An experimental and modeling study on the laminar burning velocities of ammonia + oxygen + argon mixtures

IF 5.8 2区 工程技术 Q2 ENERGY & FUELS Combustion and Flame Pub Date : 2023-09-01 DOI:10.1016/j.combustflame.2023.112930
Jundie Chen, Marco Lubrano Lavadera , Alexander A. Konnov
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Abstract

Most often, the laminar burning velocity (SL) of ammonia was measured in mixtures diluted by nitrogen bearing in mind its potential use as an alternative carbon-free fuel. Replacing the diluent with argon can increase the flame temperature and thus provide additional targets for validating pertinent detailed kinetic models. The SL data for ammonia + oxygen + argon mixtures are scarce; therefore, in the present study, new measurements have been performed using the heat flux method at an initial temperature of 298 K and atmospheric pressure over an equivalence ratio range of 0.4–1.5. The argon mole percentage in the mixture has been changed from 30 to 60%. Nine recent ammonia kinetic models are selected and validated against these new experimental data, where it is found that the models by Han et al. (Combust. Flame 228 (2021):13), Shrestha et al. (Proc. Combust. Inst. 38 (2021):2163), and Okafor et al. (Combust. Flame 204 (2019):162) provide the best predictions. Further sensitivity analysis showed that the most crucial nitrogen-related reactions for SL in present flames found in the model of Shrestha et al. are different from the other two, and flux analysis elucidated that the main consumption fluxes of NH2 radical are different among the three models. The model of Han et al., which is from the authors’ group, was revisited, and the rate constants for three reactions NH2+H(+M)=NH3(+M), NNH+ONH+NO, and NH2+OHNO+H were modified. Available speciation data from shock tube and flame studies are used to select the most suitable rate constants among expressions recommended in the literature. The updated model performs well in reproducing a range of SL, ignition delay times, and speciation data from a jet-stirred reactor for ammonia + oxygen + argon mixtures.

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氨+氧+氩混合气层流燃烧速度的实验与模型研究
大多数情况下,氨的层流燃烧速度(SL)是在用氮稀释的混合物中测量的,考虑到氨作为一种替代无碳燃料的潜在用途。用氩气代替稀释剂可以提高火焰温度,从而为验证相关的详细动力学模型提供了额外的目标。氨+氧+氩混合物的SL数据很少;因此,在本研究中,在初始温度为298 K,大气压为0.4-1.5的等效比范围内,使用热流密度法进行了新的测量。混合物中氩的摩尔百分率由30%提高到60%。选择了9个最近的氨动力学模型,并对这些新的实验数据进行了验证,其中发现Han等人的模型(燃烧。火焰228 (2021):13),Shrestha等人(过程燃烧。Inst. 38(2021):2163)和Okafor等人(燃烧。火焰204(2019):162)提供了最好的预测。进一步的敏感性分析表明,Shrestha等人的模型中目前火焰中SL最关键的氮相关反应与其他两种不同,通量分析表明三种模型中NH2自由基的主要消耗通量不同。对作者组Han等人的模型进行了修正,修正了NH2+H(+M)=NH3(+M)、NNH+ONH+NO和NH2+OHNO+H三个反应的速率常数。从激波管和火焰研究中获得的物种形成数据用于在文献中推荐的表达式中选择最合适的速率常数。更新后的模型能够很好地再现氨+氧+氩混合物的喷搅拌反应器的SL、点火延迟时间和形态数据。
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来源期刊
Combustion and Flame
Combustion and Flame 工程技术-工程:化工
CiteScore
9.50
自引率
20.50%
发文量
631
审稿时长
3.8 months
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.
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