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原子层厚 ReS2 中带隙转变的直接观察

Direct Observation of the Band Gap Transition in Atomically Thin ReS.

机构信息

Peter Grünberg Institut PGI-6, Forschungszentrum Jülich and JARA , 52425 Jülich, Germany.

Peter Grünberg Institut PGI-1 and Institute for Advanced Simulation IAS-1, Forschungszentrum Jülich and JARA , 52425 Jülich, Germany.

出版信息

Nano Lett. 2017 Sep 13;17(9):5187-5192. doi: 10.1021/acs.nanolett.7b00627. Epub 2017 Aug 9.

Abstract

ReS is considered as a promising candidate for novel electronic and sensor applications. The low crystal symmetry of this van der Waals compound leads to a highly anisotropic optical, vibrational, and transport behavior. However, the details of the electronic band structure of this fascinating material are still largely unexplored. We present a momentum-resolved study of the electronic structure of monolayer, bilayer, and bulk ReS using k-space photoemission microscopy in combination with first-principles calculations. We demonstrate that the valence electrons in bulk ReS are-contrary to assumptions in recent literature-significantly delocalized across the van der Waals gap. Furthermore, we directly observe the evolution of the valence band dispersion as a function of the number of layers, revealing the transition from an indirect band gap in bulk ReS to a direct gap in the bilayer and the monolayer. We also find a significantly increased effective hole mass in single-layer crystals. Our results establish bilayer ReS as an advantageous building block for two-dimensional devices and van der Waals heterostructures.

摘要

ReS 被认为是新型电子和传感器应用的有前途的候选材料。这种范德华化合物的低晶体对称性导致了各向异性的光学、振动和输运性质。然而,这种迷人材料的电子能带结构的细节在很大程度上仍未被探索。我们使用 k 空间光电子显微镜结合第一性原理计算,对单层、双层和体相 ReS 的电子结构进行了动量分辨研究。我们证明,体相 ReS 中的价电子——与最近文献中的假设相反——在范德华间隙中显著离域。此外,我们直接观察到价带色散随层数的变化,揭示了体相 ReS 中从间接带隙到双层和单层的直接带隙的转变。我们还发现单层晶体中有效空穴质量显著增加。我们的结果确立了双层 ReS 作为二维器件和范德华异质结构的有利构建块。

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