Congjie Hong , Jiabiao Zou , Yada Leo , Janardhanraj Subburaj , Ayman M. Elbaz , William L. Roberts , Zuohua Huang , Yingjia Zhang , Aamir Farooq
{"title":"富氢高支化异构烷烃层流火焰速度的实验与动力学分析:异辛烷与异十二烷的比较","authors":"Congjie Hong , Jiabiao Zou , Yada Leo , Janardhanraj Subburaj , Ayman M. Elbaz , William L. Roberts , Zuohua Huang , Yingjia Zhang , Aamir Farooq","doi":"10.1016/j.combustflame.2025.114506","DOIUrl":null,"url":null,"abstract":"<div><div>Highly branched alkanes, critical components of sustainable aviation fuels (SAFs), significantly influence the efficiency and emissions of aircraft engines. With the increasing global demand for low-carbon aviation fuels, a deeper understanding of the combustion kinetics of highly branched alkanes is essential for optimizing fuel design and reducing carbon emissions. In this study, the laminar flame speeds of <em>iso</em>-octane (2,2,4-trimethyl pentane), <em>iso</em>-dodecane (2,2,4,6,6-pentamethylheptane; PMH) and their blends with hydrogen were investigated over equivalence ratios ranging 0.7 to 1.4, pressures from 0.5 to 1.0 bar, and temperatures of 353 and 395 K. Results indicate that <em>iso</em>-octane exhibits consistently higher laminar flame speeds than PMH across all equivalence ratios, with a more pronounced difference under lean conditions. Reaction pathway analysis reveals that PMH generates a higher yield of dienes, which consume a substantial amount of H radicals in further reactions, resulting in chain inhibition and a reduction in overall flame propagation. In contrast, <em>iso</em>-octane predominantly produces <em>tert</em>‑butyl and <em>iso</em>-propyl radicals, which further decompose into H and <em>iso</em>-butene/propene, thereby enhancing flame propagation. Hydrogen blending enhances flame speeds for both fuels, with a more pronounced effect on <em>iso</em>-octane. This is mainly due to the increased concentrations of key radicals (H, O, and OH), which accelerate chain reactions. This study presents the first experimental dataset of PMH laminar flame speed, addressing a critical gap for validating chemical kinetic models and enhancing combustion simulations. Additionally, the findings provide valuable insights into the combustion behavior of highly branched alkanes in hydrogen-enriched environments, supporting the development of low-carbon, high-efficiency clean fuels.</div></div>","PeriodicalId":280,"journal":{"name":"Combustion and Flame","volume":"282 ","pages":"Article 114506"},"PeriodicalIF":6.2000,"publicationDate":"2025-09-26","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":"{\"title\":\"Experimental and kinetic analysis of laminar flame speed in hydrogen-enriched highly branched iso-alkanes: A comparison of iso-octane and iso-dodecane\",\"authors\":\"Congjie Hong , Jiabiao Zou , Yada Leo , Janardhanraj Subburaj , Ayman M. Elbaz , William L. Roberts , Zuohua Huang , Yingjia Zhang , Aamir Farooq\",\"doi\":\"10.1016/j.combustflame.2025.114506\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"<div><div>Highly branched alkanes, critical components of sustainable aviation fuels (SAFs), significantly influence the efficiency and emissions of aircraft engines. With the increasing global demand for low-carbon aviation fuels, a deeper understanding of the combustion kinetics of highly branched alkanes is essential for optimizing fuel design and reducing carbon emissions. In this study, the laminar flame speeds of <em>iso</em>-octane (2,2,4-trimethyl pentane), <em>iso</em>-dodecane (2,2,4,6,6-pentamethylheptane; PMH) and their blends with hydrogen were investigated over equivalence ratios ranging 0.7 to 1.4, pressures from 0.5 to 1.0 bar, and temperatures of 353 and 395 K. Results indicate that <em>iso</em>-octane exhibits consistently higher laminar flame speeds than PMH across all equivalence ratios, with a more pronounced difference under lean conditions. Reaction pathway analysis reveals that PMH generates a higher yield of dienes, which consume a substantial amount of H radicals in further reactions, resulting in chain inhibition and a reduction in overall flame propagation. In contrast, <em>iso</em>-octane predominantly produces <em>tert</em>‑butyl and <em>iso</em>-propyl radicals, which further decompose into H and <em>iso</em>-butene/propene, thereby enhancing flame propagation. Hydrogen blending enhances flame speeds for both fuels, with a more pronounced effect on <em>iso</em>-octane. This is mainly due to the increased concentrations of key radicals (H, O, and OH), which accelerate chain reactions. This study presents the first experimental dataset of PMH laminar flame speed, addressing a critical gap for validating chemical kinetic models and enhancing combustion simulations. Additionally, the findings provide valuable insights into the combustion behavior of highly branched alkanes in hydrogen-enriched environments, supporting the development of low-carbon, high-efficiency clean fuels.