The results of our MD simulation on decompression and recompression are similar to the experimental results.
减压缩和重压缩的MD模拟数据与实验结果相似。
The hydrogen bond structure and diffusion behavior of water at supercritical states were investigated by MD simulation.
采用分子动力学(MD)模拟的方法对超临界条件下水的结构及扩散性质进行了研究。
The READE (Rare Event Algorithm with Dose Effect) method can well speed up the MD simulation of ion implantation with dose effect.
（包含剂量效应的稀有事件算法）方法可以很好的加速含剂量效应的离子注入的分子动力学模拟。
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