home/categories/scientific-computing/scimate-ai-hpc-skills-skills-hpc-lammps-skill-md
scientific-computingresearch

hpc-lammps

Generate, review, debug, and recover LAMMPS molecular dynamics input scripts. Use when working with LAMMPS command ordering, data files, force fields, ensembles, neighbor settings, thermo output, or common runtime errors such as lost atoms and non-numeric pressure.

SciMate-AI
maintainer
SciMate-AI
更新於 3/16/2026
星標
29
分支
4
quick start

Installation and usage

Generate, review, debug, and recover LAMMPS molecular dynamics input scripts. Use when working with LAMMPS command ordering, data files, force fields, ensembles, neighbor settings, thermo output, or common runtime errors such as lost atoms and non-numeric pressure.

安裝
$ install --globalskills.sh
使用

安裝後,您可以透過在終端機執行以下指令來使用此技能:

skills use hpc-lammps