scientific-computational-materials
CommunityMaterials science workflows powered by Python.
Authornahisaho
Version1.0.0
Installs0
System Documentation
What problem does it solve?
Automates end-to-end computational materials workflows by enabling crystal-structure generation, symmetry analysis, materials data retrieval via the Materials Project API, phase-diagram calculations, and electronic-structure visualization.
Core Features & Use Cases
- Crystal structure manipulation and symmetry analysis with pymatgen
- Materials Project API queries for properties and phase data
- Phase diagram (convex hull) calculations and stability assessments
- Electronic band structure and density of states visualization
- DFT input/output generation for VASP/QE and automated high-throughput workflows
- High-throughput materials screening pipelines
Quick Start
Run this skill to generate a crystal structure, query Materials Project data, and visualize phase stability for your system.
Dependency Matrix
Required Modules
None requiredComponents
Standard package💻 Claude Code Installation
Recommended: Let Claude install automatically. Simply copy and paste the text below to Claude Code.
Please help me install this Skill: Name: scientific-computational-materials Download link: https://github.com/nahisaho/satori/archive/main.zip#scientific-computational-materials Please download this .zip file, extract it, and install it in the .claude/skills/ directory.
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