Experimental and kinetic study on the laminar burning velocity of TRF/NH3-air premixed flame at elevated pressure

• Published in: Fuel (Guildford) Vol. 366; p. 131256
• Main Authors: Liu, Zechang, He, Xu, Feng, Guangyuan, Zhao, Chengyuan, Zhou, Xiaoran, Wang, Zhi, Chen, Qingchu
• Format: Journal Article
• Language: English
• Published: Elsevier Ltd 15.06.2024
• Subjects: Flame chemistry; Kinetic model; Laminar burning velocity; TRF/NH3; Kinetic model; Flame chemistry; TRF/NH3; Laminar burning velocity
• ISSN: 0016-2361
• DOI: 10.1016/j.fuel.2024.131256

•The SL of TRF/NH3 mixtures at elevated pressures was measured.•A new mechanism for TRF/NH3 mixtures was proposed.•The effect of ammonia addition on chemical kinetic of TRF/NH3 mixtures was analyzed.•The mole fraction of NO for TRF/NH3 mixtures was analyzed. The application of NH3 to transportation is a practical measure to drive the automotive industry towards a more environmentally friendly and sustainable future. Thus, this study focuses on an experimental and modeling study of the laminar burning velocity (SL) of ternary reference fuel/ammonia (TRF/NH3) mixtures under specific operating conditions. TRF blend was meticulously formulated with a specific volumetric composition, comprising 17 vol% n-heptane (nC7H16), 69 vol% iso-octane (iC8H18), and 14 vol% toluene (C7H8). The laminar burning velocity (SL) of TRF/NH3 mixtures was measured using the constant-volume method, with an initial temperature (Ti) of 400 K, initial pressures (P) from 1 atm to 3 atm, equivalence ratio (ϕ), ranging from 0.8 to 1.3, and ammonia (NH3) mole fraction (XNH3) from 0 % to 70 %. By integrating TRF model developed by Cai and Pitsch [42] and NH3 model by Zhang et al. [26], a kinetics model for TRF/NH3 mixtures was constructed. Subsequently, the model was extensively validated for iC8H18/NH3, nC7H16/NH3, and TRF/NH3 mixtures, focusing on SL, ignition delay time (IDT), and stable species concentrations. Subsequently, employing sensitivity analysis combined with reaction pathway, the impact of NH3 addition on TRF mixture was investigated. The results indicate that the addition of NH3 competes with TRF for OH radicals, leading to a reduction in the proportion of most initial oxidation reaction pathways of TRF. Simultaneously, in TRF/NH3 blend, the oxidation of NH3 precedes that of TRF and has a longer oxidation duration. NH2 radicals generated during the initial oxidation of NH3 can become integrated into the H-abstraction oxidation of TRF. Additionally, radicals produced during TRF oxidation can enhance the oxidation of NH3, particularly in the later stages of combustion. Finally, the effect of initial pressure on the mole fraction of NO in TRF/NH3 flames is analyzed. For TRF/NH3 mixture, an increase in initial pressure results in a reduction in the concentration of NO. The concentration of NO decreases with the increase of initial pressure mainly because (1) the concentration of OH radicals in the flame is abundant and (2) the concentration of OH radicals decreases with the increase of initial pressure. Additionally, this study found that a high equivalence ratio and high pressure can effectively reduce the increase of NO concentration caused by the addition of NH3.