原子双原子碰撞heh2体系动力学性质分析-analysis of kinetic properties of he h2 system in atomic diatomic collisions.docxVIP

目录摘要.............................................................................................................................................IAbstract................................................................................................................................... III第一章 引言...............................................................................................................................11.1 分子反应动力学简介...................................................................................................11.2 立体分子反应动力学的发展现状...............................................................................31.3 势能面简介..................................................................................................................51.4 He+H2+的研究现状61.5 本章小结......................................................................................................................7第二章 理论方法.......................................................................................................................92.1 建立 Hamilton 方程92.2 初始条件的选择........................................................................................................102.3 轨线计算....................................................................................................................122.4 计算结果分析.............................................................................................................122.5 矢量相关的数学描述.................................................................................................14第三章 碰撞能对动力学性质的影响.....................................................................................17 3.1 引言............................................................................................................................173.2 结果及讨论................................................................................................................173.3 本章小结.............................................................................................