Geodesic
Parallelization technology for solving multiparameter inverse problems of chemical kinetics
Numerical methods and programming, Tome 13 (2012) no. 1, pp. 28-36

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A united information-analytic system (IAS) for solving inverse problems of chemical kinetics on the basis of parallel computing technology is developed. This system is implemented to construct kinetic models for industry-significant reactions of metal-complex catalysis. The following results are obtained: the dependence of the induction period of olefin hydroalumination reactions on the catalyst is quantitatively estimated and the reactivity of olefin and acetylene compounds in olefin cycloalumination reaction is evaluated; the optimal temperature and the initial reagent ratio for olefin cycloalumination reactions to ensure the maximum product yield ate determined.
Keywords: hydroalumination; cycloalumination; parallelization; information-analytic system; internal parallelism; multiparameter problems; full-scale experiment. 
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     author = {I. M. Gubaydullin and Yu. B. Lind and K. F. Koledina},
     title = {Parallelization technology for solving multiparameter inverse problems of chemical kinetics},
     journal = {Numerical methods and programming},
     pages = {28--36},
     publisher = {mathdoc},
     volume = {13},
     number = {1},
     year = {2012},
     language = {ru},
     url = {http://geodesic.mathdoc.fr/item/VMP_2012_13_1_a35/}
}
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I. M. Gubaydullin; Yu. B. Lind; K. F. Koledina. Parallelization technology for solving multiparameter inverse problems of chemical kinetics. Numerical methods and programming, Tome 13 (2012) no. 1, pp. 28-36. http://geodesic.mathdoc.fr/item/VMP_2012_13_1_a35/