Materials Tutorials

Hands-on notebooks for materials informatics and ML.

Featured Tutorials

Transformers for Materials

github.com/lamalab-org/llm-tutorial 

LlamaLab — Tutorials on transformers in chemistry and materials science, from Kevin Jablonka’s blog posts.

matminer Tutorials

hackingmaterials.lbl.gov/matminer 

Feature engineering for materials science with working examples.

Tutorial Directory

Running Tutorials

# Create environment
conda create -n materials python=3.10
conda activate materials
 
# Install core tools
pip install pymatgen matminer ase jupyter pandas scikit-learn
 
# For deep learning
pip install torch