Low-Energy Electronic Properties of Graphene and Armchair Ribbon Superlattices

被引:3
|
作者
Wong, Jen-Hsien [1 ]
Wu, Bi-Ru [2 ]
Yang, Po-Hua [3 ]
Lin, Ming-Fa [1 ]
机构
[1] Natl Cheng Kung Univ, Dept Phys, Tainan 70101, Taiwan
[2] Chang Gung Univ, Ctr Gen Educ, Dept Nat Sci, Tao Yuan, Taiwan
[3] Natl Ctr High Performance Comp South, Tainan, Taiwan
来源
JOURNAL OF PHYSICAL CHEMISTRY C | 2013年 / 117卷 / 14期
关键词
CARBON NANOTUBES; EPITAXIAL GRAPHENE; BILAYER GRAPHENE; DIRAC FERMIONS; HYBRID; NANORIBBONS; DEPENDENCE; GRAPHITE; STRAIN; FILMS;
D O I
10.1021/jp310956a
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
The geometric structures and electronic properties of graphene and armchair ribbon superlattices are investigated by the first-principles calculations. Parallel armchair ribbons are periodically placed upon a graphene sheet. The interlayer atomic interactions strongly influence the interlayer distance, binding energy, energy dispersion, state degeneracy, band gap, Fermi velocity, and Fermi momentum except for the intralayer bond length. These properties depend on the stacking configurations, ribbon width, and existence of hydrogen atoms at the ribbon edges. Such interactions also result in the distortion of graphene and ribbons, which is more obvious in the AA-stacked systems than the AB-stacked ones. All low-energy bands come from the 2p(z) orbitals of graphene or ribbon or from those of both. Most AA-stacked systems possess two intersecting low-lying bands, which exhibit highly anisotropic Fermi velocities. AB-stacked systems mainly have a direct band gap that is monotonously widened as ribbon width expands.
引用
收藏
页码:7326 / 7333
页数:8
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