Explore projects

SPEX documentation

Electron Microscopy Python Reconstruction, developed at the PGI-5 / ER-C - https://empyre.iffgit.fz-juelich.de/empyre/

Electron Microscopy Python Reconstruction, developed at the PGI-5 / ER-C - https://empyre.iffgit.fz-juelich.de/empyre/

Nodes to be shared in IAS-1

Workthrough of aiida-kkr tutorials at https://aiida-kkr.readthedocs.io

UNIFIT is a highly flexible program for fitting theories to experimental data.

Python script that reads a metadata text file, creates a SampleDB entry, and uploads files if desired.

aiida-kkr-ml: Development of a surrogate machine learning model for the acceleration of density functional calculations with the Korringa-Kohn-Rostoker method

Repository containing utilities for creating documentations.

Electron Microscopy Python Reconstruction, developed at the PGI-5 / ER-C - https://empyre.iffgit.fz-juelich.de/empyre/

Literature review on machine learning density functional theory (ML-DFT) and related topics

This are the Torch models from CAM originated from Giacomo Pedretti

Electron transport calculation code based on the real-space finite-difference formalism within the framework of the density functional theory