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KKR Green’s Function Method in Reciprocal and Real Space

  • Ján Minár
  • Ondřej Šipr
  • Jürgen Braun
  • Hubert Ebert
Conference paper
Part of the Springer Proceedings in Physics book series (SPPHY, volume 204)

Abstract

The Korringa–Kohn–Rostoker (KKR) method is a very flexible band structure technique which is based on the multiple scattering formalism. In contrast to many other band structure methods, which are based on a representation of the electronic structure in terms of Bloch wave functions, the KKR method represents the properties of solids in terms of Green’s functions. In this chapter we demonstrate the flexibility of the KKR method as a tool to describe spectroscopic aspects such as x-ray absorption spectra theory and one-step model of photoemission.

Notes

Acknowledgements

We thank the DFG for financial support via Ebe154/32-1, BMBF (05K16WMA) and to the COST action MP1306 EUSpec for travel grants. JM was supported by the CEDAMNF project (CZ.02.1.01/0.0/0.0/15_003/0000358), co-funded by the ERDF as part of the OP RDE program of the Ministry of Education, Youth and Sports (Czech Republic). OS would like to acknowledge support by the GACR (project 17-14840S).

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Copyright information

© Springer International Publishing AG, part of Springer Nature 2018

Authors and Affiliations

  • Ján Minár
    • 1
  • Ondřej Šipr
    • 2
  • Jürgen Braun
    • 3
  • Hubert Ebert
    • 3
  1. 1.New Technologies-Research CenterUniversity of West BohemiaPlzeňCzech Republic
  2. 2.Institute of Physics, Czech Academy of SciencesPraha 6Czech Republic
  3. 3.Department ChemieLudwig-Maximilians-Universität MünchenMunich, BavariaGermany

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