Testing the fourth moment approximation of vibrational mode lifetimes in fcc Lennard-Jonesium
Author:
Funder
Basic Energy Sciences
Publisher
IOP Publishing
Subject
Computer Science Applications,Mechanics of Materials,Condensed Matter Physics,General Materials Science,Modelling and Simulation
Link
http://stacks.iop.org/0965-0393/22/i=7/a=075011/pdf
Reference13 articles.
1. Improved calculation of vibrational mode lifetimes in anharmonic solids—Part I: Theory
2. Improved calculation of vibrational mode lifetimes in anharmonic solids – Part II: Numerical results
3. Improved calculation of vibrational mode lifetimes in anharmonic solids – Part III: Extension to fourth moment
4. Fast Parallel Algorithms for Short-Range Molecular Dynamics
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1. Calculation of mode lifetimes in weakly anharmonic solids using self-consistent ensemble eigenstates of the Liouvillian;Computational Materials Science;2020-12
2. First-principles electronic structure in second-moment calculation of mode frequencies: Failure of quasiharmonic approximation in silicon;Physical Review B;2019-12-27
3. Calculations of lattice vibrational mode lifetimes using Jazz: a Python wrapper for LAMMPS;Modelling and Simulation in Materials Science and Engineering;2015-04-02
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