示踪剂在非晶金属中的扩散机理研究

P. H. Kien, H. V. Hue, P. K. Hung
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引用次数: 0

摘要

采用统计弛豫(SR)模拟方法研究了含2×105原子的非晶Co金属中单晶和气泡(BB)的行为。仿真结果表明,随着松驰程度的增大,4-单纯形的比例增大,𝑛-simplex(𝑛>4)减小。模拟发现,随着弛豫程度的不同,BB的数量也有很大的变化,可以起到Co原子在非晶基体中的扩散载体的作用。非晶金属中扩散机制的思想描述如下:元素原子运动包括相邻原子跃入BB,然后BB周围大量原子的集体位移。
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Study of Tracer Diffusion Mechanism in Amorphous Metal
The statistical relaxation (SR) simulation has been conducted to study the behavior of simplexes and bubbles (BB) in amorphous Co metal containing 2×105 atoms. The simulation reveals that the fraction of 4-simplex increases and 𝑛-simplex (𝑛>4) decreases depending upon relaxation degree. The simulation found that a large number of BB vary upon relaxation degree, which could play a role of diffusion vehicle for Co atoms in amorphous matrix. The idea of the diffusion mechanism in amorphous metal is described as follows: the elemental atomic movement includes a jump of neighboring atom into the BB and then a collective displacement of a large number of atoms around BB.
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