6 projects
mattergraph
Open-source materials data infrastructure for physics-aware ML and simulation workflows.
mattergraph-connectors
Connectors to public materials databases for MatterGraph.
mattergraph-sim
ASE/LAMMPS/QE simulation job specs and runners (MVP wrappers).
mattergraph-api
FastAPI service for the MatterGraph demo and integrations.
mattergraph-core
Core schema, normalization, and crystal graphs for MatterGraph.
mattergraph-benchmarks
Benchmark adapters and evaluation utilities for MatterGraph.
