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Showing 1 to 1 of 1 for “"KKR-Methode"”.

  1. Development and application of a massively parallel KKR Green function method for large scale systems

    Thieß, Alexander R.Publikationsserver der RWTH Aachen University2011

    … full-potential Korringa-Kohn-Rostoker (KKR) Green function method KKRnano for calculating the electronic properties, magnetic interactions, and total energy including all electrons on the basis of the density functional theory (DFT) on high-end massively parallelized high-performance …

    aachen Repository record