入射粒子在薄膜表面观测迁移的杂化原子模型

Masahiro Yamamoto, A. Fujinami, S. Ogata, Y. Shibutani
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引用次数: 4

摘要

创新薄膜技术实现更精细的电子器件需要了解薄膜生长的原子水平过程及其与薄膜表征的关系。本文用所提出的杂化原子模型分析了入射粒子短时间剧烈碰撞下的几微秒级长膜生长现象。该方法将分子动力学(MD)与动力学蒙特卡罗(KMC)相结合,可以直接处理时间尺度差异较大的沉积和扩散两类事件。结果表明,与实际的物理气相沉积(PVD)相适应的沉积原子的大入射动能推动了Al(111)表面平衡的剧烈波动,并影响了原子级表面形貌。结果表明,入射速度为1.0 × 104 m/s的原子比入射速度为1.0 × 103 m/s的原子更能使表面光滑。这是由于大量活化的原子迁移,这只能通过MD来实现。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
Hybridized Atomistic Modeling of Migration Observed on Thin Film Surface by Incident Particles
Innovative thin film technology to realize the finer electric devices needs to understand the atomic level process of film growth and its relationship to the film characterization. In this paper, the long film growth phenomena for a few micro-second order with the short severe collisions by incident particles are analyzed by the proposed hybridized atomistic modeling. This method combined molecular dynamics (MD) with kinetic Monte Carlo (KMC) can directly treat two types of events of deposition and diffusion, which have quite different time scales. The solutions suggest that the large incident kinetic energy of deposited atoms compatible to the realistic physical vapor deposition (PVD) impels to fluctuate the equilibrium on Al (111) surface very drastically and affects the atomic level surface morphology. It is found that the faster incident atoms with 1.0 × 104 m/s can make the smoother surface than those with the velocity of 1.0 × 103 m/s. This is due to much activated atomic migration, which can be realized only by MD.
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