materials-properties

Expert assistant for calculating materials properties from first-principles using ASE - structure relaxation, surface energies, adsorption, reaction barriers, phonons, elastic constants, and thermodyn

by jkitchin· Repository·design

Run in AgentArea Browse All Skills

Also installable via skills CLI

npx skills add jkitchin/skillz/design/materials-properties

Source

Repo:SkillsMP + GitHub Raw

Path:design/materials-properties(main)

Related in design

add-uint-support

Add unsigned integer (uint) type support to PyTorch operators by updating AT_DISPATCH macros. Use when adding support for uint16,...

skill-writer

Guide users through creating Agent Skills for Claude Code. Use when the user wants to create, write, author, or design a new Skill...

frontend-design

Create distinctive, production-grade frontend interfaces with high design quality. Use this skill when the user asks to build web...