the domain of uncertainty, and improves the quality of mathematical model of chemical reactions. The index method was applied to solving inverse kinetic problem for the reaction of n ‐decane oxidation in the presence of a p ‐oxydiphenylamine/n‐decyl alcohol inhibitory composition.