{"title":"Laminar burning velocity and unburnt temperature: Comparative analysis across a broad temperature range of atmospheric NH3+H2 flames","authors":"Xinlu Han , Alexander A. Konnov","doi":"10.1016/j.combustflame.2025.114117","DOIUrl":null,"url":null,"abstract":"<div><div>Ammonia (NH<sub>3</sub>) emerges as a promising carbon-free fuel, necessitating an understanding of its fundamental combustion properties, particularly the laminar burning velocity (<span><math><msub><mi>S</mi><mi>L</mi></msub></math></span>), at very high unburnt temperatures (<span><math><msub><mi>T</mi><mi>u</mi></msub></math></span>). Despite this need, a consensus on the relationship between <span><math><msub><mi>S</mi><mi>L</mi></msub></math></span> and <span><math><msub><mi>T</mi><mi>u</mi></msub></math></span> across a broad temperature range has not yet been established. This study investigated the <span><math><msub><mi>S</mi><mi>L</mi></msub></math></span> vs. <span><math><msub><mi>T</mi><mi>u</mi></msub></math></span> relationship from 298 K to above 800 K, analyzing both literature data and simulation results for 40%H<sub>2</sub>+60%NH<sub>3</sub>+air flames at 1 atm. Seven kinetic models were used in the simulations, among which the models from Shrestha, Stagni, Han, NUIG, and KAUST accurately reproduced the experimental data within uncertainty limits, making them suitable for investigating <span><math><msub><mi>S</mi><mi>L</mi></msub></math></span> vs. <span><math><msub><mi>T</mi><mi>u</mi></msub></math></span> relationship. The analysis revealed that no tested correlation perfectly captures the <span><math><msub><mi>S</mi><mi>L</mi></msub></math></span> vs. <span><math><msub><mi>T</mi><mi>u</mi></msub></math></span> relationship across the entire temperature range with their originally defined constants, because the overall activation energy of the global one-step reaction is indeed increasing rapidly with <span><math><msub><mi>T</mi><mi>u</mi></msub></math></span>. In addition, the much lower reaction sensitivities of the temperature dependence coefficient than <span><math><msub><mi>S</mi><mi>L</mi></msub></math></span>, along with the same effects of elevated temperature and oxygen enrichment on model validations, were found to be valid for temperatures up to 850 K in these simulations, consistent with those previously identified for <span><math><msub><mi>T</mi><mi>u</mi></msub></math></span> < 500 K conditions. Reaction sensitivities were also calculated for the overall activation energy, which exhibits significantly stronger temperature dependence than <span><math><msub><mi>S</mi><mi>L</mi></msub></math></span>, thus more effective for identifying reactions requiring adjustment for improving predictions across wide unburnt temperature ranges. Based on these findings, a feasible strategy was proposed for future investigation of the laminar burning velocities with broad unburnt temperature range, helping with relevant applications.</div></div>","PeriodicalId":280,"journal":{"name":"Combustion and Flame","volume":"275 ","pages":"Article 114117"},"PeriodicalIF":5.8000,"publicationDate":"2025-03-14","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/S0010218025001555","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}
引用次数: 0
Abstract
Ammonia (NH3) emerges as a promising carbon-free fuel, necessitating an understanding of its fundamental combustion properties, particularly the laminar burning velocity (), at very high unburnt temperatures (). Despite this need, a consensus on the relationship between and across a broad temperature range has not yet been established. This study investigated the vs. relationship from 298 K to above 800 K, analyzing both literature data and simulation results for 40%H2+60%NH3+air flames at 1 atm. Seven kinetic models were used in the simulations, among which the models from Shrestha, Stagni, Han, NUIG, and KAUST accurately reproduced the experimental data within uncertainty limits, making them suitable for investigating vs. relationship. The analysis revealed that no tested correlation perfectly captures the vs. relationship across the entire temperature range with their originally defined constants, because the overall activation energy of the global one-step reaction is indeed increasing rapidly with . In addition, the much lower reaction sensitivities of the temperature dependence coefficient than , along with the same effects of elevated temperature and oxygen enrichment on model validations, were found to be valid for temperatures up to 850 K in these simulations, consistent with those previously identified for < 500 K conditions. Reaction sensitivities were also calculated for the overall activation energy, which exhibits significantly stronger temperature dependence than , thus more effective for identifying reactions requiring adjustment for improving predictions across wide unburnt temperature ranges. Based on these findings, a feasible strategy was proposed for future investigation of the laminar burning velocities with broad unburnt temperature range, helping with relevant applications.
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.