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Graphane and graphene are both two-dimensional materials but of different bonding configurations, which can result in distinct thermal conduction properties. We simulate thermal conduction in graphane nanoribbons (GANRs) using the…

Mesoscale and Nanoscale Physics · Physics 2015-06-18 Dengfeng Li , Yong Xu , Xiaobin Chen , Bolin Li , Wenhui Duan

We present ab-initio transport calculations for molecular junctions that include graphene as a protecting layer between a single molecule and gold electrodes. This vertical setup has recently gained significant interest in experiment for…

Mesoscale and Nanoscale Physics · Physics 2015-12-15 Falco Hüser , Gemma C. Solomon

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

We investigate the combined influence of structural defects and uniaxial longitudinal strain on the electronic transport properties of armchair graphene nanoribbons using the numerical approach based on the semiempirical tight-binding…

Mesoscale and Nanoscale Physics · Physics 2013-09-30 Thomas Lehmann , Dmitry A. Ryndyk , Gianaurelio Cuniberti

Electronic carriers in graphene show a high carrier mobility at room temperature. Thus, this system is widely viewed as a potential future charge-based high-speed electronic-material to complement- or replace- silicon. At the same time, the…

Mesoscale and Nanoscale Physics · Physics 2012-12-04 R. G. Mani , J. Hankinson , C. Berger , W. A. de Heer

A novel nanoelectronic device is constructed by graphyne that is robustly connected between graphene electrodes, where graphyne is composed of hexagonal carbon rings and carbon chains. Owing to similarities between the bond lengths and unit…

Mesoscale and Nanoscale Physics · Physics 2013-07-17 Young I. Jhon , Myung S. Jhon

Solute segregation at grain boundaries (GBs) of polycrystals strongly impacts the mechanical properties of metals including strength, fracture, embrittlement, and corrosion. However, the complexity of GB structures and the large chemical…

Materials Science · Physics 2024-12-24 Hao Wu , Xin Li , Wang Gao , Qing Jiang

The discovery of unusual heat conduction properties of graphene has led to a surge of theoretical and experimental studies of phonon transport in two-dimensional material systems. The rapidly developing graphene thermal field spans from…

Materials Science · Physics 2016-02-01 Denis L. Nika , Alexander A. Balandin

Engineering structure of grain boundaries (GBs) by solute segregation is a promising strategy to tailor the properties of polycrystalline materials. Theoretically it has been suggested that solute segregation can trigger phase transitions…

Materials Science · Physics 2025-01-28 Vivek Devulapalli , Enze Chen , Tobias Brink , Timofey Frolov , Christian H. Liebscher

The optical conductivity of graphene strained uniaxially is studied within the Kubo-Greenwood formalism. Focusing on inter-band absorption, we analyze and quantify the breakdown of universal transparency in the visible region of the…

Mesoscale and Nanoscale Physics · Physics 2011-01-17 Vitor M. Pereira , R. M. Ribeiro , N. M. R. Peres , A. H. Castro Neto

We have performed a theoretical study of electronic transport in single and bilayer graphene based on the standard linear-response (Kubo) formalism and continuum-model descriptions of the graphene band structure. We are focusing especially…

Mesoscale and Nanoscale Physics · Physics 2010-02-25 J. Z. Bernad , U. Zuelicke , K. Ziegler

Electro-optic modulation is a technology-relevant function for signal keying, beam steering, or neuromorphic computing through providing the nonlinear activation function of a perceptron. With silicon-based modulators being bulky and…

Applied Physics · Physics 2018-05-23 Rubab Amin , Zhizhen Ma , Rishi Maiti , Sikandar Khan , Jacob B. Khurgin , Hamed Dalir , Volker J. Sorger

We study the Grain Boundary (GB) migration based on the underlying disconnection structure and mechanism. Disconnections are line defects that lie solely within a GB and are characterized by both a Burgers vector and a step height, as set…

Materials Science · Physics 2019-10-23 Chaozhen Wei , Spencer L. Thomas , Jian Han , David J. Srolovitz , Yang Xiang

Grain boundaries (GBs) profoundly influence the properties and performance of materials, emphasizing the importance of understanding the GB structure and phase behavior. As recent computational studies have demonstrated the existence of…

Materials Science · Physics 2025-01-28 Enze Chen , Tae Wook Heo , Brandon C. Wood , Mark Asta , Timofey Frolov

We theoretically study the electronic and transport properties of two graphene layers vertically coupled by an insulating layer under the influence of a time-periodic external light field. The non-adiabatic driving induces excitations of…

Mesoscale and Nanoscale Physics · Physics 2020-06-11 Pascal Stadler , Tomas Löfwander , Mikael Fogelström

In an external electric field, a system of conductive grains embedded in a dielectric matrix becomes unstable and relaxes towards a conductive state. We describe and discuss the elementary acts of this relaxation. When the grains packing…

Soft Condensed Matter · Physics 2017-03-03 Alexander Z. Patashinski , Mark A. Ratner

Grain boundaries in graphene are inherent in wafer-scale samples prepared by chemical vapor deposition. They can strongly influence the mechanical properties and electronic and heat transport in graphene. In this work, we employ extensive…

Mesoscale and Nanoscale Physics · Physics 2017-09-28 Zheyong Fan , Petri Hirvonen , Luiz Pereira , Mikko Ervasti , Ken Elder , Davide Donadio , Ari Harju , Tapio Ala-Nissila

Intrinsic bilayer graphene is a gapless semimetal. Under the application of a bias field it becomes a semiconductor with a direct band gap that is proportional to the applied field. Under a layer-asymmetric strain (where the upper layer…

Mesoscale and Nanoscale Physics · Physics 2014-12-04 J. A. Crosse

Graphene, the atomically-thin honeycomb carbon lattice, is a highly conducting 2D material whose exposed electronic structure offers an ideal platform for sensing. Its biocompatible, flexible, and chemically inert nature associated to the…

We have developed the combination of an etching and deposition technique that enables the fabrication of locally gated graphene nanostructures of arbitrary design. Employing this method, we have fabricated graphene nanoconstrictions with…

Mesoscale and Nanoscale Physics · Physics 2009-11-13 Barbaros Özyilmaz , Pablo Jarillo-Herrero , Dmitri Efetov , Philip Kim
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