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license: apache-2.0
tags:
- materials-science
- deep-learning
- crystal-structure
- chemistry
---
# 🔬 MatGraph CLI
A modern CLI and GraphQL API tool for Material Science Deep Learning Pipelines.
**Powered by M3GNet Universal Potentials**
This repository contains the Gradio Space logic and documentation for `matgraph-cli`.
## 🚀 Installation
```bash
pip install matgraph-cli
```
## 🛠 Features
- Predict Thermodynamic Stability (M3GNet)
- Structural Relaxation & Geometry Optimization (ASE)
- Generative Discovery via Elemental Substitution
- X-Ray Diffraction (XRD) Simulation
- Phonon Density of States (DOS)
- High-Performance GraphQL Server
## 🔗 Links
- [GitHub Repository](https://github.com/Himan-D/matgraph-cli)
- [PyPI Package](https://pypi.org/project/matgraph-cli/)
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