exafs

[WPEM / PyWPEM] AI-Driven Structure Refinement of X-ray Diffraction

Analysis of EXAFS Spectra using AI

Fast Rust implementation of core xraylarch workflows for large XAS/XAFS datasets.

EstraPy is a synchrotron analysis tool, built in Python 3.

An open-source Python GUI for processing, analyzing, and fitting X-ray Absorption Spectroscopy (XAS/EXAFS) data. It serves as an interactive frontend for Larch and FEFF8.

DeepONets for interpreting x-ray spectra by converting XANES to EXAFS

EXAFS fitting using neural networks and PyTorch.

Rust wrapper for FEFF10 X-ray absorption and electronic structure calculations.

Python code to simulate the output of an EXAFS ( Extended X-ray Absorption Fine Structure Spectroscopy) Experiment

DecomNano is a heterogeneity analysis of bimetallic nanoparticles using coordination numbers obtained from XAS analysis.

MCP server wrapping FDMNES (X-ray spectroscopy ab-initio code) for natural-language workflows in Claude Code, Claude Desktop, Codex, and other MCP clients

Python wrapper for simplifying XAS analysis workflows.

Personal academic website of Liam T. Schmidt — PhD candidate in condensed matter physics at Northeastern University (altermagnetism, RIXS, XMCD, EXAFS).