Explore projects

All-electron FLAPW DFT code FLEUR developed at IAS-1@FZJ.

Single crystal diffraction data reduction - work in progress. Formerly NSXTool.

(Submodule of main) PhD project, public notes.

Literature review on ML-enabled DFT for AI meeting

PhD project notes.

Docker Images for building GR on various platforms.

Docker Images for building GR on various platforms.

Workshop held at the HDS-LEE Retreat 2023, https://www.hds-lee.de/events/hds-lee-retreat-2023/. Mirrors: https://jugit.fz-juelich.de/hds-lee/2023-retreat/workshop-get-started-with-mlops, https://codebase.helmholtz.cloud/hds-lee/2023-retreat/workshop-get-started-with-mlops.

The Jülich KKR codes containing: voronoi construction, bulk crystals and interfaces, impurities, magnetic susceptibilities, Fermi surface, impurity scattering, Boltzmann transport

Counting statistics and fractionalization (notes)

This are the Torch models from CAM originated from Giacomo Pedretti

Counting statistics and fractionalization