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Michalicek, Gregor
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Wortmann, Daniel
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Quanten-Theorie der Materialien; IAS-1
Topological Matter
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Michalicek, Gregor
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Wortmann, Daniel
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Quanten-Theorie der Materialien; IAS-1
Topological Matter
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Journal Article
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1
Journal Article
How to verify the precision of density-functional-theory implementations via reproducible and universal workflows
Bosoni, Emanuele
2024
Nature reviews / Physics, 6 (2024) S. 45-58
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2
Journal Article
Phonons from density-functional perturbation theory using the all-electron full-potential linearized augmented plane-wave method FLEUR *
Gerhorst, Christian-Roman
2024
Electronic structure, 6 (2024) 1, S. 017001 -
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Calculation Of Phonon Spectra With The FLAPW Method Using Density Functional Perturbation Theory
Neukirchen, Alexander
2023
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4
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Fast All-Electron Hybrid Functionals and Their Application to Rare-Earth Iron Garnets
Redies, Matthias
2022
Frontiers in Materials, 9 (2022) S. 851458
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Journal Article
3
Conference Presentation
1
Name
Blügel, Stefan
4
Michalicek, Gregor
Wortmann, Daniel
Bihlmayer, Gustav
2
Gerhorst, Christian-Roman
2
Neukirchen, Alexander
2
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Beal, Louis
1
Bercx, Marnik
1
Betzinger, Markus
1
Blaha, Peter
1
Bosoni, Emanuele
1
Bouaziz, Juba
1
Broeder, Jens
1
Callsen, Martin
1
Cottenier, Stefaan
1
Degomme, Augustin
1
Dikan, Vladimir
1
Eimre, Kristjan
1
Flage-Larsen, Espen
1
Fornari, Marco
1
Garcia, Alberto
1
Genovese, Luigi
1
Giantomassi, Matteo
1
Huber, Sebastiaan P.
1
Janssen, Henning
1
Kastlunger, Georg
1
Klüppelberg, Daniel Aaron
1
Krack, Matthias
1
Kresse, Georg
1
Kühne, Thomas D.
1
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Research Program
Topological Matter
MAterials design at the eXascale. European Centre of Excellence in materials modelling, simulations, and design
2
Domain-Specific Simulation & Data Life Cycle Labs (SDLs) and Research Groups
1
Helmholtz Platform for Research Software Engineering - Preparatory Study
1
Joint Virtual Laboratort for AI, Data Analytics and Scalable Simulation
1
Contributing Institute
Quanten-Theorie der Materialien; IAS-1
Quanten-Theorie der Materialien; PGI-1
4
JARA - HPC; JARA-HPC
3
JARA-FIT; JARA-FIT
3
Materials Data Science and Informatics; IAS-9
1
Scientific Report
2024
2
2022
1
2023
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