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Charge and thermal conductivities are the most important parameters of carbon nanomaterials as candidates for future electronics. In this paper we address the effects of Anderson type disorder in long semiconductor carbon nanotubes (CNTs)…

Mesoscale and Nanoscale Physics · Physics 2013-10-16 H. Sevincli , T. Lehmann , D. A. Ryndyk , G. Cuniberti

The effect on the vibrational and thermal properties of gradually interconnected nanoinclusions embedded in an amorphous silicon matrix is studied using MD simulations. The nanoinclusion arrangement ranges from an aligned sphere array to an…

Mesoscale and Nanoscale Physics · Physics 2021-05-10 Paul Desmarchelier , Alice Carré , Konstantinos Termentzidis , Anne Tanguy

The effect of interface scattering on the performance of disordered, nanocomposite thermoelectric materials is studied theoretically using effective medium theory and direct numerics. The interfacial electronic and phonon scattering…

Mesoscale and Nanoscale Physics · Physics 2012-02-24 Paul M. Haney

Solid-liquid interfacial thermal conductance (ITC) critically influences heat transport in microfluidic, electronic, and energy systems, yet most optical thermometry techniques are limited to specific metal-liquid interfaces. In this work,…

Applied Physics · Physics 2026-04-16 Tao Chen , Puqing Jiang

Hierarchical material nanostructuring is considered to be a very promising direction for high performance thermoelectric materials. In this work we investigate thermal transport in hierarchically nanostructured silicon. We consider the…

Mesoscale and Nanoscale Physics · Physics 2018-10-17 Dhritiman Chakraborty , Samuel Foster , Neophytos Neophytou

Boundary scattering in hierarchically disordered nanomaterials is an effective way to reduce the thermal conductivity of thermoelectric materials and increase their performance. In this work we investigate thermal transport in silicon based…

Materials Science · Physics 2019-02-27 Dhritiman Chakraborty , Laura de Sousa Oliveira , Neophytos Neophytou

Current understanding of thermal rectification asserts that the rectification ratio (R), which measures the relative heat flux between two ends of a nanostructure, is determined by its geometric asymmetry. The higher the asymmetry, the…

Mesoscale and Nanoscale Physics · Physics 2016-03-25 Zhongwei Zhang , Yuanping Chen , Yuee Xie , Shengbai Zhang

It has been shown that the first C layer on the SiC(0001)(2{\times}2)C surface already exhibits graphene-like electronic structure, with linear pi bands near the Dirac point. Indeed, the (2{\times}2)C reconstruction, with a Si adatom and C…

Mesoscale and Nanoscale Physics · Physics 2015-05-27 F. Hiebel , P. Mallet , J. -Y. Veuillen , L. Magaud

Superconductor based quantum computing has the major drawback of working temperatures which require liquid helium for cooling. A promising approach to overcome this obstacle for quantum technologies is based on deep level defects in…

Materials Science · Physics 2019-06-19 Michael Schöler , Maximilian W. Lederer , Philipp Schuh , Peter J. Wellmann

We investigate the thermal conductivity of suspended graphene as a function of the density of defects, ND, introduced in a controllable way. Graphene layers are synthesized using chemical vapor deposition, transferred onto a transmission…

Polymer composites with thermally conductive nanoscale filler particles, such as graphene and hexagonal boron nitride (h-BN), are promising for certain heat transfer applications. While graphene-polymer composites have been extensively…

Applied Physics · Physics 2017-12-04 Ruimin Ma , Xiao Wan , Teng Zhang , Nuo Yang , Tengfei Luo

Thermal transport in nanoscale interconnects is dominated by intricate electron-phonon interactions and microstructural influences. As copper faces limitations at the nanoscale, tungsten and ruthenium have emerged as promising alternatives…

We theoretically investigate thermal conductivity in silicon nanomeshes using Monte Carlo simulations of phonon transport. Silicon membranes of 100nm thickness with randomly located pores of 50nm diameter are considered. The effects of…

Materials Science · Physics 2014-06-02 Stefanie Wolf , Neophytos Neophytou , Hans Kosina

Pump-probe optical methods like transient grating spectroscopy (TGS) enable rapid, nondestructive thermoelastic property measurements. But, in phonon-dominated ceramics, they can underpredict bulk thermal diffusivity when long mean free…

Phonon transmission across an interface between dissimilar crystalline solids is calculated using molecular dynamics simulations with interatomic force constants obtained from first principles. The results reveal that although inelastic…

Computational Physics · Physics 2015-06-09 Takuru Murakami , Takuma Hori , Takuma Shiga , Junichiro Shiomi

The influence of defects on electron transport in single-wall carbon nanotube field effect transistors (CNFETs) is probed by combined scanning gate microscopy (SGM) and scanning impedance microscopy (SIM). SGM reveals a localized field…

Mesoscale and Nanoscale Physics · Physics 2009-11-07 Marcus Freitag , Sergei V. Kalinin , Dawn A. Bonnell , A. T. Johnson

The thermoelectric properties of 54 different group 4 half-Heusler (HH) alloys have been studied from first principles. Electronic transport was studied with density functional theory using hybrid functionals facilitated by the $\mathbf{k}…

Materials Science · Physics 2020-01-08 Kristian Berland , Nina Shulumba , Olle Hellman , Clas Persson , Ole Martin Løvvik

Controlling thermal energy transfer at the nanoscale has become critically important in many applications and thermal properties since it often limits device performance. In this work, we study the effects on thermal conductivity arising…

The thermal conductance in graphene nanoribbon with a vacancy or silicon point defect (substitution of C by Si atom) is investigated by non-equilibrium Green's function (NEGF) formalism combined with first-principle calculations…

Materials Science · Physics 2011-08-31 Jin-Wu Jiang , Bing-Shen Wang , Jian-Sheng Wang

Efficient thermal management is essential for the reliability of modern power electronics, where increasing device density leads to severe heat dissipation challenges. However, in thin-film systems, thermal transport is often compromised by…

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