A review of simulation methods in micro/nanoscale heat conduction

H Bao, J Chen, X Gu, B Cao - ES Energy & Environment, 2018 - espublisher.com
Significant progress has been made in the past two decades about the micro/nanoscale
heat conduction. Many computational methods have been developed to accommodate the …

Phonon transport in molecular dynamics simulations: formulation and thermal conductivity prediction

AJH McGaughey, M Kaviany - Advances in heat transfer, 2006 - Elsevier
Publisher Summary This chapter discusses the phonon transport in molecular dynamics
(MD) simulations. The chapter presents a formulation for studying the thermal transport in …

Quantitatively analyzing phonon spectral contribution of thermal conductivity based on nonequilibrium molecular dynamics simulations. I. From space Fourier …

Y Zhou, X Zhang, M Hu - Physical Review B, 2015 - APS
Probing detailed spectral dependence of phonon transport properties in bulk materials is
critical to improve the function and performance of structures and devices in a diverse …

Molecular dynamics method for microscale heat transfer

S Maruyama - Advances in Numerical Heat Transfer, Volume 2, 2018 - taylorfrancis.com
Molecular level understandings and treatments have been recognized to be more and more
important in heat and mass transfer research. A new field,“Molecular Thermophysical …

Molecular dynamics simulation of annular flow boiling with the modified Lennard-Jones potential function

DT Semiromi, AR Azimian - Heat and Mass Transfer, 2012 - Springer
Molecular dynamics simulation of annular flow boiling in a nanochannel is numerically
investigated. In this research, an annular flow model is developed to predict the superheated …

Thermal conductivity of interfacial layers in nanofluids

Z Liang, HL Tsai - Physical Review E—Statistical, Nonlinear, and Soft …, 2011 - APS
Thermal conductivity of interfacial layers is an essential parameter for determining how the
ordered liquid layering around the particle-liquid interface contributes to the unusual high …

Thermal conductance enhanced via inelastic phonon transport by atomic vacancies at Cu/Si interfaces

Z Lu, AM Chaka, PV Sushko - Physical Review B, 2020 - APS
Understanding and controlling heat transfer across interfaces has become an important
issue for the performance of micro-and nanoscale electronics, as well as achieving a high …

Contribution of inter-and intramolecular energy transfers to heat conduction in liquids

D Torii, T Nakano, T Ohara - The Journal of chemical physics, 2008 - pubs.aip.org
The molecular dynamics expression of heat flux, originally derived by Irving and Kirkwood [J.
Chem. Phys. 18, 817 (1950)] for pairwise potentials, is generalized in this paper for systems …

[PDF][PDF] Molecular dynamics simulation in nanoscale heat transfer: a review

D Poulikakos, S Arcidiacono, S Maruyama - Microscale Thermophysical …, 2003 - Citeseer
The exponential growth of research activities in nanotechnologies, as well the rapidly
increasing utilization of microscale technologies in societal applications, is affecting directly …

[HTML][HTML] Molecular dynamics study on the effect of surface ionization on the interfacial heat transfer between silica and water

H Sun, D Surblys, S Cheng, T Ohara - Applied Thermal Engineering, 2024 - Elsevier
Understanding the thermal transport across the solid–liquid interface is crucial for the
advancement of modern technology, with particular emphasis on the silica–water interface …