Domain specific library for electronic structure calculations
Full-potential Linearized Augmented Plane Wave code FLEUR: All-electron DFT (repo mirror)
AiiDA plugin of the high-performance density functional theory code JuKKR (www.judft.de) for high-throughput electronic structure calculations.
AiiDA plugin of the high-performance density functional theory code FLEUR (www.judft.de) for high-throughput electronic structure calculations.
Full-potential Korringa-Kohn-Rostoker Green function code JuKKR: All-electron DFT (repo mirror)
Real-space grid Density Functional Theory for large systems
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