镁含量对铝镁合金粉尘燃爆反应动力学特性的影响分析

Influence of magnesium content on the reaction kinetic characteristics of powder combustion and explosion reactions in Al–Mg alloys

  • 摘要: 利用化学反应动力学模拟技术,研究了不同镁含量条件下铝镁合金燃爆过程中的动力学特性,着重对比分析了五种铝镁合金粉Al–xMg(x=10%、20%、30%、40%和50%,质量分数)燃爆过程的温度以及关键自由基·O、·AlO、·Al2O的变化规律,并总结得出铝镁合金粉尘燃爆反应动力学机理. 结果表明:镁含量显著影响了铝镁合金的燃爆特性,镁含量越高,合金反应越剧烈. 铝镁合金燃爆过程中,镁的高活性使其优先与氧气发生反应,迅速生成MgO;而铝则经历了三个阶段,初期铝先与氧气反应生成AlO/Al2O等中间产物,接着AlO/Al2O又继续与·O自由基结合,最终转换为Al2O3. 数值模拟结果从反应动力学层面揭示了镁含量在铝镁合金爆炸过程中的作用机理,镁通过氧化竞争,使反应路径发生改变,并且随着镁含量的增加,铝的反应路径缩短,单位质量内·O、·AlO、·Al2O产量减少. 此外,铝镁合金升温的关键基元反应以Al与·O的反应为主,而镁的加入抑制了铝氧反应,因此随着镁含量的增加,合金的反应温度变低. 研究结果为工业生产过程中铝镁合金的选用以及燃爆事故的防控提供了理论依据.

     

    Abstract: This study utilizes chemical kinetics simulation technology to systematically investigate the combustion and explosion characteristics of aluminum-magnesium (Al–Mg) alloy powders with varying magnesium contents (10%, 20%, 30%, 40%, and 50% mass fraction). It employs a zero-dimensional closed homogeneous reactor model in Chemkin to conduct numerical simulations of the combustion process of Al–xMg alloys. The analysis focuses temperature evolution patterns, the generation and consumption dynamics of key free radicals (·O, AlO, and Al2O), and the evolution mechanisms of oxidation reaction pathways. It further evaluates the influence of Mg content on the reaction rate and productivity of Al–Mg alloys, thereby clarifying the role of the Mg content in the explosion process of Al–Mg alloys at various kinetic levels and gaining a better understanding of the explosion behavior of Al–Mg alloys. The results show that the Mg content significantly influences the combustion and explosion characteristics of Al–Mg alloys; the higher the Mg content, the more intense the alloy reaction. The combustion and explosion of Al–Mg alloys occurs via three stages; in the initial stage, the high reactivity of Mg causes it to rapidly react with oxygen to form MgO, while Al reacts with the remaining oxygen to generate intermediate products such as·AlO/·Al2O. Subsequently, AlO/·Al2O reacts with ·O free radicals, ultimately converting to Al2O3. A comparison of the reaction kinetic pathways of Al–10%Mg and Al–50%Mg powders showed that the number of reaction pathways of the Al–50%Mg powder was relatively low. Among them, the main reaction pathways of ·Al free radicals decreased from three to two, thereby reducing the number of pathways for generating the intermediate product·Al2O. This reduction arises from oxidative competition between Mg and Al during the combustion and explosion processes. The entire process occurs in a closed container. Owing to the stronger chemical activity of Mg compared to Al, Mg preferentially reacts with oxygen in the container, leading to a reduction in the concentration of ·O free radicals in gas phase and weakening of the Al–O reaction. The higher the Mg content, the more O free radicals are consumed. Therefore, when the Mg content increases to 50%, ·Al can only react with the remaining·O to form·AlO and·Al2O; it cannot be further oxidized to form·AlO2. Similarly, the main reaction pathway for AlO decreases from four to three. In terms of the reaction rate, the Mg-based elementary absolute rate of production was higher in Al–50Mg powder compared to that in Al–10%Mg powder. Notably, the rate of the Mg–O reaction increased threefold, whereas the Al-based elementary reaction rate declined. This phenomenon is attributed to the increased Mg and reduced Al contents. The increase in the decomposition reaction rate of AlO further indicates that the addition of Mg promoted the AlO decomposition reaction and, to a certain extent, accelerated the formation of Al2O. In addition, during the combustion and explosion of Al–Mg alloys, temperature rise was dominated by the elementary reaction between Al and ·O; the addition of Mg suppressed the Al–O reaction, thus decreasing the overall reaction temperature with increasing Mg content. The reaction kinetics of Al–Mg alloys revealed microscopic changes in chemical substances during the combustion and explosion processes. These research findings provide a theoretical basis for the selection of Al–Mg alloys and for the prevention and control of combustion-explosion accidents during industrial production.

     

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