Analyze crystal structures and materials
pymatgenskillsetup L2★27,559
K-Dense-AI/scientific-agent-skills ↗What it does
Materials science toolkit. Crystal structures (CIF, POSCAR), phase diagrams, band structure, DOS, Ma
Best for
Using pymatgen when it is the specialized tool
Inputs
- · Gene/disease/drug identifier
- · Crystal structure (CIF)
Outputs
- · .pptx file
- · Graph relationships
- · Visual narrative
- · Material properties
Requires
- · Python
Preconditions
- · API credentials
- · Database connection
Trust signals
- · Open-source licensed
- · From established skill repo
- · Includes examples
- · Versioned/documented
- · Includes best practices
- · Practical patterns