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This project comprises all infrastructure related source-code, integrates all necessary parsers and auxiliary projects, and contains the necessary deployment and operation scripts of the current consolidated NOMAD repository and archive.

Open-source Python package for geometric plasma simulations.

Binder-compatible repository for the MPCDF Python for HPC course.

Eigenvalue Solvers for Petaflop Apllications (ELPA), please see elpa.mpcdf.mpg.de

The w7x package is a simulation framework that defines interfaces for simulation codes with interchangeable backends, computation pipelines in a directed acyclic graph that communicate via a central state.

6D backwards semi-Lagrangian Simulations

Kinetic Modeling of Stripes, Surfaces, and Solids (kmos3): Lattice based kinetic Monte Carlo with a python front-end and Fortran back-end.

GADGET-4 is a parallel cosmological N-body and SPH code meant for simulations of cosmic structure formation and calculations relevant for galaxy evolution and galactic dynamics.

AREPO is a parallel moving-mesh code for hydrodynamical cosmological simulations. It is a flexible code that can be applied to a variety of different types of simulations, offering a variety of physics solvers and postprocessing algorithms.

The edd provisioning system based on ansible

An implementation of the presented framework in an article in J. Chem. Phys. 2023 (accepted DOI: 10.1063/5.0160369), Manuscript title: A Fuzzy Classification Framework to Identify Equivalent Atoms in Complex Materials and Molecules.

The NOMAD remote tools hub is an ....

GPU-Accelerated Python STOPgap for Template Matching is an open-source SW for fast template matching (TM) in cryo electron tomograms that is based on TM routines from STOPGAP.

Bayesian calibration and imaging for data from radio telescopes.