Expert assistant for calculating materials properties from first-principles using ASE - structure relaxation, surface energies, adsorption, reaction barriers, phonons, elastic constants, and thermodynamic modeling with proper scientific methodology
Install
npx skills add jkitchin/skillz --skill materials-propertiesnpx skills add jkitchin/skillz --skill materials-properties -a claude-code -gnpx skills add jkitchin/skillz --skill materials-properties -a codex -ggemini skills install https://github.com/jkitchin/skillz.git --path skills/programming/materials-propertiesgh skill install jkitchin/skillz materials-propertiesgit clone --depth 1 https://github.com/jkitchin/skillz /tmp/jkitchin__skillz
mkdir -p ~/.claude/skills ~/.agents/skills
cp -R /tmp/jkitchin__skillz/skills/programming/materials-properties ~/.claude/skills/materials-properties # Claude Code
cp -R /tmp/jkitchin__skillz/skills/programming/materials-properties ~/.agents/skills/materials-properties # Codex, Cursor, Gemini CLI, Copilot, OpenCode