Pymatgen (https://pymatgen.org/) IO plugin for the LAPW code FLEUR (www.flapw.de)
-
Updated
Nov 4, 2024 - Python
#
fleur
Here are 13 public repositories matching this topic...
This repository contains different tutorials for various juDFT codes
-
Updated
Nov 28, 2024 - Jupyter Notebook
Materials Simulation Environment
materials dft simulation vasp aiida quantum-espresso fleur ase aiida-fleur aiida-kkr spex pymatgen aiida-spex
-
Updated
Jul 7, 2020 - JavaScript
Improve this page
Add a description, image, and links to the fleur topic page so that developers can more easily learn about it.
Add this topic to your repo
To associate your repository with the fleur topic, visit your repo's landing page and select "manage topics."