{"title":"循环醚在燃烧中的化学动力学","authors":"Luc-Sy Tran , Olivier Herbinet , Hans-Heinrich Carstensen , Frédérique Battin-Leclerc","doi":"10.1016/j.pecs.2022.101019","DOIUrl":null,"url":null,"abstract":"<div><p><span>Cyclic Ethers (CEs) belong to a class of compounds of importance to understand the chemistry of both the engine auto-ignition of hydrocarbon fuels and the combustion of oxygenated biofuels. This article, divided in six parts, aims at systematically analyzing how up-to-date experimental and theoretical methods were applied to unveil the gas-phase oxidation chemistry of these compounds</span><em>.</em><span><span> The first part gives a brief overview on the significance of CEs as intermediates formed during alkane low-temperature oxidation summarizing its generally accepted chemical mechanism. This part also addresses the role of CEs as potential biofuels derived from lignocellulosic biomass<span> and discusses the production methods of these molecules and their combustion performances in engine. The second part presents the different theoretical methods dedicated to calculate the electronic structure, thermochemical and kinetic data of CEs. The third part introduces the experimental methods used in studies related to CEs with a special focus on mass spectrometry and </span></span>gas chromatography<span>. The fourth part reviews the experimental and modeling studies related to CE formation during the low-temperature oxidation of linear, branched, cyclic alkanes, alkylbenzenes, olefins, and oxygenated fuels. The fifth part analyses the published work concerning the CE degradation chemistry and highlights the dominant involved reactions. To finish, the sixth part concludes and proposes future research directions.</span></span></p></div>","PeriodicalId":410,"journal":{"name":"Progress in Energy and Combustion Science","volume":null,"pages":null},"PeriodicalIF":32.0000,"publicationDate":"2022-09-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"12","resultStr":"{\"title\":\"Chemical kinetics of cyclic ethers in combustion\",\"authors\":\"Luc-Sy Tran , Olivier Herbinet , Hans-Heinrich Carstensen , Frédérique Battin-Leclerc\",\"doi\":\"10.1016/j.pecs.2022.101019\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"<div><p><span>Cyclic Ethers (CEs) belong to a class of compounds of importance to understand the chemistry of both the engine auto-ignition of hydrocarbon fuels and the combustion of oxygenated biofuels. This article, divided in six parts, aims at systematically analyzing how up-to-date experimental and theoretical methods were applied to unveil the gas-phase oxidation chemistry of these compounds</span><em>.</em><span><span> The first part gives a brief overview on the significance of CEs as intermediates formed during alkane low-temperature oxidation summarizing its generally accepted chemical mechanism. This part also addresses the role of CEs as potential biofuels derived from lignocellulosic biomass<span> and discusses the production methods of these molecules and their combustion performances in engine. The second part presents the different theoretical methods dedicated to calculate the electronic structure, thermochemical and kinetic data of CEs. The third part introduces the experimental methods used in studies related to CEs with a special focus on mass spectrometry and </span></span>gas chromatography<span>. The fourth part reviews the experimental and modeling studies related to CE formation during the low-temperature oxidation of linear, branched, cyclic alkanes, alkylbenzenes, olefins, and oxygenated fuels. The fifth part analyses the published work concerning the CE degradation chemistry and highlights the dominant involved reactions. To finish, the sixth part concludes and proposes future research directions.</span></span></p></div>\",\"PeriodicalId\":410,\"journal\":{\"name\":\"Progress in Energy and Combustion Science\",\"volume\":null,\"pages\":null},\"PeriodicalIF\":32.0000,\"publicationDate\":\"2022-09-01\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"12\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Progress in Energy and Combustion Science\",\"FirstCategoryId\":\"5\",\"ListUrlMain\":\"https://www.sciencedirect.com/science/article/pii/S0360128522000284\",\"RegionNum\":1,\"RegionCategory\":\"工程技术\",\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"Q1\",\"JCRName\":\"ENERGY & FUELS\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Progress in Energy and Combustion Science","FirstCategoryId":"5","ListUrlMain":"https://www.sciencedirect.com/science/article/pii/S0360128522000284","RegionNum":1,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q1","JCRName":"ENERGY & FUELS","Score":null,"Total":0}
Cyclic Ethers (CEs) belong to a class of compounds of importance to understand the chemistry of both the engine auto-ignition of hydrocarbon fuels and the combustion of oxygenated biofuels. This article, divided in six parts, aims at systematically analyzing how up-to-date experimental and theoretical methods were applied to unveil the gas-phase oxidation chemistry of these compounds. The first part gives a brief overview on the significance of CEs as intermediates formed during alkane low-temperature oxidation summarizing its generally accepted chemical mechanism. This part also addresses the role of CEs as potential biofuels derived from lignocellulosic biomass and discusses the production methods of these molecules and their combustion performances in engine. The second part presents the different theoretical methods dedicated to calculate the electronic structure, thermochemical and kinetic data of CEs. The third part introduces the experimental methods used in studies related to CEs with a special focus on mass spectrometry and gas chromatography. The fourth part reviews the experimental and modeling studies related to CE formation during the low-temperature oxidation of linear, branched, cyclic alkanes, alkylbenzenes, olefins, and oxygenated fuels. The fifth part analyses the published work concerning the CE degradation chemistry and highlights the dominant involved reactions. To finish, the sixth part concludes and proposes future research directions.
期刊介绍:
Progress in Energy and Combustion Science (PECS) publishes review articles covering all aspects of energy and combustion science. These articles offer a comprehensive, in-depth overview, evaluation, and discussion of specific topics. Given the importance of climate change and energy conservation, efficient combustion of fossil fuels and the development of sustainable energy systems are emphasized. Environmental protection requires limiting pollutants, including greenhouse gases, emitted from combustion and other energy-intensive systems. Additionally, combustion plays a vital role in process technology and materials science.
PECS features articles authored by internationally recognized experts in combustion, flames, fuel science and technology, and sustainable energy solutions. Each volume includes specially commissioned review articles providing orderly and concise surveys and scientific discussions on various aspects of combustion and energy. While not overly lengthy, these articles allow authors to thoroughly and comprehensively explore their subjects. They serve as valuable resources for researchers seeking knowledge beyond their own fields and for students and engineers in government and industrial research seeking comprehensive reviews and practical solutions.