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Rapid adatom island decay on Cu(111): a kinetic Monte Carlo simulation study

机译:Cu(111)上快速吸附原子的衰变:动力学蒙特卡洛模拟研究

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Kinetic Monte Carlo (KMC) simulations are used to investigate the recent scanning tunneling microscopy (STM) measurements of fast decaying adatom islands on Cu(111). The KMC model is a full diffusion bond-counting model including nearest neighbor as well as second-nearest neighbor interactions. For encounters between steps in adjacent atomic layers of an island it is demonstrated that a moderately reduced activation energy for interlayer adatom transport is enough to obtain correspondence between simulations and experiments, provided that the one-dimensional Ehrlich-Schwoebel barrier for corner transitions is reduced to zero. The results presented in this report are interesting because they demonstrate that step-edge crossing by simple adatom hopping is sufficient to explain the rapid island-decay mechanism.
机译:动力学蒙特卡洛(KMC)模拟用于研究Cu(111)上快速衰减的原子原子岛的最新扫描隧道显微镜(STM)测量。 KMC模型是一个完整的扩散键计数模型,其中包括最近邻居以及次最近邻居相互作用。对于岛上相邻原子层中台阶之间的相遇,证明了适度降低的层间吸附原子传输的活化能足以获得模拟与实验之间的对应关系,但前提是将拐角过渡的一维Ehrlich-Schwoebel势垒减小至零。本报告中提出的结果很有趣,因为它们证明了通过简单的原子跳跃实现的跨步穿越足以说明快速的岛衰变机制。

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