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.
maintainer
GodJh1n
Обновлено 4/10/2026
Звёзды
3
Форки
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.
Установка
$ install --globalskills.sh
Использование
После установки вы можете использовать этот skill, выполнив следующую команду в терминале:
skills use phonon