DOE PAGES title logo U.S. Department of Energy
Office of Scientific and Technical Information

Title: Exact diagonal representation of normal mode energy, occupation number, and heat current for phonon-dominated thermal transport

Journal Article · · Journal of Chemical Physics
DOI: https://doi.org/10.1063/1.5099936 · OSTI ID:1562132

Sponsoring Organization:
USDOE
OSTI ID:
1562132
Journal Information:
Journal of Chemical Physics, Journal Name: Journal of Chemical Physics Vol. 151 Journal Issue: 10; ISSN 0021-9606
Publisher:
American Institute of PhysicsCopyright Statement
Country of Publication:
United States
Language:
English

References (30)

Phonon dispersion using the ratio of zero-time correlations among conjugate variables: Computing full phonon dispersion surface of graphene journal May 2019
Quantitatively analyzing phonon spectral contribution of thermal conductivity based on nonequilibrium molecular dynamics simulations. I. From space Fourier transform journal November 2015
Quantitatively analyzing phonon spectral contribution of thermal conductivity based on nonequilibrium molecular dynamics simulations. II. From time Fourier transform journal November 2015
Dynamics of Phononic Materials and Structures: Historical Origins, Recent Progress, and Future Outlook journal May 2014
Introduction to Lattice Dynamics book February 2010
Approach to local thermodynamic equilibrium and the evolution to a glassy core following neutron/ion radiation impact journal August 2018
Deducing Phonon Scattering from Normal Mode Excitations journal May 2019
Beyond the Maxwell limit: Thermal conduction in nanofluids with percolating fluid structures journal December 2007
Molecular Dynamics Simulation on Longitudinal Optical Phonon Mode Decay and Heat Transport in a Silicon Nano-Structure Covered with Oxide Films journal January 2011
Approaching the strongly anharmonic limit with ab initio calculations of materials’ vibrational properties – a colloquium* journal November 2016
Sound and heat revolutions in phononics journal November 2013
Anharmonicity and necessity of phonon eigenvectors in the phonon normal mode analysis journal May 2015
Nonequilibrium phonon mean free paths in anharmonic chains journal December 2015
Molecular dynamics study of relaxons in the Fermi-Pasta-Ulam- β model journal June 2018
Nanoscale thermal transport. II. 2003–2012 journal March 2014
Vibrational mean free paths and thermal conductivity of amorphous silicon from non-equilibrium molecular dynamics simulations journal December 2016
A simple nonequilibrium molecular dynamics method for calculating the thermal conductivity journal April 1997
Mechanism of Thermal Transport in Dilute Nanocolloids journal January 2007
Cross-correlations between phonon modes in anharmonic oscillator chains: Role in heat transport journal April 2014
On the importance of collective excitations for thermal transport in graphene journal May 2015
Nonuniversal heat conduction of one-dimensional lattices journal February 2012
Spectral Phonon Transport Properties of Silicon Based on Molecular Dynamics Simulations and Lattice Dynamics journal February 2008
Removing artificial Kapitza effects from bulk thermal conductivity calculations in direct molecular dynamics journal May 2015
The Art of Molecular Dynamics Simulation book January 2004
Colloquium : Phononics: Manipulating heat flow with electronic analogs and beyond journal July 2012
Non-negligible Contributions to Thermal Conductivity From Localized Modes in Amorphous Silicon Dioxide journal October 2016
Lattice thermal conductivity: A comparison of molecular dynamics and anharmonic lattice dynamics journal October 1986
Atomistic Modeling of Short Pulse Laser Ablation of Metals: Connections between Melting, Spallation, and Phase Explosion journal May 2009
A microscopic formulation of the phonon transmission at the nanoscale journal July 2013
Prediction of Spectral Phonon Mean Free Path and Thermal Conductivity with Applications to Thermoelectrics and Thermal Management: A Review journal January 2014

Related Subjects