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Using first-principle electronic structure calculations, we show a metal- semiconductor transition of a metallic graphene nanoribbon with zigzag edges induced by substitutional doping of Nitrogen or Boron atoms at the edges. A field effect…

Materials Science · Physics 2009-11-13 Bing Huang , Qimin Yan , Gang Zhou , Jian Wu , Feng Liu , Bing-Lin Gu , Wenhui Duan

Vertical tunneling field-effect-transistor (FET) based on graphene heterojunctions with layers of hBN is simulated by self-consistent quantum transport simulations. It is found that the asymmetric p-type and n-type conduction is due to work…

Mesoscale and Nanoscale Physics · Physics 2015-06-05 S. Bala Kumar , Gyungseon Seol , Jing Guo

We report on the experimental demonstration and electrical characterization of N = 7 armchair graphene nanoribbon (7-AGNR) field effect transistors. The back-gated transistors are fabricated from atomically precise and highly aligned…

Mesoscale and Nanoscale Physics · Physics 2018-03-21 Vikram Passi , Amit Gahoi , Boris V. Senkovskiy , Danny Haberer , Felix R. Fischer , Alexander Grüneis , Max C. Lemme

The thermoelectric properties of in plane heterostructures made of Graphene and hexagonal Boron Nitride (BN) have been investigated by means of atomistic simulation. The heterostructures consist in armchair graphene nanoribbons to the sides…

Mesoscale and Nanoscale Physics · Physics 2015-08-19 Van-Truong Tran , Jérôme Saint Martin , Philippe Dollfus

The characteristics of energy band spectrum of armchair graphene nanoribbons in presence of line defect are analyzed within a simple non-interacting tight-binding framework. In metallic nanoribbons an energy gap may or may not appear in the…

Mesoscale and Nanoscale Physics · Physics 2013-07-19 Paramita Dutta , Santanu K. Maiti , S. N. Karmakar

Bottom-up synthesized GNRs and GNR heterostructures have promising electronic properties for high performance field effect transistors (FETs) and ultra-low power devices such as tunnelling FETs. However, the short length and wide band gap…

Using density functional theory combined with a Green's function scattering approach, we examine the thermoelectric properties of hetero-nanoribbons formed from alternating lengths of graphene and boron nitride. In such structures, the…

Mesoscale and Nanoscale Physics · Physics 2015-10-06 L. A. Algharagholy , Q. Al-Galiby , H. A. Marhoon , H. Sadeghi , H. M. Abduljalil , C. J. Lambert

In-plane heterojunction tunnel field effect transistors based on monolayer transition metal dichalcogenides are studied by means of self-consistent non-equilibrium Green's functions simulations and an atomistic tight-binding Hamiltonian. We…

Mesoscale and Nanoscale Physics · Physics 2018-11-14 Jean Choukroun , Marco Pala , Shiang Fang , Efthimios Kaxiras , Philippe Dollfus

We study the transport property for armchair-edge graphene nanoribbons (AGNRs) with an adatom coupling to a semi-infinite quantum wire. Using the nonequilibrium Green's function approach with tight-binding approximation, we demonstrate that…

Mesoscale and Nanoscale Physics · Physics 2015-05-28 Xiongwen Chen , Kehui Song , Benhu Zhou , Haiyan Wang , Guanghui Zhou

We propose two schemes of field-effect transistor based on gapped armchair graphene nanoribbons connected to metal leads, by introducing sidearms or on-site gate voltages. We make use of the band gap to reach excellent switch-off character.…

Mesoscale and Nanoscale Physics · Physics 2012-05-17 H. Tong , M. W. Wu

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 present the first principle calculations of the electrical properties of graphene sheet/h-BN heterojunction(GS/h-BN) and 11-armchair graphene nanoribbon heterojunction(11-AGNR/h-BN), which were carried out using the density functional…

Mesoscale and Nanoscale Physics · Physics 2018-07-04 Taiga Wakai , Shoichi Sakamoto , Mitsuyoshi Tomiya

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

In this paper, we propose a combined modeling of molecular mechanics (MM) and the tight-binding (TB) approach, which enables us to study the effect of factors such as external local forces, constraints, and vacancy defects on electronic…

Computational Physics · Physics 2021-03-11 Mahnoosh Rostami , Isa Ahmadi , Farhad Khoeini

Graphene/silicon heterostructures have attracted tremendous interest as a new platform for diverse electronic and photonic devices such as barristors, solar cells, optical modulators, and chemical sensors. The studies to date largely focus…

Materials Science · Physics 2015-12-29 Yuan Liu , Jiming Sheng , Hao Wu , Qiyuan He , Hung-Chieh Cheng , Muhammad Imran Shakir , Yu Huang , Xiangfeng Duan

We study all-carbon-hydrogen molecular transistors where zigzag graphene nanoribbons play the role of three metallic electrodes connected to a ring-shaped 18-annulene molecule. Using the nonequilibrium Green function formalism combined with…

Mesoscale and Nanoscale Physics · Physics 2010-12-02 Kamal K. Saha , Branislav K. Nikolic , Vincent Meunier , Wenchang Lu , J. Bernholc

In this paper, we present a mode space method for atomistic non-equilibrium Green's function simulations of armchair graphene nanoribbon FETs that includes electron-phonon scattering. With reference to both conventional and tunnel FET…

Mesoscale and Nanoscale Physics · Physics 2013-04-12 Roberto Grassi , Antonio Gnudi , Ilaria Imperiale , Elena Gnani , Susanna Reggiani , Giorgio Baccarani

A weakly coupled system of two crossed graphene nanoribbons exhibits direct tunneling due to the overlap of the wavefunctions of both ribbons. We apply the Bardeen transfer Hamiltonian formalism, using atomistic band structure calculations…

Mesoscale and Nanoscale Physics · Physics 2016-08-02 Maarten L. Van de Put , William G. Vandenberghe , Bart Sorée , Wim Magnus , Massimo V. Fischetti

This paper projects the enhanced drive current of a n-type electrostatically doped (ED) tunnel field-effect transistor (ED-TFET) based on heterojunction and band-gap engineering via TCAD 2-D device simulations. The homojunction ED-TFET…

Mesoscale and Nanoscale Physics · Physics 2015-12-22 Kanchan Cecil , Jawar Singh

We combine density-functional theory and the nonequilibrium Green's function method to study the thermal conductance of graphene nanoribbons with armchair and zigzag edges. Zigzag ribbons have higher thermal conductance than armchair…

Mesoscale and Nanoscale Physics · Physics 2011-08-05 Zhen Wah Tan , Jian-Sheng Wang , Chee Kwan Gan