molecular dynamics md simulation 分子动力学模拟
molecular dynamics simulation md 分子动力学模拟
md molecular dynamics simulation 分子动力学模拟
The density profile of hard sphere fluid confined in two parallel hard walls was studied by using Rosenfeld density Functional Theory (DFT) and Molecular Dynamics (MD) simulation method.
利用密度泛函理论和分子动力学方法，对处于两平行硬墙之间的硬球流体的密度分布进行了计算。
The aluminum and carbon clusters impacting on gold thin films have been studied by molecular dynamics (MD) simulation.
本文基于分子动力学模拟研究铝原子簇和碳原子簇轰击金薄膜的碰撞级联过程。
In this paper molecular dynamics (MD) simulation was applied to validate COMPASS force field for HMX.
首先通过分子动力学(MD)模拟考察了COMPASS力场对HMX的适用性。
应用推荐