</div></div>\",\"PeriodicalId\":280,\"journal\":{\"name\":\"Combustion and Flame\",\"volume\":\"282 \",\"pages\":\"Article 114506\"},\"PeriodicalIF\":6.2000,\"publicationDate\":\"2025-09-26\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"0\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Combustion and Flame\",\"FirstCategoryId\":\"5\",\"ListUrlMain\":\"https://www.sciencedirect.com/science/article/pii/S0010218025005437\",\"RegionNum\":2,\"RegionCategory\":\"工程技术\",\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"Q2\",\"JCRName\":\"ENERGY & FUELS\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Combustion and Flame","FirstCategoryId":"5","ListUrlMain":"https://www.sciencedirect.com/science/article/pii/S0010218025005437","RegionNum":2,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q2","JCRName":"ENERGY & FUELS","Score":null,"Total":0}
Experimental and kinetic analysis of laminar flame speed in hydrogen-enriched highly branched iso-alkanes: A comparison of iso-octane and iso-dodecane
Highly branched alkanes, critical components of sustainable aviation fuels (SAFs), significantly influence the efficiency and emissions of aircraft engines. With the increasing global demand for low-carbon aviation fuels, a deeper understanding of the combustion kinetics of highly branched alkanes is essential for optimizing fuel design and reducing carbon emissions. In this study, the laminar flame speeds of iso-octane (2,2,4-trimethyl pentane), iso-dodecane (2,2,4,6,6-pentamethylheptane; PMH) and their blends with hydrogen were investigated over equivalence ratios ranging 0.7 to 1.4, pressures from 0.5 to 1.0 bar, and temperatures of 353 and 395 K. Results indicate that iso-octane exhibits consistently higher laminar flame speeds than PMH across all equivalence ratios, with a more pronounced difference under lean conditions. Reaction pathway analysis reveals that PMH generates a higher yield of dienes, which consume a substantial amount of H radicals in further reactions, resulting in chain inhibition and a reduction in overall flame propagation. In contrast, iso-octane predominantly produces tert‑butyl and iso-propyl radicals, which further decompose into H and iso-butene/propene, thereby enhancing flame propagation. Hydrogen blending enhances flame speeds for both fuels, with a more pronounced effect on iso-octane. This is mainly due to the increased concentrations of key radicals (H, O, and OH), which accelerate chain reactions. This study presents the first experimental dataset of PMH laminar flame speed, addressing a critical gap for validating chemical kinetic models and enhancing combustion simulations. Additionally, the findings provide valuable insights into the combustion behavior of highly branched alkanes in hydrogen-enriched environments, supporting the development of low-carbon, high-efficiency clean fuels.
期刊介绍:
The mission of the journal is to publish high quality work from experimental, theoretical, and computational investigations on the fundamentals of combustion phenomena and closely allied matters. While submissions in all pertinent areas are welcomed, past and recent focus of the journal has been on:
Development and validation of reaction kinetics, reduction of reaction mechanisms and modeling of combustion systems, including:
Conventional, alternative and surrogate fuels;
Pollutants;
Particulate and aerosol formation and abatement;
Heterogeneous processes.
Experimental, theoretical, and computational studies of laminar and turbulent combustion phenomena, including:
Premixed and non-premixed flames;
Ignition and extinction phenomena;
Flame propagation;
Flame structure;
Instabilities and swirl;
Flame spread;
Multi-phase reactants.
Advances in diagnostic and computational methods in combustion, including:
Measurement and simulation of scalar and vector properties;
Novel techniques;
State-of-the art applications.
Fundamental investigations of combustion technologies and systems, including:
Internal combustion engines;
Gas turbines;
Small- and large-scale stationary combustion and power generation;
Catalytic combustion;
Combustion synthesis;
Combustion under extreme conditions;
New concepts.