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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…

介观与纳米尺度物理 · 物理学 2015-08-19 Van-Truong Tran , Jérôme Saint Martin , Philippe Dollfus

The thermoelectric properties of hybrid graphene-boron nitride nanoribbons (BCNNRs) are investigated using the non-equilibrium Green's function (NEGF) approach. We find that the thermoelectric figure of merit (ZT) can be remarkably enhanced…

介观与纳米尺度物理 · 物理学 2015-06-04 Kaike Yang , Yuanping Chen , Roberto D'Agosta , Yuee Xie , Jianxin Zhong , Angel Rubio

Thermoelectric properties of Graphene Nanoribbons doped by magnetic impurities Fe and Co are carried out in room temperature. We report on a study of the band structure dependent properties such as electrical conductivity, charge of…

介观与纳米尺度物理 · 物理学 2019-03-12 Elham Rahmati

We study the thermoelectric performance of $90^0$-bent graphene nanoribbons containing nanopores for optimized design of multiple functional circuits including thermoelectric generators. We show that the thermal conductance of the…

介观与纳米尺度物理 · 物理学 2021-08-11 Van-Truong Tran , Alessandro Cresti

Transport and thermoelectric coefficients (including also spin thermopower) of silicene nanoribbons with zigzag edges are investigated by {\it ab-initio} numerical methods. Local spin density of such nanoribbons reveals edge magnetism. Like…

材料科学 · 物理学 2015-06-16 K. Zberecki , M. Wierzbicki , J. Barnaś , R. Swirkowicz

Nanostructures exhibit unusual properties due to the dominance of quantum mechanical effects. In addition, the geometry of a nanostructure can have a strong influence on its physical properties. Using the tight-binding (TB) and…

材料科学 · 物理学 2024-02-13 M. Amir Bazrafshan , Farhad Khoeini

This study delves into the thermoelectric properties of armchair black phosphorene nanoribbons while considering the presence of line edge roughness. Employing the tight-binding method in conjunction with non-equilibrium Green's function…

介观与纳米尺度物理 · 物理学 2025-01-27 Ebrahim Pishevar , Hossein Karamitaheri

Graphene has been widely studied for various applications due to its outstanding electrical and mechanical properties. However, its potential in thermoelectric applications has been limited by a low Seebeck coefficient and high thermal…

材料科学 · 物理学 2024-04-04 Laura Caputo , Viet-Hung Nguyen , Jean-Christophe Charlier

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…

材料科学 · 物理学 2013-08-22 Pei Shan Emmeline Yeo , Michael B. Sullivan , Kian Ping Loh , Chee Kwan Gan

In this work we study thermoelectric properties of graphene nanoribbons with side-attached organic molecules. By adopting a single-band tight binding Hamiltonian and the Green's function formalism, we calculated the transmission and Seebeck…

介观与纳米尺度物理 · 物理学 2013-06-26 L. Rosales , C. D. Nunez , M. Pacheco , A. Latge , P. A. Orellana

Effect of doping of graphene either by Boron (B), Nitrogen (N) or co-doped by B and N is studied using density functional theory. Our extensive band structure and density of states calculations indicate that upon doping by N (electron…

介观与纳米尺度物理 · 物理学 2012-07-31 Sugata Mukherjee , T. P. Kaloni

Thermoelectric measurements for graphene ribbons are currently performed on samples that include atomic disorder via defects and irregular edges. In this work, we investigate the thermopower or Seebeck coefficient of graphene ribbons within…

介观与纳米尺度物理 · 物理学 2018-09-11 Jhon W. González , Luis Rosales , Andrés Ayuela

We present electronic and transport properties of a zigzag nanoribbon made of alpha-$\mathcal{T}_3$ lattice. Our particular focus is on the effects of the continous evolution of the edge modes ( from flat to dispersive) on the…

介观与纳米尺度物理 · 物理学 2019-09-09 Mir Waqas Alam , Basma Souayeh , SK Firoz Islam

The thermoelectric properties of armchair graphene nanoribbons (AGNRs) with array characteristics are investigated theoretically using the tight-binding model and Green's function technique. The AGNR structures with array characteristics…

介观与纳米尺度物理 · 物理学 2024-01-17 David M T Kuo

A heterojunction tunneling field effect transistor based on armchair graphene nanoribbons is proposed and studied using ballistic quantum transport simulation based on 3D real space nonequilibrium Green's function formalism. By using low…

介观与纳米尺度物理 · 物理学 2013-12-13 Fei Liu , Xiaoyan Liu , Jinfeng Kang , Yi Wang

Grain boundaries are commonly observed in carbon nanostructures, but their influence on thermal and electric properties are still not completely understood. Using a combined approach of density functional tight-binding theory and…

材料科学 · 物理学 2015-06-30 Thomas Lehmann , Dmitry A. Ryndyk , Gianaurelio Cuniberti

We investigate electron and phonon transport through edge disordered zigzag graphene nanoribbons based on the same methodological tool of nonequilibrium Green functions. We show that edge disorder dramatically reduces phonon thermal…

介观与纳米尺度物理 · 物理学 2010-07-20 H. Sevincli , G. Cuniberti

We theoretically investigate the thermoelectric properties of zigzag graphene nanoribbons in the presence of extended line defects, substrate impurities and edge roughness along the nanoribbon's length. A nearest-neighbor tight-binding…

材料科学 · 物理学 2012-03-12 Hossein Karamitaheri , Neophytos Neophytou , Mahdi Pourfath , Rahim Faez , Hans Kosina

We report on the thermal and electrical properties of hybrid epoxy composites with graphene and boron nitride fillers. The thicknesses, lateral dimensions, and aspect ratios of each filler material were intentionally selected for geometric…

Thermoelectric materials open a way to harness dissipated energy and make electronic devices less energy-demanding. Heat-to-electricity conversion requires materials with a strongly suppressed thermal conductivity but still high electronic…

介观与纳米尺度物理 · 物理学 2022-08-31 Irián Sánchez-Ramírez , Yuriko Baba , Leonor Chico , Francisco Domínguez-Adame
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