activity
20192023
most citedInfluence of Boundaries and Thermostatting on Nonequilibrium Molecular Dynamics Simulations of Heat Conduction in Solids

225 citations · 264 across the 6 of their papers we have counts for

collaborators

6 papers

cond-mat.mes-hall2023★ 3 cited

GiftBTE: An efficient deterministic solver for non-gray phonon Boltzmann transport equation

Yue Hu, Ru Jia, Jiaxuan Xu +5

Advances in nanotechnology have facilitated the exploration of submicron thermal transport. At this scale, Fourier's law is no longer applicable, and the governing equation for the…

physics.comp-ph2021★ 1 cited

Optimized phonon band discretization scheme for efficiently solving the non-gray Boltzmann transport equation

Yue Hu, Yongxing Shen, Hua Bao

Phonon Boltzmann transport equation (BTE) is an important tool for studying the nanoscale thermal transport. Because phonons have a large spread in their properties, the non-gray (…

cond-mat.mes-hall2020★ 34 cited

First-principles based analysis of thermal transport in metallic nanostructures: size effect and Wiedemann-Franz law

Yue Hu, Shouhang Li, Hua Bao

Metallic nanostructures (the nanofilms and nanowires) are widely used in electronic devices, and their thermal transport properties are crucial for heat dissipation. However, there…

cond-mat.mtrl-sci2020★ 1 cited

Anomalous thermal transport in metallic transition-metal nitrides originated from strong electron-phonon interactions

Shouhang Li, Ao Wang, Yue Hu +3

Metallic transition-metal nitrides (TMNs) are promising conductive ceramics for many applications, whose thermal transport is of great importance in device design. It is found meta…

cond-mat.mes-hall2019

A Unified Phonon Interpretation for the Non-Fourier Heat Conduction by Non-equilibrium Molecular Dynamics Simulations

Yue Hu, Xiaokun Gu, Tianli Feng +2

Nanoconfinement induces many intriguing non-Fourier heat conduction phenomena that have been extensively studied in recent years, such as the nonlinear temperature profile inside t…

cond-mat.mes-hall2019★ 225 cited

Influence of Boundaries and Thermostatting on Nonequilibrium Molecular Dynamics Simulations of Heat Conduction in Solids

Zhen Li, Shiyun Xiong, Charles Sievers +7

Nonequilibrium molecular dynamics (NEMD) has been extensively used to study thermal transport at various length scales in many materials. In this method, two local thermostats at d…