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juDFT - Home of the DFT codes in Juelich
juDFT: DFT from FZ-Jülich

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G-Fleur
G-Fleur is an implementation of the Green function embedding method based on FLEUR

G-Fleur allows to calculate the Green function of systems embedded between semi-infinite half-spaces.

Features:

  • Calculation of the embedding potential/self-energy of semi-infinite leads
  • Electronic transport
  • Bloch spectral function of surfaces
  • Access to all features within FLEUR (like SOC, non-collinear magnetism ...)
  • Order-N scaling FLAPW
  • Fully parallel implementation

For further questions about G-Fleur contact Symbol - Mail LinkDaniel Wortmann.

Forschungszentrum Jülich, D-52425 Jülich Institute for Advanced Simulation
Institute Quantum Theory of Materials Impressum
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Page last modified:
October 08, 2012