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Non-Equilibrium Reaction Rates in Chemical Kinetic Equations

机译:化学动力学方程中的非平衡反应速率

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Within the recently proposed asymptotic method for solving the Boltzmann equation for chemically reacting gas mixture, the chemical kinetic equations has been derived. Corresponding one-temperature non-equilibrium reaction rates are expressed in terms of specific heat capacities of the species participate in the chemical reactions, bracket integrals connected with the internal energy transfer in inelastic non-reactive collisions and energy transfer coefficients. Reactions of dissociation/recombination of homonuclear and heteronuclear diatomic molecules are considered. It is shown that all reaction rates are the complex functions of the species densities, similarly to the unimolecular reaction rates. For determining the rate coefficients it is recommended to tabulate corresponding bracket integrals, additionally to the equilibrium rate constants. Correlation of the obtained results with the irreversible thermodynamics is established.
机译:在最近提出的用于求解化学反应气体混合物的Boltzmann方程的渐近方法中,已经推导出化学动力学方程。相应的单温非平衡反应速率以物种的特定热容量参与化学反应而表示,与内部能量传递连接的括号积分,在非弹性非反应碰撞和能量转移系数中。考虑解离/重组的反应和杂核硅藻分子的反应。结果表明,所有反应速率都是物质密度的复杂功能,类似于单分子反应速率。为了确定速率系数,建议另外输入相应的括号积分,另外到平衡速率常数。确定了与不可逆热力学的结果的相关结果。

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