Powder Diffraction Python Packages

xrd-rust

Fast XRD pattern calculator with Rust acceleration (5-10x faster than original pymatgen implementation)

xylib-py-wheels

library for reading files with x-y data from powder diffraction, spectroscopy, or other experimental methods

xylib-py

Python bindings to xylib

xrdpattern

Python library for XrdPatterns including file import, file export and postprocessing functionalities

topas-tools

Set of scripts for working with Topas

xpdlines

A program for plotting powder diffraction patterns and background subtraction