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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 study the effects of uniaxial strains on the transport properties of the graphene nanoribbons(GNRs) connected with two metallic leads in heterojunctions, using the transfer matrix method. Two typical GNRs with zigzag and armchair…

Mesoscale and Nanoscale Physics · Physics 2015-05-27 Jing Wang , Guiping Zhang , Fei Ye , Xiaoqun Wang

Due to their unique electrical properties, graphene nanoribbons (GNRs) show great promise as the building blocks of novel electronic devices. However, these properties are strongly dependent on the geometry of the edges of the graphene…

Mesoscale and Nanoscale Physics · Physics 2012-08-17 Patrick Hawkins , Milan Begliarbekov , Marko Zivkovic , Stefan Strauf , Christopher P. Search

In this article, we study zigzag graphene nanoribbons with edges reconstructed with Stone-Wales defects, by means of an empirical (first-neighbor) tight-binding method, with parameters determined by ab-initio calculations of very narrow…

The conductance of metallic graphene nanoribbons (GNRs) with single defects and weak disorder at their edges is investigated in a tight-binding model. We find that a single edge defect will induce quasi-localized states and consequently…

Mesoscale and Nanoscale Physics · Physics 2008-02-07 T. C. Li , Shao-Ping Lu

Atomically precise graphene nanoribbons (GNRs) have emerged as promising candidates for nanoelectronic applications due to their widely tunable energy band gaps resulting from lateral quantum confinement and edge effects. Here we report on…

In graphene nanoribbons (GNRs), the lateral confinement of charge carriers opens a band gap, the key feature to enable novel graphene-based electronics. Successful synthesis of GNRs has triggered efforts to realize field-effect transistors…

Mesoscale and Nanoscale Physics · Physics 2018-06-05 Nils Richter , Zongping Chen , Alexander Tries , Thorsten Prechtl , Akimitsu Narita , Klaus Müllen , Kamal Asadi , Mischa Bonn , Mathias Kläui

We theoretically study the effect of transverse electric potentials on the transport properties of armchair graphene nanoribbons (AGNRs), formed by pairs of asymme-tric gates placed along the side of the ribbon. Single pair and dual pair…

Mesoscale and Nanoscale Physics · Physics 2011-04-12 S. Bala Kumar , T. Fujita , Gengchiau Liang

We present an ab initio study of the structural, electronic, and quantum transport properties of B-N-complex edge-doped graphene nanoribbons (GNRs). We find that the B-N edge codop-ing is energetically a very favorable process and…

Mesoscale and Nanoscale Physics · Physics 2015-03-10 Seong Sik Kim , Han Seul Kim , Hyo Seok Kim , Yong-Hoon Kim

By applying tight binding model, we investigate the electronic and transport properties of randomly distributed Stone-Wales (SW) defects on an armchair graphene nanoribbon (AGNR). We use four different functions, as distribution functions,…

Mesoscale and Nanoscale Physics · Physics 2019-04-02 Mobin Shakeri

The edge reconstruction of zigzag graphene nanoribbons to a stable line of alternatively fused seven and five membered rings with hydrogen passivation has been studied within density functional theory with both localized and extended basis…

Materials Science · Physics 2009-11-17 Sudipta Dutta , Swapan K. Pati

The electronic nonlinear transport through ultra narrow graphene nanoribbons (sub-$10nm$) is studied. A stable region of negative differential resistance (NDR) appears in the I-V characteristic curve of {\it odd} zigzag graphene nanoribbons…

Mesoscale and Nanoscale Physics · Physics 2012-11-14 Hosein Cheraghchi

A theoretical study of the magnetoelectronic properties of zigzag and armchair bilayer graphene nanoribbons (BGNs) is presented. Using the recursive Green's function method, we study the band structure of BGNs in uniform perpendicular…

Mesoscale and Nanoscale Physics · Physics 2009-07-13 Hengyi Xu , T. Heinzel , I. V. Zozoulenko

The transmission properties of armchair graphene nanoribbon junctions between graphene electrodes are investigated by means of first-principles quantum transport calculations. First the dependence of the transmission function on the size of…

Mesoscale and Nanoscale Physics · Physics 2023-07-19 C. Motta , D. Sánchez-Portal , M. I. Trioni

We propose an extensive report on the simulation of electronic transport in 2D graphene in presence of structural defects. Amongst the large variety of such defects in sp$^2$ carbon-based materials, we focus on the Stone-Wales defect and on…

Mesoscale and Nanoscale Physics · Physics 2012-08-03 Aurelien Lherbier , Simon M. -M. Dubois , Xavier Declerck , Yann-Michel Niquet , Stephan Roche , Jean-Christophe Charlier

This comprehensive study investigates charge transport through the multiple end zigzag edge states of finite-size armchair graphene nanoribbons/boron nitride nanoribbons (n-AGNR/w-BNNR) junctions under a longitudinal electric field, where n…

Mesoscale and Nanoscale Physics · Physics 2024-06-18 David M T Kuo

In this work we address the effects on the conductance of graphene nanoribbons (GNRs) at which organic molecules are side-attached on the ribbon ends. For simplicity, only armchair (AGNRs) and zigzag (ZGNRs) nanoribbons are considered and…

Mesoscale and Nanoscale Physics · Physics 2009-11-13 L. Rosales , M. Pacheco , Z. Barticevic , A. Latge , P. A. Orellana

A theoretical study of the transport properties of zigzag and armchair graphene nanoribbons with a magnetic barrier on top is presented. The magnetic barrier modifies the energy spectrum of the nanoribbons locally, which results in an…

Mesoscale and Nanoscale Physics · Physics 2008-09-19 Hengyi Xu , T. Heinzel , M. Evaldsson , I. V. Zozoulenko

Using density functional theory and non-equilibrium Greens function technique, we performed theoretical investigations on the structural and transport properties of zigzag silicene nanoribbons with Stone-Wales defect. The calculated…

Materials Science · Physics 2016-01-07 Dace Zha , Changpeng Chen , Manman Wang

Using the density functional theory, we have demonstrated the chemical functionalization of semiconducting graphene nanoribbons (GNRs) with Stone-Wales (SW) defects by carboxyl (COOH) groups. It is found that the geometrical structures and…

Materials Science · Physics 2007-10-18 Fangping OuYang , Bing Huang , Zuanyi Li , Hui Xu
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