Investigation of surface and subsurface defects of Cu(111) surface by scanning tunneling microscopy.

IF 3.7 2区 化学 Q3 CHEMISTRY, PHYSICAL
Killian Walshe, Brian Walls, Alexei Yu Aladyshkin, Victor N Matveev, Kuanysh Zhussupbekov, Andrey M Ionov, Igor V Shvets, Sergey I Bozhko
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引用次数: 0

Abstract

Various types of surface defects are observed using scanning tunneling microscopy (STM) on a clean Cu(111) surface. Detailed STM images of defects show an asymmetric structure comprised of a bright protrusion inside a hexagonal depression. Protrusions are consistently aligned in the same direction, Cu[001], on the surface. The defects are observed to interact with one another, as each defect is separated by an integer multiple of half the Fermi wavelength, evident from the quasiparticle interference oscillations resulting from the defects. This interaction is also suspected to dictate the orientation of the defects, resulting in their uniform alignment. Ab initio density functional theory methods are used to investigate Cu(111) surface defects and adatoms. Simulated STM images using the Tersoff-Hamann scheme are compared to STM images. Results are also discussed in the context of existing literature on similar structures.

扫描隧道显微镜对Cu(111)表面和亚表面缺陷的研究。
利用扫描隧道显微镜(STM)在干净的Cu(111)表面观察到各种类型的表面缺陷。缺陷的详细STM图像显示由六边形凹陷内的明亮突起组成的不对称结构。凸出物在表面上始终沿同一方向排列,Cu[001]。这些缺陷被观察到相互作用,因为每个缺陷被一半费米波长的整数倍隔开,这从缺陷引起的准粒子干涉振荡中可以看出。这种相互作用也被怀疑决定了缺陷的方向,导致它们的均匀排列。采用从头算密度泛函理论方法研究了Cu(111)表面缺陷和附原子。采用Tersoff-Hamann方案的模拟STM图像与STM图像进行了比较。结果还讨论了现有文献的类似结构。
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来源期刊
Journal of Chemical Physics
Journal of Chemical Physics 物理-物理:原子、分子和化学物理
CiteScore
7.40
自引率
15.90%
发文量
1615
审稿时长
2 months
期刊介绍: The Journal of Chemical Physics publishes quantitative and rigorous science of long-lasting value in methods and applications of chemical physics. The Journal also publishes brief Communications of significant new findings, Perspectives on the latest advances in the field, and Special Topic issues. The Journal focuses on innovative research in experimental and theoretical areas of chemical physics, including spectroscopy, dynamics, kinetics, statistical mechanics, and quantum mechanics. In addition, topical areas such as polymers, soft matter, materials, surfaces/interfaces, and systems of biological relevance are of increasing importance. Topical coverage includes: Theoretical Methods and Algorithms Advanced Experimental Techniques Atoms, Molecules, and Clusters Liquids, Glasses, and Crystals Surfaces, Interfaces, and Materials Polymers and Soft Matter Biological Molecules and Networks.
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