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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.
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Open-source Python package for geometric plasma simulations.
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Binder-compatible repository for the MPCDF Python for HPC course.
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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.
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Kinetic Modeling of Stripes, Surfaces, and Solids (kmos3): Lattice based kinetic Monte Carlo with a python front-end and Fortran back-end.
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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.
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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.
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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.
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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.
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A python library to map arbitrary, simply connected domains to the unit disc, useful for constructing boundary conforming coordinates. In addition this package includes classes to describe and compute Zernike Polynomials.
This library relies on the boundary integral methods provided by pybie2d and is intended to be used for a new initialization option for GVEC.
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GUI interface between tokamak data and transport codes. Developed first for the ASDEX-Upgrade shotfile system, it can now read IMAS data as input.
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