Suppression Mechanisms of Ferrocene on Methane–Hydrogen Explosion Propagation in Pipe: An Integrated Study of Experiments and Chemical Reaction Kinetics

IF 3.4
Journal of chemical health & safety Pub Date : 2026-05-25 Epub Date: 2026-04-15 DOI:10.1021/acs.chas.6c00023
Shuo Wang*, , , Qin He, , , Hongfu Mi*, , , Yulong Duan, , , Sen He, , , Yanling Yang, , , Peng Shao, , , Guoqing Xiao, , and , Jinjun Yang, 
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Abstract

This study investigates the performance and mechanism of ferrocene in suppressing the propagation of methane–hydrogen explosions through experiments and chemical kinetic simulations. The experimental results demonstrate that ferrocene can decrease the flame speed and attenuate the explosion pressure by inhibiting the mutual excitation between the flame and the premixed zone. Specifically, the addition of ferrocene at concentrations of 0.1 g·L–1, 0.2 g·L–1, and 0.3 g·L–1 increased the flame propagation time by 93.02%, 323.26%, and 597.67%, respectively, and decreased the maximum explosion pressure by 68.03%, 81.56%, and 95.49%. Kinetic modeling reveals that the decomposition products of ferrocene, FeC5H5, Fe, and FeO can consume key radicals, such as H, O, and OH in the explosion chain reactions, leading to a significant reduction in the concentrations of the active component and the effective combination. Moreover, the catalytic cyclic reactions of Fe-containing species continuously consume H and O, which diminish the promotional effect of various radical reactions on the temperature and flame speed of the explosion system. The findings provide theoretical support for protecting and suppressing methane–hydrogen explosions at the microscopic level.

二茂铁抑制管道内甲烷-氢爆炸传播的机理:实验与化学反应动力学的综合研究
通过实验和化学动力学模拟研究了二茂铁抑制甲烷氢爆炸传播的性能和机理。实验结果表明,二茂铁通过抑制火焰与预混区之间的相互激发,降低了火焰速度,减弱了爆炸压力。其中,添加浓度为0.1 g·L-1、0.2 g·L-1和0.3 g·L-1的二茂铁使火焰传播时间分别延长了93.02%、323.26%和597.67%,最大爆炸压力分别降低了68.03%、81.56%和95.49%。动力学建模表明,二茂铁、FeC5H5、Fe和FeO的分解产物在爆炸链式反应中能够消耗关键自由基H、O、OH,导致活性组分浓度和有效组合显著降低。此外,含铁物质的催化循环反应不断消耗H和O,降低了各种自由基反应对爆炸系统温度和火焰速度的促进作用。这一发现为在微观层面上保护和抑制甲烷氢爆炸提供了理论支持。
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CiteScore
4.20
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