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scientific-computingresearch
pymatgen-materials
Use this Skill for materials science with pymatgen: crystal structure manipulation, Materials Project API queries (bandgap, DOS, formation energy), phase diagrams, and symmetry analysis.
maintainer
xjtulyc
更新于 3/17/2026
星标
20
分支
5
quick start
Installation and usage
Use this Skill for materials science with pymatgen: crystal structure manipulation, Materials Project API queries (bandgap, DOS, formation energy), phase diagrams, and symmetry analysis.
安装
$ install --globalskills.sh
使用
安装后，您可以通过在终端运行以下命令来使用此技能：
skills use pymatgen-materials