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JOURNALS // Numerical methods and programming // Archive

Num. Meth. Prog., 2024 Volume 25, Issue 4, Pages 413–426 (Mi vmp1133)

This article is cited in 1 paper

Methods and algorithms of computational mathematics and their applications

Averaging of the model of a chemical process in a catalyst layer with a spherical grain

O. S. Yazovtsevaa, I. M. Gubaydullinbc, I. G. Lapshinc

a Steklov Mathematical Institute of RAS
b Institute of Petrochemistry and Catalysis of RAS
c Ufa State Petroleum Technological University

Abstract: The article presents a comparative analysis of models of a non-stationary chemical process using the example of burning coke sedimentation from a catalyst layer with a spherical grain. The first model is obtained by averaging the heat conductivity equation for a spherical catalyst grain. The second is the averaging of the entire grain model, including the diffusion-reaction equations. The comparative analysis showed good consistency of the results under conditions of low concentrations of reagents, small catalyst grains and high process temperatures with a significant reduction in calculation time for the first model. It was found necessary to take into account intradiffusion inhibition at the case of a high reagent concentrations. It causes the occurrence of a concentration gradient along the radius of the catalyst grain at the initial stages of the process.

Keywords: numerical methods, mathematical modeling, explicit-implicit scheme, the diffusion-reaction equation, unsteady process.

Received: 03.09.2024

DOI: 10.26089/NumMet.v25r431



© Steklov Math. Inst. of RAS, 2025