{"title":"Features of the Inhibition of Hydrogen-Air Mixtures by Propylene Additive","authors":"A. A. Belyaev, B. S. Ermolaev","doi":"10.1134/S1990793124700532","DOIUrl":null,"url":null,"abstract":"<p>Small additions of hydrocarbons, such as propylene, which are widely studied as combustion and explosion inhibitors of hydrogen-air mixtures, sometimes exhibit specific properties. The known mechanism of the inhibitory effect of these additives is associated with the intensification of the termination of branching chains due to the addition of hydrogen atoms; however, conditions also exist in which these compounds, instead of inhibiting, have a neutral and even promoting effect. Such conditions and the reasons leading to the fact that inhibition is practically absent have not yet been studied. This article shows the results of numerical modeling, which make it possible to more fully outline the range of conditions where the addition of propylene practically does not inhibit hydrogen-air mixtures and outline possible reasons for this effect. The solution to three model problems is presented: self-ignition in a constant-volume reactor, laminar flame propagation, and gas ignition with a heated wire. The calculations are carried out with the detailed kinetic mechanism of chemical reactions NUIGMech 1.1 (2020). The objects of the study are three air mixtures containing hydrogen in amounts of 15, 29.6, and 50 vol % (lean, stoichiometric, and rich mixtures, respectively) without additives and with the addition of 1% propylene.</p>","PeriodicalId":768,"journal":{"name":"Russian Journal of Physical Chemistry B","volume":null,"pages":null},"PeriodicalIF":1.4000,"publicationDate":"2024-09-11","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":null,"platform":"Semanticscholar","paperid":null,"PeriodicalName":"Russian Journal of Physical Chemistry B","FirstCategoryId":"92","ListUrlMain":"https://link.springer.com/article/10.1134/S1990793124700532","RegionNum":4,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q4","JCRName":"PHYSICS, ATOMIC, MOLECULAR & CHEMICAL","Score":null,"Total":0}
引用次数: 0
Abstract
Small additions of hydrocarbons, such as propylene, which are widely studied as combustion and explosion inhibitors of hydrogen-air mixtures, sometimes exhibit specific properties. The known mechanism of the inhibitory effect of these additives is associated with the intensification of the termination of branching chains due to the addition of hydrogen atoms; however, conditions also exist in which these compounds, instead of inhibiting, have a neutral and even promoting effect. Such conditions and the reasons leading to the fact that inhibition is practically absent have not yet been studied. This article shows the results of numerical modeling, which make it possible to more fully outline the range of conditions where the addition of propylene practically does not inhibit hydrogen-air mixtures and outline possible reasons for this effect. The solution to three model problems is presented: self-ignition in a constant-volume reactor, laminar flame propagation, and gas ignition with a heated wire. The calculations are carried out with the detailed kinetic mechanism of chemical reactions NUIGMech 1.1 (2020). The objects of the study are three air mixtures containing hydrogen in amounts of 15, 29.6, and 50 vol % (lean, stoichiometric, and rich mixtures, respectively) without additives and with the addition of 1% propylene.
期刊介绍:
Russian Journal of Physical Chemistry B: Focus on Physics is a journal that publishes studies in the following areas: elementary physical and chemical processes; structure of chemical compounds, reactivity, effect of external field and environment on chemical transformations; molecular dynamics and molecular organization; dynamics and kinetics of photoand radiation-induced processes; mechanism of chemical reactions in gas and condensed phases and at interfaces; chain and thermal processes of ignition, combustion and detonation in gases, two-phase and condensed systems; shock waves; new physical methods of examining chemical reactions; and biological processes in chemical physics.