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Computationally efficient modeling of the thermal conductivity of materials is crucial to thorough experimental planning and theoretical understanding of thermal properties. We present a modeling approach in this work that utilizes…

Mesoscale and Nanoscale Physics · Physics 2017-09-28 Long Chen , Jeffrey L. Braun , Brian F. Donovan , Patrick E. Hopkins , S. Joseph Poon

In this paper, a multilayer thermal infrared detector model has been achieved by finite element method (FEM). All contributions of the thermal conductance were taken into account and calculated. In order to maximize the detector response,…

Applied Physics · Physics 2017-12-08 P. Ramos , A. Andrés , A. López , A. Manzanares

The mechanisms causing the reduction in lattice thermal conductivity in highly P- and B-doped Si are looked into in detail. Scattering rates of phonons by point defects, as well as by electrons, are calculated from first principles. Lattice…

Materials Science · Physics 2019-10-02 Bonny Dongre , Jesús Carrete , Shihao Wen , Jinlong Ma , Wu Li , Natalio Mingo , Georg K. H. Madsen

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

High entropy carbides ceramics with randomly-distributed multiple principal cations have shown high temperature stability, low thermal conductivity, and possible radiation tolerance. While chemical disorder has been shown to suppress…

Materials Science · Physics 2022-05-23 Cody A. Dennett , Zilong Hua , Eric Lang , Fei Wang , Bai Cui

Declining the lattice thermal conductivity in graphene is essential for its thermoelectric applications. In high electron density systems, scatterings of phonons by electrons are no less than the phonon scatterings by other phonons. With…

Materials Science · Physics 2019-08-08 Ajit Jena , Wu Li

mDCThermalC is a program written in Python for computing lattice thermal conductivity of crystalline bulk materials using the modified Debye-Callaway model. Building upon the traditional Debye-Callaway theory, the modified model obtains the…

Materials Science · Physics 2024-05-07 Tao Fan , Artem R. Oganov

An easy to implement and powerful method for the solution of 3D scattering problems that can be well described by Helmholtz equation is presented. The matrix algebra used provides excellent stability versus the number of junctions as well…

Mesoscale and Nanoscale Physics · Physics 2007-05-23 J. A. Torres , J. J. Saenz

Lattice thermal conductivity (LTC) is a critical parameter for thermal transport properties, playing a pivotal role in advancing thermoelectric materials and thermal management technologies. Traditional computational methods, such as…

Materials Science · Physics 2025-09-22 Yuxuan Zeng , Wei Cao , Yijing Zuo , Tan Peng , Yue Hou , Ling Miao , Ziyu Wang , Jing Shi

As the energy problem becomes more prominent, researches on thermoelectric (TE) materials have deepened over the past few decades. Low thermal conductivity enables thermoelectric materials better thermal conversion performance. In this…

Materials Science · Physics 2021-09-20 Yingtao Wang , Xian Zhang

In the work, a modified effective medium theory is constructed for calculating the effective properties of thermoelectric composites with different values of percolation thresholds. It is shown that even at concentrations beyond the…

Materials Science · Physics 2020-06-23 Snarskii Andrei , Yuskevich Pavel

Medium and high entropy ceramics, with their distinctive disordered structures, exhibit ultra-low thermal conductivity and high temperature stability. These properties make them strong contenders for next generation thermal barrier coating…

Materials Science · Physics 2024-05-27 Yuxuan Wang , Guoqiang Lan , Jun Song

Recent experimental observations of anisotropic conductivity in stretched polymer electrolytes films of the polyethylene oxide family are discussed. The main experimental observations, enhancement of the ionic diffusion and conductivity in…

Soft Condensed Matter · Physics 2007-05-23 Oliver Duerr , Wolfgang Dieterich , Philipp Maas , Abraham Nitzan

Based on the Debye-Callaway and the Klemens model, as well as molecular dynamics, the paper proposes mechanism of thermal conductivity reduction by embedding dense 60{\deg} shuffle-set dislocation arrays into silicon nano-films. Thermal…

Mesoscale and Nanoscale Physics · Physics 2016-07-12 Zhimin Jiang , Haisheng Fang , Zhenya Lv , Xiangang Luo , Lili Zheng

The development of four-dimensional (4D) scanning transmission electron microscopy (STEM) using fast detectors has opened-up new avenues for addressing some of long-standing challenges in electron imaging. One of these challenges is how to…

Materials Science · Physics 2021-01-19 Yu-Tsun Shao , Renliang Yuan , Haw-Wen Hsiao , Qun Yang , Yang Hu , Jian-Min Zuo

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

Utilizing the approach recently proposed for the $\ell N$ inclusive scattering cross section on the lattice, we compute the differential scattering cross section for the charged current process $\ell p \rightarrow \nu n $ for various…

High Energy Physics - Lattice · Physics 2022-06-02 Jun-Sik Yoo , Shoji Hashimoto , Hiroshi Ohki

We describe a technique to derive constraints on the differential emission measure (DEM) distribution, a measure of the temperature distribution, of collisionally ionized hot plasmas from their X-ray emission line spectra. This technique…

Astrophysics · Physics 2009-11-10 Patrick S. Wojdowski , Norbert S. Schulz

In this paper we consider scattering resonance computations in optics when the resonators consist of frequency dependent and lossy materials, such as metals at optical frequencies. The proposed computational approach combines a novel…

Numerical Analysis · Mathematics 2020-12-24 Juan C. Araujo-Cabarcas , Carmen Campos , Christian Engström , Jose E. Roman

The thermal conductance by phonons of a quasi-one-dimensional solid with isotope or defect scattering is studied using the Landauer formalism for thermal transport. The conductance shows a crossover from localized to Ohmic behavior, just as…

Disordered Systems and Neural Networks · Physics 2009-11-13 P. G. Murphy , J. E. Moore