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Reproduction of results from https://doi.org/10.1021/acs.chemrev.1c00022

Repository containing utilities for creating documentations.

Repository containing utilities for creating documentations.

Project outline for HDS-LEE monitoring process, October 2022.

Python-based command line tool with Fortran routines for global optimization of atomistic arrangement problems by Couolmb energy.

This git repository contains the source of the FLEUR-webpage.

https://iffmd.fz-juelich.de/RhXA4J_JTwebjYKG35TbuQ#

Development backyard for project atomlflow on GitHub. Mainly notes.

A collection of some useful Fortran modules on general purposes. Implementation of some common datastructures and algorithms, tools for common tasks, that kind of stuff.

Convert Fortran modules to C-headers. Taken over from https://github.com/sharifmarat/fortran_to_c_headers

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

JSC Course "Getting started with AI on supercomputers", synonyms "Bringing Deep Learning Workloads to JSC supercomputers", "Introduction to AI on supercomputers", "Getting started with deep learning on supercomputers", student wasmer, participation notes.