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Simulating warm dense matter that undergoes a wide range of temperatures and densities is challenging. Predictive theoretical models, such as quantum-mechanics-based first-principles molecular dynamics (FPMD), require a huge amount of…

Computational Physics · Physics 2019-09-04 Yuzhi Zhang , Chang Gao , Linfeng Zhang , Han Wang , Mohan Chen

Asymmetric heat transfer systems, often referred to as thermal diodes or thermal rectifiers, have garnered increasing interest due to their wide range of application possibilities. Most of those previous macroscopic thermal diodes either…

Applied Physics · Physics 2022-09-09 Yishu Su , Ying Li , Minghong Qi , Sebastien Guenneau , Huagen Li , Jian Xiong

A numerical modeling study based on 3D finite element method (FEM) simulation and 1D analytical solutions has been carried out to evaluate the capabilities of two ac methods for measuring in-plane thermal conductivity of thin film deposited…

Applied Physics · Physics 2020-12-22 Hanfu Wang , Yanjun Guo , Kaiwu Peng , Weiguo Chu , Guangming Chen

The vast amount of computational studies on electrical conduction in solid-state electrolytes is not mirrored by comparable efforts addressing thermal conduction, which has been scarcely investigated despite its relevance to thermal…

Materials Science · Physics 2024-06-18 Davide Tisi , Federico Grasselli , Lorenzo Gigli , Michele Ceriotti

As power electronics shrinks down to sub-micron scale, the thermal transport from a solid surface to environment becomes significant. Under circumstances when the device works in rare gas environment, the scale for thermal transport is…

Applied Physics · Physics 2018-05-23 Jianshu Gao , Yanan Yue , Danmei Xie , Yangheng Xiong

With the popularity of electric vehicles, the demand for lithium-ion batteries is increasing. Temperature significantly influences the performance and safety of batteries. Battery thermal management systems can effectively control the…

Machine Learning · Computer Science 2026-01-07 Zheng Liu , Yuan Jiang , Yumeng Li , Pingfeng Wang

Control of transport processes in composite microstructures is critical to the development of high performance functional materials for a variety of energy storage applications. The fundamental process of conduction and its control through…

Soft Condensed Matter · Physics 2014-11-03 Kyle C. Smith , Timothy S. Fisher

There has been much interest in semiconductor superlattices because of showing very low thermal conductivities. This makes them especially suitable for applications in a variety of devices for thermoelectric generation of energy, heat…

Statistical Mechanics · Physics 2020-02-06 Federico Vázquez , Péter Ván , Róbert Kovács

First-principles molecular dynamics simulation based on a plane wave/pseudopotential implementation of density functional theory is adopted to investigate atomic scale energy transport for semiconductors (silicon and germanium). By imposing…

Computational Physics · Physics 2016-02-02 Pengfei Ji , Yuwen Zhang

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…

Heat dissipation is a very critical problem for designing nano-functional devices, including MoS2/Graphene heterojunctions. In this paper we investigate thermal transport in MoS2/Graphene hybrid nanosheets under various heating conditions,…

Mesoscale and Nanoscale Physics · Physics 2015-10-20 Zhongwei Zhang , Yuee Xie , Qing Peng , Yuanping Chen

We studied the phononic heat transfer through an atomic dielectric wire with both infinite and finite lengths by using a model Hamiltonian approach. At low temperature under ballistic transport, the thermal conductance contributed by each…

Condensed Matter · Physics 2009-10-31 A. Buldum , S. Ciraci , C. Y. Fong

Thermal transport properties of amorphous carbon has attracted increasing attention due to its extreme thermal properties: It has been reported to have among the highest thermal conductivity for bulk amorphous solids up to $\sim$ 37…

Disordered Systems and Neural Networks · Physics 2024-05-14 Jaeyun Moon , Zhiting Tian

The packing behavior of powders is significantly influenced by various types of inter-particle attractive forces, including adhesion and non-bonded van der Waals forces [1, 2, 3, 4, 5, 6]. Alongside particle size and shape distributions,…

Finite-temperature calculations are relevant for rationalizing material properties yet they are computationally expensive because large system sizes or long simulation times are typically required. Circumventing the need for performing many…

The dust emission spectrum and the brightness profile of passively heated condensed cores is analyzed in relation to their astrophysical environment. The cores are modeled as critically stable self-gravitating spheres embedded at the center…

Astrophysics of Galaxies · Physics 2010-11-16 Joerg Fischera

We explore the possibility to perform an in-situ transmission electron microscopy (TEM) thermoelectric characterization of materials. A differential heating element on a custom in-situ TEM microchip allows to generate a temperature gradient…

Materials Science · Physics 2025-01-14 Simon Hettler , Mohammad Furqan , Andres Sotelo , Raul Arenal

Ever since the discovery of the record-high thermal conductivity of single layer graphene, thermal transport capability of monolayer 2D materials has been under constant spotlight. Since thermal conductivity is an intensive property for 3D…

Materials Science · Physics 2017-02-01 Xufei Wu , Vikas Varshney , Jonghoon Lee , Yunsong Pang , Ajit K. Roy , Tengfei Luo

We present a model which deepens into the role that normal scattering has on the thermal conductivity in semiconductor bulk, micro and nanoscale samples. Thermal conductivity as a function of the temperature undergoes a smooth transition…

Mesoscale and Nanoscale Physics · Physics 2015-06-17 C. de Tomas , A. Cantarero , A. F. Lopeandia , F. X. Alvarez

Development of algorithms and growth of computational resources in the past decades have enabled simulations of sediment transport processes with unprecedented fidelities. The Computational Fluid Dynamics--Discrete Element Method (CFD--DEM)…

Computational Physics · Physics 2017-09-13 Rui Sun , Heng Xiao
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