Combustion Enhancement of Ammonia by Cofiring Oxymethylene Ethers (OMEn, n = 0–2): An Experimental and Kinetic Modeling Investigation

IF 5.2 3区 工程技术 Q2 ENERGY & FUELS Energy & Fuels Pub Date : 2024-11-04 DOI:10.1021/acs.energyfuels.4c0382710.1021/acs.energyfuels.4c03827
Bilal Hussain, Jun Fang, Jianguo Zhang, Wei Li* and Yuyang Li*, 
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Abstract

Ammonia (NH3) is a promising zero-carbon fuel with an exceptionally high hydrogen density. However, the feasibility of employing ammonia as a future fuel faces several obstacles including low combustion intensity. Co-firing reactive carbon-neutral fuels, such as oxymethylene ethers (OMEn) with NH3 emerges as an effective approach to enhance NH3 combustion. This work investigates the laminar flame propagation of NH3 cofired with dimethyl ether (DME), dimethoxymethane (OME1), and methoxy(methoxymethoxy)methane (OME2) using a high-pressure high-temperature constant-volume combustion vessel. Laminar burning velocities (LBVs) are measured at an initial temperature of 423 K and pressures of 1–10 atm. A kinetic model for NH3/OMEn combustion is developed and validated against the measured LBVs in this study, as well as LBVs and speciation data in literature. Both the experimental and kinetic modeling studies indicate the positive effect of cofiring of OMEn on ammonia combustion enhancement. The LBV levels of the NH3/OMEn mixture can be similar to that of methane. The effects of cofiring fuel compositions, equivalence ratios, and pressures are investigated using modeling analysis and the modified fictitious diluent gas method. In mixture combustion, the reaction pathways of ammonia, DME, OME1, and OME2 remain almost unchanged compared to single fuel combustion, despite the slight contribution of C–N interaction. Combustion enhancements result from both chemical effects and thermal effects and their contribution ratios vary according to equivalence ratios and fuel compositions. At ϕ = 1.6, the contribution of chemical effects increases in the order 50%NH3/50%DME, 50%NH3/50%OME1, and 50%NH3/50%OME2. Though there are similar LBVs for DME, OME1, and OME2, the mixture LBVs follow the sequence of 50%NH3/50%DME < 50%NH3/50%OME1 < 50%NH3/50%OME2, which can be attributed to the influence of their lower heating values. A quasi-square relationship between normalized LBVs and energy fraction can be derived by using the correction of the energy fraction for the three NH3/OMEn mixtures.

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氧亚甲基醚(OMEn,n = 0-2)协同燃烧增强氨的燃烧:实验和动力学模型研究
氨(NH3)具有极高的氢密度,是一种前景广阔的零碳燃料。然而,将氨作为未来燃料的可行性面临着一些障碍,包括燃烧强度低。将活性碳中性燃料,如氧亚甲基醚(OMEn)与 NH3 共同燃烧,是增强 NH3 燃烧的有效方法。本研究利用高压高温恒容燃烧容器,研究了 NH3 与二甲醚(DME)、二甲氧基甲烷(OME1)和甲氧基(甲氧基甲氧基)甲烷(OME2)共燃时的层状火焰传播。在初始温度为 423 K 和压力为 1-10 atm 时测量了层燃速度 (LBV)。我们建立了一个 NH3/OMEn 燃烧动力学模型,并根据本研究中测得的层燃速度以及文献中的层燃速度和标本数据进行了验证。实验和动力学模型研究都表明,OMEn 的协同燃烧对氨气燃烧有积极的促进作用。NH3/OMEn 混合物的 LBV 水平与甲烷相似。利用建模分析和改进的虚构稀释气体法研究了共燃燃料成分、等效比和压力的影响。与单一燃料燃烧相比,在混合燃烧中,氨、二甲醚、OME1 和 OME2 的反应途径几乎保持不变,尽管 C-N 相互作用有轻微影响。燃烧增强既来自化学效应,也来自热效应,它们的贡献比例因等效比和燃料成分而异。当 ϕ = 1.6 时,化学效应的贡献率依次为 50%NH3/50%DME, 50%NH3/50%OME1 和 50%NH3/50%OME2 。虽然二甲醚、OME1 和 OME2 的 LBV 值相似,但混合物的 LBV 值却依次为 50%NH3/50%DME < 50%NH3/50%OME1 < 50%NH3/50%OME2 ,这可能是由于它们的加热值较低的影响。通过对三种 NH3/OMEn 混合物的能量分数进行修正,可以得出归一化 LBV 与能量分数之间的准平方关系。
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来源期刊
Energy & Fuels
Energy & Fuels 工程技术-工程:化工
CiteScore
9.20
自引率
13.20%
发文量
1101
审稿时长
2.1 months
期刊介绍: Energy & Fuels publishes reports of research in the technical area defined by the intersection of the disciplines of chemistry and chemical engineering and the application domain of non-nuclear energy and fuels. This includes research directed at the formation of, exploration for, and production of fossil fuels and biomass; the properties and structure or molecular composition of both raw fuels and refined products; the chemistry involved in the processing and utilization of fuels; fuel cells and their applications; and the analytical and instrumental techniques used in investigations of the foregoing areas.
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