Energy relaxation processes initiated by suddenly heating of the vibrational degrees of freedom were studied with molecular dynamical method.
用分子动力学方法研究瞬时加热振动自由度后的能量弛豫过程。
In this paper we have calculated the vibrational relaxation rate by molecular dynamics simulation for homonuclear diatomic molecular crystal.
本文用分子动力学模拟方法计算同核双原子分子晶体的振动弛豫速率。
Associated with the molecular statics relaxation method, a computer modelling technique was provided for the study of structural characteristics of nanocrystals.
结合分子静力学的原子弛豫技术提出了一个对纳米晶体的原子结构模型及性质进行研究的计算机模拟方法。
The concentration quenching of organic dyes is mainly induced by the organic molecular interactions, such as formation of excimer and dimer, intercrossing relaxation, etc.
有机分子之间及有机分子与基质之间的各种相互作用，如激发态反应、二聚作用、交叉弛豫作用等，是引起有机染料浓度猝灭的主要原因。
For solid or liquid phases, some environmental effects, such as dephasing and vibrational relaxation, should be taken into account for studying molecular dynamics.
对于固相或液相情况，需要加入一些环境效应诸如退相、振动弛豫因子来描述分子动力学过程。
The former one was caused by the molecular diffusion from bulk to interface and the latter one was caused by the relaxation of H2D molecules at interface.
液滴扩张和收缩时，H2D分子存在从体相到表面的扩散快过程和分子在表面上的弛豫慢过程两个弛豫过程。
The former one was caused by the molecular diffusion from bulk to interface and the latter one was caused by the relaxation of H2D molecules at interface.
液滴扩张和收缩时，H2D分子存在从体相到表面的扩散快过程和分子在表面上的弛豫慢过程两个弛豫过程。
应用推荐