首页> 外文会议>NATO advanced research workshop on collective diffusion on surfaces: Correlation effects and adatom interactions >CORRELATED DIFFUSION OF ADATOMS AND ISLANDS ON THE LOW INDEXED SURFACES OF NOBLE METALS AND ALLOYS
【24h】

CORRELATED DIFFUSION OF ADATOMS AND ISLANDS ON THE LOW INDEXED SURFACES OF NOBLE METALS AND ALLOYS

机译:贵金属和合金低分度表面上的吸附和岛的相关扩散

获取原文
获取外文期刊封面目录资料

摘要

The diffusion processes of adatoms and islands en the low indexed noble metal and alloy surfaces were studied by Molecular Dynamics Simulations, based on semi-empirical potential models in analogy to the Tight Binding Theory in the Second Moment Approximation. Several systems were considered, like Cu adatoms and Cu or Au islands/adlayers on the Cu(110) and Cu(111) surface, respectively, and Cu or Au adatoms on the Cu_3Au(001) face. Various diffusion processes, that were monitored and analyzed, Were found for these systems. It comes out that collective excitations may play an important role not only in the diffusivity of the adsorbates, but also in the structural and dynamic behavior of the substrate. In addition, it was found that the ciffusive behavior of islands is characterized by the high mobility of the peripheral atoms and their different relaxed positions from the other island atoms. The surface and half monolayer island (0.5ML) relaxation were also found to play an important role in the stability and diffusivity of adlayers deposited on he 0.5ML island. Moreover, it was found that the presence of Cu or Au adatoms on the Cu_3Au(001) surface stimulates diffusion processes that can be related to wetting and disordering phenomena occurring at higher temperatures.
机译:通过分子动力学模拟研究了低分度贵金属和合金表面的adatoms和岛的扩散过程,基于半经验潜在模型在第二时刻近似下的紧密结合理论。考虑了几种系统,如Cu(110)和Cu(110)和Cu(111)表面上的Cu adatoms和Cu或Au岛/ adlayers,以及Cu_3au(001)面上的Cu或Au adatoms。发现和分析的各种扩散过程被发现用于这些系统。它出来的是,集体激发可能不仅在吸附物的扩散性中起重要作用,而且可以在基板的结构和动态行为中发挥重要作用。此外,发现岛的悬崖行为的特征在于外周原子的高迁移率以及来自其他岛原子的不同宽松位置。还发现表面和半层岛(0.5ml)放松在沉积在0.5ml岛上的亚丁层的稳定性和扩散性中起重要作用。此外,发现Cu _3AU(001)表面上的Cu或Au吸附物的存在刺激了在较高温度下发生的润湿和障碍现象的扩散过程。

著录项

相似文献

  • 外文文献
  • 中文文献
  • 专利
获取原文

客服邮箱:kefu@zhangqiaokeyan.com

京公网安备:11010802029741号 ICP备案号:京ICP备15016152号-6 六维联合信息科技 (北京) 有限公司©版权所有
  • 客服微信

  • 服务号