home/categories/astronomy-physics/godjh1n-gpumd-skill-molecular-dynamics-gpumd-phonon-skill-md
astronomy-physicsresearch

phonon

Prepare GPUMD harmonic phonon-dispersion calculations using `compute_phonon`, `kpoints.in`, and supercell replication. Use when the user needs harmonic phonons, `omega2.out`, `D.out`, phonon DOS, or a GPUMD-based starting point for lattice-dynamics analysis.

GodJh1n
maintainer
GodJh1n
Updated 4/10/2026
Stars
3
Forks
0
quick start

Installation and usage

Prepare GPUMD harmonic phonon-dispersion calculations using `compute_phonon`, `kpoints.in`, and supercell replication. Use when the user needs harmonic phonons, `omega2.out`, `D.out`, phonon DOS, or a GPUMD-based starting point for lattice-dynamics analysis.

Installation
$ install --globalskills.sh
Usage

Once installed, you can use this skill by running the following command in your terminal:

skills use phonon