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We calculate the thermal conductivity of free-standing silicene using the phonon Boltzmann transport equation within the relaxation time approximation. In this calculation, we investigate the effects of sample size and different scattering…

Mesoscale and Nanoscale Physics · Physics 2018-04-18 M. Barati , T. Vazifehshenas , T. Salavati-fard , M. Farmanbar

Quantum transport in disordered systems is studied using a polaron-based master equation. The polaron approach is capable of bridging the results from the coherent band-like transport regime governed by the Redfield equation to incoherent…

Mesoscale and Nanoscale Physics · Physics 2016-05-11 Chee Kong Lee , Jeremy Moix , Jianshu Cao

Alloys based on lanthanum phosphate (LaPO$_{4}$) are often employed as thermal barrier coatings, due to their low thermal conductivity and structural stability over a wide temperature range. To enhance the thermal-insulation performance of…

Materials Science · Physics 2024-07-02 Anees Pazhedath , Lorenzo Bastonero , Nicola Marzari , Michele Simoncelli

Phonon modes and their dispersion relations in ultrathin homogenous dielectric membranes are calculated using elasticity theory. The approach differs from the previous ones by a rigorous account of the effect of the film surfaces on the…

Mesoscale and Nanoscale Physics · Physics 2007-05-23 T. Kühn , D. V. Anghel , J. P. Pekola , M. Manninen , Y. M Galperin

The effect of electron-phonon scattering processes over the thermoelectric properties of extrinsic graphene was studied. Electrical and thermal resistivity, as well as the thermopower, were calculated within the Bloch theory approximations.…

Mesoscale and Nanoscale Physics · Physics 2012-08-02 Enrique Muñoz

A Full Band Monte Carlo simulator has been developed to consider phonon transmission across interfaces that are perpendicular to the heat flux. This solver of the Boltzmann transport equation which does not require any assumption on the…

Applied Physics · Physics 2022-05-06 N. D. Le , B. Davier , N. Izitounene , P. Dollfus , J. Saint-Martin

Although extensive experimental and theoretical works have been conducted to understand the ballistic and diffusive phonon transport in nanomaterials recently, direct observation of temperature and thermal nonequilibrium of different phonon…

Mesoscale and Nanoscale Physics · Physics 2017-05-17 Tianli Feng , Wenjun Yao , Zuyuan Wang , Jingjing Shi , Chuang Li , Bingyang Cao , Xiulin Ruan

In this article, we address lattice heat transport in single-walled carbon nanotubes (CNTs) by a quantum mechanical calculation of three-phonon scattering rates in the framework of the Boltzmann transport equation (BTE) and classical…

Mesoscale and Nanoscale Physics · Physics 2020-05-06 Daniel Bruns , Alireza Nojeh , A. Srikantha Phani , Jörg Rottler

We describe the electro-thermal transport in metallic carbon nanotubes (m-CNTs) by a semi-classical approach that takes into account the high-field dynamical interdependence between charge carrier and phonon populations. Our model is based…

Mesoscale and Nanoscale Physics · Physics 2015-05-13 Marcelo A. Kuroda , Jean Pierre Leburton

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…

Mesoscale and Nanoscale Physics · Physics 2016-08-22 Bjorn Vermeersch , Ali Shakouri

We study thermalization and thermal transport in single crystals of CsV$_3$Sb$_5$ through the CDW transition by directly measuring thermal diffusivity ($D$), thermal conductivity ($\kappa$), resistivity ($\rho$), and specific heat ($c$).…

Boltzmann transport calculations based on band structures generated with density functional theory (DFT) are often used in the discovery and analysis of thermoelectric materials. In standard implementations, such calculations require dense…

Materials Science · Physics 2018-07-04 Kristian Berland , Clas Persson

The hydrodynamic phonon transport was studied several decades ago for verifying the quantum theory of lattice thermal transport. Recent prediction of significant hydrodynamic phonon transport in graphitic materials shows its practical…

Mesoscale and Nanoscale Physics · Physics 2019-03-15 Sangyeop Lee , Xun Li

This paper studies thermal transport in nanoporous silicon with a significant specific surface area. First, the equilibrium molecular dynamics approach was used to obtain the dependence of thermal conductivity on a specific surface area.…

Mesoscale and Nanoscale Physics · Physics 2023-05-15 Mykola Isaiev , Yuliia Mankovska , Vasyl Kuryliuk , David Lacroix

We present systematic thermal conductivity measurements of suspended thin graphite ribbons, 234-527 nm thick, using a four-probe 3-omega method. Unlike recent reports of phonon hydrodynamics and exceptionally high thermal conductivity in…

Mesoscale and Nanoscale Physics · Physics 2025-09-16 Wonjae Jeon , Yu Pei , Xun Li , Lucas Lindsay , Sangyeop Lee , Renkun Chen

We introduce the concept of transport waves by showing that the linearized Boltzmann transport equation admits excitations in the form of waves that have well defined dispersion relations and decay times. Crucially, these waves do not…

Materials Science · Physics 2017-10-04 Andrea Cepellotti , Nicola Marzari

Discovering new materials with ultrahigh thermal conductivity has been a critical research frontier and driven by many important technological applications ranging from thermal management to energy science. Here we have rigorously…

Materials Science · Physics 2021-04-19 Huan Wu , Hang Fan , Yongjie Hu

We investigate the semiclassical electronic transport properties of the bilayer silicene-like system in the presence of charged impurity. The trigonal warping due to the interlayer hopping, and its effect to the band structure of bilayer…

Mesoscale and Nanoscale Physics · Physics 2018-09-18 Chen-Huan Wu

We propose a method to engineer the phonon thermal transport properties of low dimensional systems. The method relies on introducing a predetermined combination of molecular adsorbates, which give rise to antiresonances at frequencies…

Mesoscale and Nanoscale Physics · Physics 2018-10-02 Koray Sevim , Hâldun Sevinçli

We present a study of the phononic thermal conductivity of isotopically disordered carbon nanotubes. In particular, the behavior of the thermal conductivity as a function of the system length is investigated, using Green's function…

Materials Science · Physics 2008-11-03 Gabriel Stoltz , Michele Lazzeri , Francesco Mauri