Rhys Goodall

aviary. The Wren sits on its Roost in the Aviary.

roost. Representation Learning from Stoichiometry

EleMD. A minimal implementation of the Element-Movers-Distance using modular libraries.

ornstein-zernike. Machine Learning to infer improved closure relationships for the Ornstein-Zernike equation

go-md. Simple Molecular Dynamics in Go

apical. Investigation of structural dependencies of cuprates on the apical and in-plane distances

espresso. The ESPResSo package

CompRhys.

pymatgen. Python Materials Genomics (pymatgen) is a robust materials analysis code that defines classes for structures and molecules with support for many electronic structure codes. It powers the Materials Project.