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Studying the elastic properties of nanocrystalline copper using a model of randomly packed uniform grains

机译:用模型研究纳米晶铜的弹性性质  随机包装的均匀颗粒

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摘要

We develop a new Voronoi protocol, which is a space tessellation method, togenerate fully dense (containing no voids) nanocrystalline models of copper(Cu) with precise grain size control; we also perform uniaxial tensile testsusing molecular dynamical (MD) simulations to measure the elastic moduli of thegrain boundary and the grain interior components at 300 K. We find that thegrain boundary deforms more locally compared with the grain core region underthermal vibrations and is elastically less stiff than the core component atfinite temperature. The elastic modulus of the grain boundary is lower than 30%of that of the grain interior. Our results will aid in the development of moreaccurate continuum models of nanocrystalline metals.
机译:我们开发了一种新的Voronoi协议,它是一种空间曲面细分方法,以精确的晶粒尺寸控制,以完全致密的(不含空隙)铜(Cu)的全致密(不含空隙);我们还执行单轴拉伸试验分子动力学(MD)模拟,以测量TheGrain边界的弹性模量,谷物内部部件在300K中。我们发现与晶粒芯区域在热振动下方相比,TheGrain边界更加局部地变形,并且弹性较低比核心成分Atfinite温度。晶界的弹性模量低于晶粒内部的30%。我们的结果将有助于开发Moreacrate Continuum型号的纳米晶金属。

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