HomeAI & Machine LearningAI Discovery of Materials: GNN Crystal Stability Explorer

🔬 AI Discovery of Materials: GNN Crystal Stability Explorer

Explore how graph neural networks screen candidate crystal structures for stability. Pick a crystal family, dope it with substitutional defects, and watch simulated GNN message-passing propagate through the bond network to predict formation energy and stability.

AI & Machine Learning3DAdvanced60 FPS
ai-discovery-of-materials-gnn-crystal-stability-explorer ↗ Open standalone
⚙ Under the hood

Explore how graph neural networks screen candidate crystal structures for stability. Pick a crystal family, dope it with substitutional defects, and watch simulated GNN message-passing propagate through the bond network to predict formation energy and stability.

Three.jsAIGNNmaterials discoverycrystal structureInstancedMesh

3D · Three.js / WebGL renderer · 60 FPS target · runs fully client-side, no install

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