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The phonon and electron transport in single-walled carbon nanotubes (SWCNT) are investigated using the nonequilibrium Green's function approach. In zigzag SWCNT ($n$, 0) with $mod(n,3)\not=0$, the thermal conductance is mainly attributed to…

Materials Science · Physics 2015-03-17 Jin-Wu Jiang , Jian-Sheng Wang , Baowen Li

The thermoelectric properties of MoS2 armchair nanoribbons with different width are studied by using first-principles calculations and Boltzmann transport theory, where the relaxation time is predicted from deformation potential theory. Due…

Mesoscale and Nanoscale Physics · Physics 2015-02-24 D. D. Fan , H. J. Liu , L. Cheng , P. H. Jiang , J. Shi , X. F. Tang

Electronic transport in a zig-zag-edge graphene nanoribbon (GNR) and its modification by adsorbed transition metal porphyrins is studied by means of density functional theory calculations. The detachment reaction of the metal centre of the…

Mesoscale and Nanoscale Physics · Physics 2019-09-27 P. Kratzer , Sherif Abdulkader Tawfik , X. Y. Cui , C. Stampfl

We will present brief overview on the electronic and transport properties of graphene nanoribbons focusing on the effect of edge shapes and impurity scattering. The low-energy electronic states of graphene have two non-equivalent massless…

Mesoscale and Nanoscale Physics · Physics 2009-09-30 Katsunori Wakabayashi , Yositake Takane , Masayuki Yamamoto , Manfred Sigrist

Electronic transport with a line (or a few lines) of Anderson type disorder in a zigzag graphene nanoribbon is investigated in presence of Rashba spin-orbit interaction. Such line disorders give rise to peculiar behavior in both charge as…

Mesoscale and Nanoscale Physics · Physics 2019-01-01 Sudin Ganguly , Saurabh Basu , Santanu K. Maiti

We performed a series of theoretical transport studies on Y-branch electron waveguides which are embedded in mid-size armchair graphene nanoribbons (AGNRs). Non-equilibrium Greens function (NEGF) with different approximations of…

Mesoscale and Nanoscale Physics · Physics 2018-11-14 Vahid Mosallanejad , Kuei-Lin Chiu , Guo-ping Guo

We investigate the conductivity $\sigma$ of graphene nanoribbons with zigzag edges as a function of Fermi energy $E_F$ in the presence of the impurities with different potential range. The dependence of $\sigma(E_F)$ displays four different…

Mesoscale and Nanoscale Physics · Physics 2007-08-20 Yan-Yang Zhang , Jiang-Ping Hu , X. C. Xie , W. M. Liu

Coherent electronic transport through a molecular device is studied using non-equilibrium Green's function (NEGF) formalism. Such device is made of a carbon nanowire which is connected to ferromagnetic electrodes. The molecule itself is…

Mesoscale and Nanoscale Physics · Physics 2007-05-23 Kamil Walczak , Gloria Platero

We report electronic structure and electric field modulation calculations in the width direction for armchair graphene nanoribbons (acGNRs) using a semi-empirical extended Huckel theory. Important band structure parameters are computed,…

Mesoscale and Nanoscale Physics · Physics 2008-06-25 Hassan Raza , Edwin C. Kan

Negative differential resistivity (NDR) in a (3+1)-dimensional quantum system of strongly correlated charge carriers is theoretically reproduced by using the AdS/CFT correspondence. Our system is microscopically defined, and the analysis…

High Energy Physics - Theory · Physics 2011-09-19 Shin Nakamura

We explore electron transport properties in honeycomb lattice ribbons with zigzag edges coupled to two semi-infinite one-dimensional metallic electrodes. The calculations are based on the tight-binding model and the Green's function method,…

Mesoscale and Nanoscale Physics · Physics 2010-06-08 Santanu K. Maiti

The primary requirement for achieving spin-selective electron transfer in a nanojunction possessing a magnetic system with zero net magnetization is to break the symmetry between the up and down spin sub-Hamiltonians. Circumventing the…

Mesoscale and Nanoscale Physics · Physics 2026-05-22 Prabhab Patra , Santanu K. Maiti

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

We investigate localization effects in zigzag graphene nanoribbons with quasiperiodic Fibonacci-type edge extensions, accounting for electron-electron interactions. We employ a tight-binding model that includes first- and…

Mesoscale and Nanoscale Physics · Physics 2026-05-15 Diego B. Fonseca , Anderson L. R. Barbosa , Luiz Felipe C. Pereira

We extensively characterize the electronic structure of ultra-narrow graphene nanoribbons (GNRs) with armchair edges and zig-zag termini that have 5 carbon atoms across their width (5-AGNRs), as synthesised on Au(111). Scanning tunnelling…

Geometric and electronic properties of folded graphene nanoribbons (FGNRs) are investigated by first-principles calculations. These properties are mainly dominated by the competition or cooperation among stacking, curvature and edge…

Computational Physics · Physics 2015-09-15 Shen-Lin Chang , Bi-Ru Wu , Po-Hua Yang , Ming-Fa Lin

We study the electronic and transport properties of heterostructures formed by armchair graphene nanoribbons with intersections of finite length. We describe the system by a tight-binding model and calculate the density of states and the…

Mesoscale and Nanoscale Physics · Physics 2007-11-19 L. Rosales , P. Orellana , Z. Barticevic , M. Pacheco

We study the effect of a structural nanoconstriction on the coherent transport properties of otherwise ideal zig-zag-edged infinitely long graphene ribbons. The electronic structure is calculated with the standard one-orbital tight-binding…

Mesoscale and Nanoscale Physics · Physics 2007-05-23 F. Muñoz-Rojas , D. Jacob , J. Fernández-Rossier , J. J. Palacios

We study the transport properties, in particular, the thermoelectric figure of merit ZT of armchair graphene nanoribbons, AGNR-N (for N=4-12, with widths ranging from 3.7 to 13.6~\AA) through strain engineering, where N is the number of…

Materials Science · Physics 2013-08-22 Pei Shan Emmeline Yeo , Michael B. Sullivan , Kian Ping Loh , Chee Kwan Gan

We study theoretically electron interference in a Mach--Zehnder-like geometry formed by four zigzag graphene nanoribbons (ZGNRs) arranged in parallel pairs, one on top of the other, such that they form intersection angles of 60$^\circ$.…

Mesoscale and Nanoscale Physics · Physics 2023-07-04 Sofia Sanz , Nick Papior , Géza Giedke , Daniel Sánchez-Portal , Mads Brandbyge , Thomas Frederiksen