用分子动力学模拟方法，计算了氟代硼酸锂玻璃的电导率。
The conductivities in Fluoroborate glasses were calculated by molecular dynamics simulation method at near and higher than glass transition temperatures.
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。
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研究了近固体壁面拟有序液体边界层及其导热特性。
In the present paper a study on thermal conductivity of the quasi-ordered liquid layer on a solid surface was performed by molecular dynamics simulation.
介绍了用分子动力学模拟与热力学积分法相结合 ，模拟蛋白质与配体的绝对结合自由能的方法 。
Molecular dynamics simulation and thermodynamic integration method were used to calculate the absolute binding free energy of the protein- ligand complex.
介绍用分子动力学模拟方法研究固体的体相结构，表面问题，界面问题以及薄膜形成过程等方面的研究成果。
It also summarizes MD simulation in the studies of solid bulk characters, surface problem, interface problem and the progress of thin film formation etc.
用分子动力学方法模拟计算了二维无序钉扎系统中磁通的运动。
Using molecular dynamic simulations, this paper studies the vortices motion in random pinning superconductors.
用弹性动力学理论分析了应力波传播对纳米铜线的动力屈曲的影响，并与分子动力学模拟的结果进行了比较。
Elastic dynamics method predicts that stress wave has remarkable effects on dynamic buckling of the nano crystal copper wire. Comparison with molecular dynamic...
用分子动力学方法模拟了空位在金刚石近(0 0 1)表面的扩散过程，研究了温度对空位扩散的影响。
The diffusion process of the vacancy near diamond (001) surface and the effects of temperature on the vacancy diffusion were investigated by molecular dynamics simulation.
用弹性动力学理论分析了应力波传播对纳米铜线的动力屈曲的影响，并与分子动力学模拟的结果进行了比较。
Elastic dynamics method predicts that stress wave has remarkable effects on dynamic buckling of the nano crystal copper wire. Comparison with molecular dynamics resu...
用弹性动力学理论分析了应力波传播对纳米铜线的动力屈曲的影响，并与分子动力学模拟的结果进行了比较。
Elastic dynamics method predicts that stress wave has remarkable effects on dynamic buckling of the nano crystal copper wire. Comparison with molecular dynamics resu...
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