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As nanostructured devices become prevalent, interfaces often play an important role in thermal transport phenomena. However, interfacial thermal transport remains poorly understood due to complex physics across a wide range of length scales…

介观与纳米尺度物理 · 物理学 2024-02-27 Xun Li , Jinchen Han , Sangyeop Lee

We study nondiffusive thermal transport by phonons at small distances within the framework of the Boltzmann transport equation (BTE) and demonstrate that the transport is significantly affected by the distribution of phonons emitted by the…

介观与纳米尺度物理 · 物理学 2017-10-05 Vazrik Chiloyan , Samuel Huberman , Alexei A. Maznev , Keith A. Nelson , Gang Chen

Phonon coherence elucidates the propagation and interaction of phonon quantum states within superlattice, unveiling the wave-like nature and collective behaviors of phonons. Taking MoSe$_2$/WSe$_2$ lateral heterostructures as a model…

材料科学 · 物理学 2025-03-11 Xin Wu , Zhang Wu , Ting Liang , Zheyong Fan , Jianbin Xu , Masahiro Nomura , Penghua Ying

Heat transport at nanoscales in semiconductors is investigated with a statistical method. The Boltzmann Transport Equation (BTE) which characterize phonons motion and interaction within the crystal lattice has been simulated with a Monte…

经典物理 · 物理学 2009-11-11 David Lacroix , Karl Joulain

We present a calculation of the lattice thermal conductivity of Si-Ge nanowires (NWs), based on solving the Boltzmann transport equation by the Monte Carlo method of sampling the phonon mean free paths. We augment the previous work with the…

介观与纳米尺度物理 · 物理学 2016-11-15 M. Upadhyaya , Z. Aksamija

Using a full dispersion description of phonons, the thermal conductivities of bulk Si and Bi2Te3 are evaluated using a Landauer approach and related to the conventional approach based on the Boltzmann transport equation. A procedure to…

材料科学 · 物理学 2010-11-18 Changwook Jeong , Supriyo Datta , Mark Lundstrom

We determine the size effect on the lattice thermal conductivity of nanoscale wire and multilayer structures formed in and by some typical semiconductor materials, using the Boltzmann transport equation and focusing on the Knudsen flow…

材料科学 · 物理学 2009-11-11 Eleni Ziambaras , Per Hyldgaard

In this study, we systematically investigate the thermal and electronic transport properties of two-dimensional PbSe/PbTe monolayer heterostructure by combining first-principles calculations, Boltzmann transport theory, and machine learning…

材料科学 · 物理学 2026-02-27 Ruihao Tan , Kaiwang Zhang , Yue-Wen Fang

The experimentally observed order-of-magnitude reduction in the thermal conductivity along the growth axis of (GaAs)_n/(AlAs)_n (or n x n) superlattices is investigated theoretically for (2x2), (3x3) and (6x6) structures using an accurate…

材料科学 · 物理学 2009-10-31 W. E. Bies , R. J. Radtke , H. Ehrenreich

Phonon transport of recently-fabricated $\mathrm{Na_2He}$ at high pressure is investigated from a combination of first-principles calculations and the linearized phonon Boltzmann equation within the single-mode relaxation time approximation…

材料科学 · 物理学 2017-05-24 San-Dong Guo , Ai-Xia Zhang

Understanding ballistic phonon transport effects in transient thermoreflectance experiments and explaining the observed deviations from classical theory remains a challenge. Diffusion equations are simple and computationally efficient but…

介观与纳米尺度物理 · 物理学 2016-03-23 Jesse Maassen , Mark Lundstrom

Semiconductor superlattices have been extensively investigated for thermoelectric applications, to explore the effects of compositions, interface structures, and lattice strain environments on the reduction of thermal conductivity, and…

材料科学 · 物理学 2021-11-29 Manoj Settipalli , Vitaly S Proshchenko , Sanghamitra Neogi

Diminution of the thermal conductivity is a crucial aspect in thermoelectric research. We report a systematic and significant reduction of the cross-plane thermal conductivity in a model system consisting of DC sputtered TiNiSn and HfNiSn…

We demonstrate the coherent transport of thermal energy in superlattices by introducing a microscopic definition of the phonon coherence length. We demonstrate how to distinguish a coherent transport regime from diffuse interface scattering…

介观与纳米尺度物理 · 物理学 2014-09-09 Benoit Latour , Sebastian Volz , Yann Chalopin

We systematically demonstrate the temperature-dependent thermal transport properties in crystalline Ge$_2$Sb$_2$Te$_5$via first-principles density functional theory-informed linearized Boltzmann transport equation. The investigation,…

材料科学 · 物理学 2023-12-18 Kanka Ghosh , Andrzej Kusiak , Jean-Luc Battaglia

Nanostructured materials exhibit low thermal conductivity because of the additional scattering due to phonon-boundary interactions. As these interactions are highly sensitive to the mean free path (MFP) of a given phonon mode, MFP…

材料科学 · 物理学 2016-01-13 Giuseppe Romano , Keivan Esfarjani , David A. Strubbe , David Broido , Alexie M. Kolpak

Suitably superimposed grey-medium solutions of the Boltzmann transport equation (BTE) provide a simple yet accurate description of non-grey quasiballistic heat conduction in transient thermal grating experiments. Recent applications of…

介观与纳米尺度物理 · 物理学 2016-08-22 Bjorn Vermeersch , Ali Shakouri

We develop a computational framework, based on the Boltzmann transport equation, with the ability to compute the thermal transport in nanostructured materials of any geometry using as the only input the bulk thermal conductivity…

介观与纳米尺度物理 · 物理学 2014-10-20 Giuseppe Romano , Jeffrey C. Grossman

The mechanism of heat transfer and the contribution of electron-phonon coupling to thermal conductance of a metal-semiconductor interface remains unclear in the present literature. We report ab initio simulations of a technologically…

材料科学 · 物理学 2015-04-07 Sridhar Sadasivam , Umesh V. Waghmare , Timothy S. Fisher

A first-principles density functional method along with the direct solution of linearized Boltzmann transport equations are employed to systematically analyze the low-temperature thermal transport in crystalline GeTe. The extensive thermal…

材料科学 · 物理学 2020-09-28 Kanka Ghosh , Andrzej Kusiak , Jean-Luc Battaglia
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