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An energy gap can be opened in the electronic spectrum of graphene by lifting its sublattice symmetry. In bilayers, it is possible to open gaps as large as 0.2 eV. However, these gaps rarely lead to a highly insulating state expected for…

Using ab-initio methods, we show that the uniform deformation either leaves graphene (semi)metallic or opens up a small gap yet only beyond the mechanical breaking point of the graphene, contrary to claims in the literature based on…

Mesoscale and Nanoscale Physics · Physics 2015-05-27 I. I. Naumov , A. M. Bratkovsky

Electronic structures of graphene sheet with different defective patterns are investigated, based on the first principles calculations. We find that defective patterns can tune the electronic structures of the graphene significantly.…

Mesoscale and Nanoscale Physics · Physics 2015-05-19 H. Y. He , Y. Zhang , B. C. Pan

We study the electronic and transport properties of a graphene-based superlattice theoretically by using an effective Dirac equation. The superlattice consists of a periodic potential applied on a single-layer graphene deposited on a…

Mesoscale and Nanoscale Physics · Physics 2015-02-26 Jonas R. F. Lima

Gap opening at the Dirac point of the single-layer graphene with periodic scalar and vector potentials has been theoretically investigated under the continuum model. The symmetry analysis indicates that the two-fold degeneracy at the Dirac…

Mesoscale and Nanoscale Physics · Physics 2015-05-28 Xin Lin , Hailong Wang , Hui Pan , Huaizhe Xu

Gap opening in graphene is usually discussed in terms of a semiconducting-like spectrum, where the appearance of a finite gap at the Dirac point is accompanied by a finite mass for the fermions. In this Letter we propose a gap scenario from…

Mesoscale and Nanoscale Physics · Physics 2008-10-03 L. Benfatto , E. Cappelluti

Graphene antidot lattices constitute a novel class of nano-engineered graphene devices with controllable electronic and optical properties. An antidot lattice consists of a periodic array of holes which causes a band gap to open up around…

Graphene lacks an intrinsic band-gap, which limits its use in electronic applications. Here we demonstrate that periodic arrays of topological defects can open and control a band-gap in a predictable manner governed by defect spacing and…

We investigate the electronic structure and lattice stability of pristine and functionalized (with either hydrogen or oxygen) $\alpha$-graphyne systems. We identify lattice instabilities due to soft-phonon modes, and describe two mechanisms…

Materials Science · Physics 2014-04-02 R. Longuinhos , E. A. Moujaes , S. S. Alexandre , R. W. Nunes

We study the energy level structures of the defective graphane lattice, where a carbon dimer defect is created by removing the hydrogen atoms on two nearest-neighbor carbon sites. Robust defect states emerge inside the bulk insulating gap…

Mesoscale and Nanoscale Physics · Physics 2019-02-19 Lei Hao , Hong-Yan Lu , C. S. Ting

Graphene has shown great application potentials as the host material for next generation electronic devices. However, despite its intriguing properties, one of the biggest hurdles for graphene to be useful as an electronic material is its…

Defects play a key role in the electronic structure of graphene layers flat or curved. Topological defects in which an hexagon is replaced by an n-sided polygon generate long range interactions that make them different from vacancies or…

Strongly Correlated Electrons · Physics 2008-11-26 Alberto Cortijo , María A. H. Vozmediano

Much attention has been focused on ways of rendering graphene semiconducting. We study periodically gated graphene in a tight-binding model and find that, contrary to predictions based on the Dirac equation, it is possible to open a band…

Mesoscale and Nanoscale Physics · Physics 2012-10-10 Jesper Goor Pedersen , Thomas Garm Pedersen

Graphene, being one-atom thick, is extremely sensitive to the presence of adsorbed atoms and molecules and, more generally, to defects such as vacancies, holes and/or substitutional dopants. This property, apart from being directly usable…

Materials Science · Physics 2011-04-08 Rocco Martinazzo , Simone Casolo , Gian Franco Tantardini

The geometric properties of a lattice can have profound consequences on its band spectrum. For example, symmetry constraints and geometric frustration can give rise to topologicially nontrivial and dispersionless bands, respectively.…

Mesoscale and Nanoscale Physics · Physics 2020-12-25 Christie S. Chiu , Da-Shuai Ma , Zhi-Da Song , B. Andrei Bernevig , Andrew A. Houck

Various types of topological defects in graphene are considered in the framework of the continuum model for long-wavelength electronic excitations, which is based on the Dirac--Weyl equation. The condition for the electronic wave function…

Strongly Correlated Electrons · Physics 2016-10-04 Yu. A. Sitenko , N. D. Vlasii

The influence of a topological defect in graphene on the ground state of electronic quasiparticle excitations is studied in the framework of the long-wavelength continuum model originating in the tight-binding approximation for the nearest…

Strongly Correlated Electrons · Physics 2016-10-06 Yu. A. Sitenko , N. D. Vlasii

Theoretical calculations, based on hybrid exchange density functional theory, are used to show that in graphene a periodic array of defects generates a ferromagnetic ground state at room temperature for unexpectedly large defect…

Materials Science · Physics 2009-11-13 L. Pisani , B. Montanari , N. M. Harrison

Graphene, a two dimensional (2D) carbon sheet, acquires many of its amazing properties from the Dirac point nature of its electronic structures with negligible spin-orbit coupling. Extending to 3D space, graphene networks with negative…

Mesoscale and Nanoscale Physics · Physics 2015-07-09 Hongming Weng , Yunye Liang , Qiunan Xu , Rui Yu , Zhong Fang , Xi Dai , Yoshiyuki Kawazoe

The $\pi$-electronic structure of graphene in the presence of a modulated electric potential is investigated by the tight-binding model. The low-energy electronic properties are strongly affected by the period and field strength. Such a…

Mesoscale and Nanoscale Physics · Physics 2009-11-13 J. H. Ho , Y. H. Chiu , S. J. Tsai , M. F. Lin
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