Molecular dynamics simulations of liquid water were performed at 258 K and density of 1.0 g/cm3 under different strength......

By using molecular dynamics simulations based on the classical mechanic method, the dispersion behavior of gasoline dete......

用３ 种检测粒子法（Ｗｉｄｏｍ ，Ｋｕｍａｒ，ｆｇ ｓａｍｐｌｉｎｇ） 对Ｌ－Ｊ流体临界温度以上的数十个状态点的化学势进行了模拟计算。结果表明，这几种方法与由Ｌ－ Ｊ流体状态方程得出的值......