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准分子动力学 |
Quasi-molecular Dynamics |
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DOI:10.3969/j.issn.1671-5322.2003.01.004 |
中文关键词: 准分子动力学 势函数 弹性波 跨尺度力学 |
英文关键词: quasi-molecular dynamics potential function stress wave multi-scales mechanics |
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中文摘要: |
分子动力学计算机模拟是研究复杂凝聚态系统的有力工具,但存在着时间尺度和空间尺度小的局限性.准分子动力学方法,有望成为研究凝聚态系统的跨尺度问题的有力工具.对径受压圆盘的算例表明,准分子动力学方法在解决大尺度力学问题时是有效的. |
英文摘要: |
A new multi-scales quasi-molecular dynamics method is proposed. The method is based on molecular potential functions and time-space-scale corelation. A declining elastic wave propagation in a disc subjected to a pair opposite concentrate compressive loading symmetrically is simulated with the method. The method is a powerful tool to solve macro-scale dynamic problems and convenient to transform from micro-scales to macro-scales. |
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