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Dynamics of clustering in a binary Lennard-Jones material

机译:二元Lennard-Jones材料中的聚类动力学

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We have performed constant temperature two-dimensional molecular dynamics simulations of a binary Lennard-Jones material, representing an idealized metallic alloy or a material containing a specified fraction of an additive atomic species. Differences in the interatomic potentials between the atomic species can lead to clustering of the alloy atoms. An exponential distribution of cluster size is obtained as time approaches infinity. For sufficiently strong attractions the distribution of cluster sizes becomes nearly independent of the force and the attained maximum cluster size reaches a saturation level. [References: 16]
机译:我们已经对二元Lennard-Jones材料进行了恒定温度的二维分子动力学模拟,该材料代表理想化的金属合金或包含指定分数的添加原子种类的材料。原子种类之间原子间电势的差异可能导致合金原子聚集。随着时间接近无穷大,获得簇大小的指数分布。对于足够强的吸引力,簇的大小分布变得几乎与力无关,并且获得的最大簇大小达到饱和水平。 [参考:16]

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