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Development backyard for project atomlflow on GitHub. Mainly notes.

Course HDSLEE Introduction and Fundamentals of Machine Learning

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

McStas representation for the bispectral direct geometry chopper instrument T-REX at the European Spallation Source ESS in Lund, Sweden

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

Master thesis "Development of a surrogate machine learning model for the acceleration of density functional calculations with the Korringa-Kohn-Rostoker method". 2021.

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

Reproduction of results from https://doi.org/10.1002/qua.24954

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

Counting statistics and fractionalization

Poster for Psi-k 2022 conference