Nature

X-ray diffraction articles from across Nature Portfolio

X-ray crystallography is a technique used to reveal how the atoms of crystalline solids are arranged, relying upon the diffraction of X-ray radiation by the periodic atomic structure. Its continual ...
Drexel University

X-Ray Diffraction Tools

Provides a complete range of structural measurements including powder diffraction, thin film metrology including thin-film method, preferred orientation, crystal quality, reflectometry and grazing ...
GitHub

Pointlist Encoder - Attention Graph - Graphormer Mixture of Experts (PE-AG-GMoE) that predicts both crystal systems and space groups directly from electron diffraction point lists.

OVERVIEW This repository contains PyTorch Lightning code for training and evaluating the PE-AG-GMoE model. It supports single- and multi-GPU runs (DDP), gradient accumulation and automatic ...