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The spin-polarized electronic structure and half-metallicity of zigzag graphene nanoribbons (ZGNRs) with asymmetric edge terminations are investigated by using first principles calculations. It is found that compared with symmetric…

Materials Science · Physics 2010-07-15 Zuanyi Li , Bing Huang , Wenhui Duan

We explore the edge properties of rectangular graphene nanoribbons featuring two zigzag edges and two armchair edges. Although the self-consistent Hartree-Fock fields break chiral symmetry, our work demonstrates that graphene nanoribbons…

Mesoscale and Nanoscale Physics · Physics 2024-03-25 Hyun Cheol Lee , S. -R. Eric Yang

Using density functional theory calculations, we have studied the edge-functionalization of armchair graphene nanoribbons (AGNRs) with pentagonal-hexagonal edge structures. While the AGNRs with pentagonal-hexagonal edge structures (labeled…

Mesoscale and Nanoscale Physics · Physics 2020-02-05 Junga Ryou , Jinwoo Park , Gunn Kim , Suklyun Hong

Magnetic carbon nanostructures are currently under scrutiny for a wide spectrum of applications. Here, we theoretically investigate armchair graphene nanoribbons patterned with asymmetric edge extensions consisting of laterally fused…

Mesoscale and Nanoscale Physics · Physics 2021-02-11 Michele Pizzochero , Efthimios Kaxiras

We study the electronic correlation effects in armchair graphene nanoribbons that have been recently proposed to be the building blocks of spin qubits. The armchair edges give rise to peculiar quantum interferences and lead to quenched…

Mesoscale and Nanoscale Physics · Physics 2009-11-13 Yen-Chen Lee , Hsiu-Hau Lin

Recently, atomically well-defined cove-shaped graphene nanoribbons have been obtained using bottom-up synthesis. These nanoribbons have an optical gap in the visible range of the spectrum which make them candidates for donor materials in…

Mesoscale and Nanoscale Physics · Physics 2014-11-18 Cesar E. P. Villegas , Pedro B. Mendonça , Alexandre Rocha

We investigate the quality of hydrogen plasma defined graphene edges by Raman spectroscopy, atomic resolution AFM and low temperature electronic transport measurements. The exposure of graphite samples to a remote hydrogen plasma leads to…

We study the electron transport through a graphene nanoribbon-superconductor junction. Both zigzag and armchair edge graphene nanoribbons are considered, and the effects of the magnetic field and disorder on the transport property are…

Mesoscale and Nanoscale Physics · Physics 2015-05-13 Qing-feng Sun , X. C. Xie

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

We unveil the nature of the structural disorder in bottom-up zigzag graphene nanoribbons along with its effect on the magnetism and electronic transport on the basis of scanning probe microscopies and first-principles calculations. We find…

Electronic states at the ends of a narrow armchair nanoribbon give rise to a pair of non-locally entangled spins. We propose two experiments to probe these magnetic states, based on magnetometry and tunneling spectroscopy, in which…

Mesoscale and Nanoscale Physics · Physics 2013-08-23 Michael Golor , Cornelie Koop , Thomas C. Lang , Stefan Wessel , Manuel J. Schmidt

We investigate the ground-state properties of triangular graphene nanoflakes with zigzag edge configurations. The description of zero-dimensional nanostructures requires accurate many-body techniques since the widely used density-functional…

Strongly Correlated Electrons · Physics 2018-01-24 I. Hagymasi , O. Legeza

The electronic properties of a material depend on the spatial freedom of the electron wavefunction. A well-known example is graphite, which is a conventional gapless semiconductor, while a single layer of it, graphene, exhibits extremely…

Mesoscale and Nanoscale Physics · Physics 2026-01-28 Mohammadamir Bazrafshan , Thomas. D. Kühne

Hydrogenated graphene edges are assumed to be either armchair, zigzag or a combination of the two. We show that the zigzag is not the most stable fully hydrogenated structure along the <2-1-10> direction. Instead hydrogenated Klein and…

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

Using a continuum Dirac theory, we study the density and spin response of zigzag edge terminated graphene ribbons subjected to edge potentials and Zeeman fields. Our analytical calculations of the density and spin responses of the closed…

Mesoscale and Nanoscale Physics · Physics 2010-11-23 Somnath Bhowmick , Vijay B. Shenoy

We present the analytical solution of the wavefunction and energy dispersion of armchair graphene nanoribbons (GNRs) based on the tight-binding approximation. By imposing hard-wall boundary condition, we find that the wavevector in the…

Mesoscale and Nanoscale Physics · Physics 2015-06-25 Huaixiu Zheng , Zhengfei Wang , Tao Luo , Qinwei Shi , Jie Chen

In the paper we consider the system composed of two magnetic planes attached to zigzag terminations of the graphene nanostructure being an ultrashort fragment of the armchair nanoribbon. We investigate theoretically an indirect coupling…

Mesoscale and Nanoscale Physics · Physics 2014-08-20 Karol Szałowski

The effect of edge modification of armchair graphene nanoribbons (AGNRs) on the collective excitations are theoretically investigated. The tight-binding method is employed in conjunction with the dielectric function. Unconventional plasmon…

Mesoscale and Nanoscale Physics · Physics 2021-09-22 Thi-Nga Do , Po-Hsin Shih , Godfrey Gumbs , Danhong Huang

Polarization resolved micro-Raman spectroscopy was carried out at the edges of bilayer graphene. We find strong dependence of the intensity of the G band on the incident laser polarization, with its intensity dependence being 90 degrees out…

Mesoscale and Nanoscale Physics · Physics 2015-05-19 Milan Begliarbekov , Onejae Sul , Sokratis Kalliakos , Eui-Hyeok Yang , Stefan Strauf
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