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Strain engineering has been recently recognized as an effective way to tailor the electrical properties of graphene. In the optical domain, effects such as strain-induced anisotropic absorption add an appealing functionality to graphene,…

Mesoscale and Nanoscale Physics · Physics 2013-12-31 Guang-Xin Ni , Hong-Zhi Yang , Wei Ji , Seung-Jae Baeck , Chee-Tat Toh , Jong-Hyun Ahn , Vitor M. Pereira , Barbaros Özyilmaz

The effect of contact architecture, graphene defect density and metal-semiconductor work function difference on resistivity of metal-graphene contacts have been investigated. An architecture with metal on the bottom of graphene is found to…

Materials Science · Physics 2016-01-05 Krishna Bharadwaj B , Rudra Pratap , Srinivasan Raghavan

The electronic and transport properties of aluminum-graphene composite materials were investigated using ab initio plane wave density functional theory. The interfacial structure is reported for several configurations. In some cases, the…

Materials Science · Physics 2024-02-12 K. Nepal , C. Ugwumadu , K. N. Subedi , K. Kappagantula , D. A. Drabold

A possibility to control magnetic properties by using electric fields is one of the most desirable characteristics for spintronics applications. Finding a suitable material remains an elusive goal, with only a few candidates found so far.…

We report the electronic properties of two-dimensional systems made of graphene nanoribbons which are patterned with ad-atoms in two separated regions. Due to the extra electronic confinement induced by the presence of the impurities, we…

Mesoscale and Nanoscale Physics · Physics 2015-09-25 J. W. González , L. Rosales , M. Pacheco , A. Ayuela

We investigate the conductivity of doped graphene in the semiclassical Boltzmann limit, as well as the conductivity minimum within the self-consistent transport theory. Using the hard-disk model for a two-dimensional distribution of…

Materials Science · Physics 2013-11-21 Rastko Aničić , Zoran L. Mišković

This work presents a systematic review of the feature-rich essential properties in graphene-related systems using the first-principles method. The geometric and electronic properties are greatly diversified by the number of layers, the…

Chemical Physics · Physics 2017-02-14 Ngoc Thanh Thuy Tran , Shih-Yang Lin , Chiun-Yan Lin , Ming-Fa Lin

Understanding the magnetic properties of graphenic nanostructures is instrumental in future spintronics applications. These magnetic properties are known to depend crucially on the presence of defects. Here we review our recent theoretical…

Mesoscale and Nanoscale Physics · Physics 2013-04-02 Elton J. G. Santos , Andres Ayuela , Daniel Sanchez-Portal

Recent experimental findings and theoretical predictions suggest that nitrogen-doped CVD-grown graphene may give rise to electronic band gaps due to impurity distributions which favour segregation on a single sublattice. Here we demonstrate…

Mesoscale and Nanoscale Physics · Physics 2016-02-09 Thomas Aktor , Antti-Pekka Jauho , Stephen R. Power

We present a theoretical study of the optical conductivity of graphene with magnetic and nonmagnetic adatoms. First, by introducing alternating potential in a pure graphene, we demonstrate a gap formation in the density of states and the…

Strongly Correlated Electrons · Physics 2015-01-13 Muhammad Aziz Majidi , Syahril Siregar , Andrivo Rusydi

The electronic transport properties of single layer graphene having a dilute coating of indium adatoms has been investigated. Our studies establish that isolated indium atoms donate electrons to graphene and become a source of charged…

Mesoscale and Nanoscale Physics · Physics 2019-12-11 U. Chandni , Erik A. Henriksen , J. P. Eisenstein

We compute the optical conductivity for an out-of-plane deformation in graphene using an approach based on solutions of the Dirac equation in curved space. Different examples of periodic deformations along one direction translates into an…

Mesoscale and Nanoscale Physics · Physics 2014-05-05 A. J. Chaves , T. Frederico , O. Oliveira , W. de Paula , M. C. Santos

We present numerical studies of conduction in graphene nanoribbons with reconstructed edges based on the standard tight-binding model of the graphene and the extended Huckel model of the reconstructed defects. We performed atomic geometry…

Mesoscale and Nanoscale Physics · Physics 2016-06-29 S. Ihnatsenka , G. Kirczenow

We investigate the electronic transport properties of copper-graphene composites using a density-functional framework. Conduction in composites by varying the interface distance of a copper/graphene/copper (Cu/G/Cu) interface models was…

Materials Science · Physics 2023-02-01 K. N. Subedi , K. Nepal , C. Ugwumadu , K. Kappagantula , D. A. Drabold

We investigate the electronic properties of semi-metallic (12,0) carbon nanotubes in the presence of a variety of mono-, di- and hexa-vacancy defects, by using first principle DFT combined with non-equilibrium Green's function technique. We…

Mesoscale and Nanoscale Physics · Physics 2009-10-08 Hui Zeng , Huifang Hu , Jean-Pierre Leburton

We study the conductivity of a graphene strip taking into account electrostatically-induced charge accumulation on its edges. Using a local dependency of the conductivity on the carrier concentration we find that the electrostatic size…

Mesoscale and Nanoscale Physics · Physics 2010-12-09 F. T. Vasko , I. V. Zozoulenko

Graphene has been studied in detail due to its mechanical, electrical, and thermal properties. It is well documented that the introduction of dopants or defects in the lattice can be used to tune material properties for a specific…

Materials Science · Physics 2025-09-11 Benedict Saunders , Lukas Hörmann , Reinhard J. Maurer

We present a first-principles study of the migration and recombination of edge defects (carbon adatom and/or vacancy) and their influence on electrical conductance in zigzag graphene nanoribbons (ZGNRs). It is found that at room…

Mesoscale and Nanoscale Physics · Physics 2010-09-10 Jia Li , Zuanyi Li , Gang Zhou , Zhirong Liu , Jian Wu , Bing-Lin Gu , Jisoon Ihm , Wenhui Duan

We present electron transport measurements on lithographically defined and etched graphene nanoconstrictions with different aspect ratios including different lengths (L) and widths (W). A roughly length-independent disorder induced…

Mesoscale and Nanoscale Physics · Physics 2011-04-13 B. Terrés , J. Dauber , C. Volk , S. Trellenkamp , U. Wichmann , C. Stampfer

We study numerically the effects of edge and bulk disorder on the conductance of graphene nanoribbons. We compute the conductance suppression due to localization induced by edge scattering. We find that even for weak edge roughness,…

Mesoscale and Nanoscale Physics · Physics 2009-11-13 Eduardo R. Mucciolo , Antonio H. Castro Neto , Caio H. Lewenkopf