The numerical algorithm the refine of the mechanism of chemical reactions by the DRGEP method
E. V. Stepashina1, S. A. Mustafina2
Annotation | In this paper the numerical algorithm the refine of the mechanism of chemical reactions based on the DREGEP method was designed. A computer experiment for the process of obtaining phthalic anhydride is conducted. Obtained reduced mechanism of reaction scheme. |
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Keywords | graph of the reaction, mechanism of the reaction, refinement of reaction scheme. |
1Graduate student of mathematical modeling, Sterlitamak State Pedagogical Academy, Sterlitamak; zhenja05@rambler.ru.
2Head of Mathematical Modelling Chair, Sterlitamak State Pedagogical Academy, Sterlitamak.
Citation: E. V. Stepashina, S. A. Mustafina, "[The numerical algorithm the refine of the mechanism of chemical reactions by the DRGEP method]", Zhurnal Srednevolzhskogo matematicheskogo obshchestva,13:3 (2011) 118–121 (In Russian)