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We present a review of the phonon thermal conductivity of segmented nanowires focusing on theoretical results for Si and Si/Ge structures with the constant and periodically modulated cross-sections. We describe the use of the face-centered…

Mesoscale and Nanoscale Physics · Physics 2017-11-22 Denis L. Nika , Aleksandr I. Cocemasov , Alexander A. Balandin

We perform molecular dynamics simulations to investigate the reduction of the thermal conductivity by kinks in silicon nanowires. The reduction percentage can be as high as 70% at room temperature. The temperature dependence of the…

Materials Science · Physics 2013-08-14 Jin-Wu Jiang , Nuo Yang , Bing-Shen Wang , Timon Rabczuk

We study heat current autocorrelation function and thermal conductivity in core-shell nanowires by using molecular dynamics simulations. Interestingly, a remarkable oscillation effect in heat current autocorrelation function is observed in…

Materials Science · Physics 2015-05-30 Jie Chen , Gang Zhang , Baowen Li

Porous nanowires (NWs) with tunable thermal conductance are examined as a candidate for thermoelectric (TE) devices with high efficiency (ZT). Thermal conductance of porous Si and Ge NWs is calculated using the complete phonon dispersion…

Mesoscale and Nanoscale Physics · Physics 2015-05-20 Abhijeet Paul , Gerhard Klimeck

We present analytical model and molecular dynamics simulations of phonon heat transport in nanowires and nanoribbons with anharmonic lattices and dynamically rough surfaces and edges. In agreement with recent experiments on heat transport…

Statistical Mechanics · Physics 2011-12-30 Yuriy A. Kosevich , Alexander V. Savin

We evaluate the impact of acoustic Mie resonance in nanoparticles on the thermal conductivity of semiconductor and polymer composites. By appropriately choosing the bulk modulus and density, and selecting the size of the nanoparticle to…

Mesoscale and Nanoscale Physics · Physics 2021-12-08 Brian Slovick , Srini Krishnamurthy

Boundary-engineering in nanostructures has the potential to dramatically impact the development of materials for high-efficiency conversion of thermal energy directly into electricity. In particular, nanostructuring of semiconductors can…

Materials Science · Physics 2016-10-04 Giuseppe Romano , Alexie M. Kolpak

A comprehensive rational thermal material design paradigm requires the ability to reduce and enhance the thermal conductivities of nanomaterials. In contrast to the existing ability to reduce the thermal conductivity, methods that allow to…

Mesoscale and Nanoscale Physics · Physics 2017-10-09 Abhinav Malhotra , Kartik Kothari , Martin Maldovan

By using non-equilibrium molecular dynamics simulations, we demonstrated that thermal conductivity of Germanium nanowires can be reduced more than 25% at room temperature by atomistic coating. There is a critical coating thickness beyond…

Materials Science · Physics 2016-09-21 Jie Chen , Gang Zhang , Baowen Li

Porous materials provide a large surface to volume ratio, thereby providing a knob to alter fundamental properties in unprecedented ways. In thermal transport, porous nanomaterials can reduce thermal conductivity by not only enhancing…

Thermal transport in the Si/SiO$_2$ multishell nanotubes is investigated theoretically. The phonon energy spectra are obtained using the atomistic Lattice Dynamics approach. Thermal conductivity is calculated using the Boltzmann transport…

Materials Science · Physics 2021-04-30 C. Isacova , A. Cocemasov , D. L. Nika , V. M. Fomin

Suppressing phonon propagation in nanowires is an essential goal towards achieving efficient thermoelectric devices. Recent experiments have shown unambiguously that surface roughness is a key factor that can reduce the thermal conductivity…

Mesoscale and Nanoscale Physics · Physics 2017-08-09 K. A. Muttalib , S. Abhinav

Prevailing nanostructuring strategies focus on increasing phonon scattering and reducing the mean-free-path of phonons across the spectrum. In nanoporous Si materials, for example, boundary scattering reduces thermal conductivity…

Mesoscale and Nanoscale Physics · Physics 2020-12-02 Laura de Sousa Oliveira , S. Aria Hosseini , Alex Greaney , Neophytos Neophytou

Phonon properties of small Si nanowires in [110] direction have been analyzed using density functional perturbation theory. Several samples with varying diameters ranging from 0.38 to 1.5 nm have been calculated. It is found that the…

Materials Science · Physics 2022-07-06 Konstanze R. Hahn , Claudio Melis , Fabio Bernardini , Lorenzo Paulatto , Luciano Colombo

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

The thermal conductivity of a freestanding single-crystal silicon membrane may be reduced significantly by attaching nanoscale pillars on one or both surfaces. Atomic resonances of the nanopillars locally and intrinsically couple with the…

Mesoscale and Nanoscale Physics · Physics 2021-09-01 Hossein Honarvar , Mahmoud I. Hussein

Prior experimental studies showed that nanowires are promising structures for improving the thermoelectric performance of practical thermoelectric materials due to the strongly induced phonon-boundary scattering. However, few studies…

Mesoscale and Nanoscale Physics · Physics 2017-09-13 Lei Ma , Riguo Mei , Mengmeng Liu , Xuxin Zhao , Qixing Wu , Hongyuan Sun

We analyze the benefits and shortcomings of a thermal control in nanoscale electronic conductors by means of the contact heating scheme. Ideally, this straightforward approach allows one to apply a known thermal bias across nanostructures…

Tuning thermal transport in nanostructures is essential for many applications, such as thermal management and thermoelectrics. Nanophononic metamaterials (NPM) have shown great potential for reducing thermal conductivity by introducing…

Materials Science · Physics 2024-09-10 Lina Yang , Yixin Xu , Xianheng Wang , Yanguang Zhou

It has been proposed for a long time now that the reduction of the thermal conductivity by reducing the phonon mean free path is one of the best way to improve the current performance of thermoelectrics. By measuring the thermal conductance…

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