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采用ＤＳＭＣ方法研究分子碰撞反应机理，在分子水平上模拟绝热封闭体系合并式电离－复合反应的弛豫过程。ＤＳＭＣ结果与反应动力学理论结果相符，验证了本文所用的ＤＳＭＣ仿真模型是合理的。
DSMC method was used to study the mechanism of molecular collision reaction to simulate the relaxation process of the combined ionization-recombination reaction of adiabatic closed system at the molecular level. The results of DSMC are in agreement with the theoretical results of the reaction kinetics, which verifies that the DSMC simulation model used in this paper is reasonable.