xrd
DARA: Data-driven Automated Rietveld Analysis for powder XRD phase search and refinement
Coherent Diffraction Imaging Simulation Tools — BCDI simulation and NN-based phase retrieval
Calculate XRD patterns based on XRDCalculator in pymatgen, but using Rust for certain parts, making it about > 10x faster.
[WPEM / PyWPEM] AI-Driven Structure Refinement of X-ray Diffraction
[ICLR 2025] SimXRD-4M: Big Simulated X-ray Diffraction Data and Crystalline Symmetry Classification Benchmark
A Python package build to analyze powder XRD (and XRD) data. The only known open-source Github project with a Rietveld refinement method in development.
