forschungszentrum-juelich
Here are 12 public repositories matching this topic...
AiiDA plugin for the spirit code
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Jun 23, 2023 - JavaScript
Simple Tight-binding
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May 31, 2023 - Fortran
Full-potential Korringa-Kohn-Rostoker Green function code JuKKR: All-electron DFT (repo mirror)
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May 3, 2024 - Fortran
Tools for simplifying daily work with the AiiDA workflow engine
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Jul 17, 2024 - Python
OVF (OOMMF Vector Field file format) parser library with C API and language bindings
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Sep 5, 2021 - C++
Full-potential Linearized Augmented Plane Wave code FLEUR: All-electron DFT (repo mirror)
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Sep 12, 2024 - Fortran
AiiDA plugin of the high-performance density functional theory code JuKKR (www.judft.de) for high-throughput electronic structure calculations.
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Jul 18, 2024 - Python
AiiDA plugin of the high-performance density functional theory code FLEUR (www.judft.de) for high-throughput electronic structure calculations.
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Sep 6, 2024 - Python
Post-processing toolkit for electronic structure calculations
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Aug 19, 2024 - Python
A FORTRAN module to write Numpy's *.npy and *.npz files
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Jul 5, 2023 - Fortran
Atomistic Spin Simulation Framework
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Jun 9, 2023 - C++
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