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The band structures of strained graphene nanoribbons (GNRs) are examined by a tight binding Hamiltonian that is directly related to the type and strength of strains. Compared to the two-dimensional graphene whose band gap remains close to…

Mesoscale and Nanoscale Physics · Physics 2010-01-20 Yang Lu , Jing Guo

We propose a unified description of transport in graphene with adsorbates that fully takes into account localization effects and loss of electronic coherence due to inelastic processes. We focus in particular on the role of the scattering…

Mesoscale and Nanoscale Physics · Physics 2013-11-28 Guy Trambly De Laissardière , Didier Mayou

We numerically investigate the electronic transport properties between two mesoscopic graphene disks with a twist by employing the density functional theory coupled with non-equilibrium Green's function technique. By attaching two graphene…

Mesoscale and Nanoscale Physics · Physics 2020-07-01 Yulei Han , Yafei Ren , Xinlong Dong , Junjie Zeng , Wei Ren , Zhenhua Qiao

Structural and electronic properties, including deformation, magnetic moment, Mulliken population, bond order as well as electronic transport properties, of zigzag graphene nanoribbon (ZGNR) with Co adatom on hollow site are investigated by…

Mesoscale and Nanoscale Physics · Physics 2013-02-19 G. P. Zhang , Xiaojie Liu , C. Z. Wang , Y. X. Yao , Jian Zhang , K. M. Ho

Quantum resonant tunneling behaviors of double-barrier structures on graphene are investigated under the tight-binding approximation. The Klein tunneling and resonant tunneling are demonstrated for the quasiparticles with energy close to…

Mesoscale and Nanoscale Physics · Physics 2014-05-02 Wei-Yin Deng , Rui Zhu , Yun-Chang Xiao , Wen-Ji Deng

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 study the low-energy properties of a Hubbard chain of finite size N_C connected to two noninteracting leads using the numerical renormalization group (NRG) method. The results obtained for N_C = 3 and 4 show that the low-lying…

Mesoscale and Nanoscale Physics · Physics 2009-11-10 Akira Oguri , A. C. Hewson

Adiabatic quantum charge pumping in graphene nanoribbon double barrier structures with armchair and zigzag edges in the resonant transmission regime is analyzed. Using recursive Green's function method we numerically calculate the pumped…

Mesoscale and Nanoscale Physics · Physics 2010-12-13 E. Grichuk , E. Manykin

We present a theoretical study on narrow armchair graphene nanoribbons (AGNRs) with hydroxyl functionalized edges. Although this kind of passivation strongly affects the structure of the ribbon, a high degree of edge functionalization…

Mesoscale and Nanoscale Physics · Physics 2015-05-28 Nils Rosenkranz , Christian Till , Christian Thomsen , Janina Maultzsch

Based on a tight-binding model and a recursive Green's function technique, spin-depentent ballistic transport through tinny graphene sheets (flakes) is studied. The main interest is focussed on: electrical conductivity, giant…

Mesoscale and Nanoscale Physics · Physics 2015-05-13 S. Krompiewski

Effect of contact interfaces, between metallic single-wall carbon nanotubes (SWCNT) and external electrodes made also of nanotubes, on the electrical conductance is studied. A tight-binding model with both diagonal and off-diagonal…

Mesoscale and Nanoscale Physics · Physics 2015-06-24 S. Krompiewski

Impurities are unavoidable during the preparation of graphene samples and play an important role in graphene's electronic properties when they are adsorbed on graphene surface. In this work, we study the electronic structures and transport…

Mesoscale and Nanoscale Physics · Physics 2020-03-31 Lan Chen , Fangping Ouyang , Songshan Ma , Tie-Feng Fang , Ai-Min Guo , Qing-Feng Sun

A real-space quantum transport simulator for carbon nanoribbon (CNR) MOSFETs has been developed. Using this simulator, the performance of carbon nanoribbon (CNR) MOSFETs is examined in the ballistic limit. The impact of quantum effects on…

Mesoscale and Nanoscale Physics · Physics 2007-05-23 Gengchiau Liang , Neophytos Neophytou , Mark S. Lundstrom , Dmitri E. Nikonov

Quantum-dot states in graphene nanoribbons (GNR) were calculated using density-functional theory, considering the effect of the electric field of gate electrodes. The field is parallel to the GNR plane and was generated by an inhomogeneous…

Mesoscale and Nanoscale Physics · Physics 2012-09-25 Tobias Burnus , Gustav Bihlmayer , Daniel Wortmann , Yuriy Mokrousov , Stefan Blügel , Klaus Michael Indlekofer

The coherent electron transport along zigzag and metallic armchair graphene nanoribbons in the presence of one or two vacancies is investigated. Having in mind atomic scale tunability of the conductance fingerprints, the primary focus is on…

Mesoscale and Nanoscale Physics · Physics 2010-10-26 D. A. Bahamon , A. L. C. Pereira , P. A. Schulz

We investigate the transport characteristics of monolayer graphene p-n junctions by means of the non-equilibrium Green's function technique. It is shown that thanks to the high interband tunneling of chiral fermions and to a finite bandgap…

Mesoscale and Nanoscale Physics · Physics 2013-06-11 V. Hung Nguyen , A. Bournel , P. Dollfus

Graphene nanoribbons (GNRs) are promising components in future nanoelectronics due to the large mobility of graphene electrons and their tunable electronic band gap in combination with recent experimental developments of on-surface…

Mesoscale and Nanoscale Physics · Physics 2017-02-03 Pedro Brandimarte , Mads Engelund , Nick Papior , Aran Garcia-Lekue , Thomas Frederiksen , Daniel Sánchez-Portal

Using density functional theory and non-equilibrium Greens function technique, we performed theoretical investigations on the transport properties of several ZAZ SiNRs junctions,a similar kind of silicene molecules junction combined by…

Materials Science · Physics 2016-01-07 Dace Zha , Changpeng Chen , Jinping Wu

Based on a first-principles approach, we present scaling rules for the band gaps of graphene nanoribbons (GNRs) as a function of their widths. The GNRs considered have either armchair or zigzag shaped edges on both sides with hydrogen…

Mesoscale and Nanoscale Physics · Physics 2009-11-11 Young-Woo Son , Marvin L. Cohen , Steven G. Louie

Graphene-based nanostructures exhibit a vast range of exciting electronic properties that are absent in extended graphene. For example, quantum confinement in carbon nanotubes and armchair graphene nanoribbons (AGNRs) leads to the opening…