流动反应器中自振荡催化反应的数学建模

IF 16.4 1区 化学 Q1 CHEMISTRY, MULTIDISCIPLINARY Accounts of Chemical Research Pub Date : 2024-05-09 DOI:10.1134/S0023158423601237
N. V. Peskov, M. M. Slinko
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摘要

摘要 本文致力于分析常压下金属表面催化氧化反应过程中可能出现的时空动力学结构。使用反应-扩散-对流类型的一维方程系统对流动反应器中的催化振荡反应进行建模。催化氧化的 STM 型振荡反应模型被用作动力学模型。数学建模的结果表明,反应器中的轴向混合对时空结构的发展具有决定性影响。研究还表明,根据反应物的吸附速率比,可以产生三种不同的等温时空结构,即空间不均匀静止状态、规则和非周期性 "呼吸结构"。
本文章由计算机程序翻译,如有差异,请以英文原文为准。

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Mathematical Modeling of a Self-Oscillating Catalytic Reaction in a Flow Reactor

The article is devoted to the analysis of possible spatiotemporal kinetic structures that can arise during catalytic oxidation reactions on metal surfaces at atmospheric pressure. The catalytic oscillatory reaction in a flow reactor is modeled using a 1D system of equations of the reaction–diffusion–convection type. The STM type oscillatory reaction model of catalytic oxidation is used as a kinetic model. The obtained results of mathematical modeling show the decisive influence of an axial mixing in the reactor on the development of spatiotemporal structures. It is also shown that, depending on the ratio of adsorption rates of reacting species, three different isothermal spatiotemporal structures can arise, namely a spatially inhomogeneous stationary state, regular and aperiodic “breathing structures”.

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来源期刊
Accounts of Chemical Research
Accounts of Chemical Research 化学-化学综合
CiteScore
31.40
自引率
1.10%
发文量
312
审稿时长
2 months
期刊介绍: Accounts of Chemical Research presents short, concise and critical articles offering easy-to-read overviews of basic research and applications in all areas of chemistry and biochemistry. These short reviews focus on research from the author’s own laboratory and are designed to teach the reader about a research project. In addition, Accounts of Chemical Research publishes commentaries that give an informed opinion on a current research problem. Special Issues online are devoted to a single topic of unusual activity and significance. Accounts of Chemical Research replaces the traditional article abstract with an article "Conspectus." These entries synopsize the research affording the reader a closer look at the content and significance of an article. Through this provision of a more detailed description of the article contents, the Conspectus enhances the article's discoverability by search engines and the exposure for the research.
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