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Zeitschrift für Physik B Condensed Matter

, Volume 81, Issue 3, pp 391–396 | Cite as

Application of LAPW and Green-function methods to calculation of electronic structure of crystal defects

  • V. S. Stepanyuk
  • A. Szasz
  • A. A. Katsnelson
  • A. V. Kozlov
  • O. V. Farberovich
Original Contributions

Abstract

Calculations based on the Linear Augmented Plane-Wave (LAPW) which was treated by the KKR-Green-function method were performed for the electronic structure of 3d impurities (Sc, Ti, V, Cr, Mn, Fe, Co, Ni) in Cu-matrix as well as for vacancies in Cu and Ni. The results are in good agreement with experiments.

Keywords

Spectroscopy Neural Network State Physics Complex System Nonlinear Dynamics 
These keywords were added by machine and not by the authors. This process is experimental and the keywords may be updated as the learning algorithm improves.

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Copyright information

© Springer-Verlag 1990

Authors and Affiliations

  • V. S. Stepanyuk
    • 1
  • A. Szasz
    • 2
  • A. A. Katsnelson
    • 1
  • A. V. Kozlov
    • 1
  • O. V. Farberovich
    • 3
  1. 1.Department of Solid State PhysicsLomonosov State UniversityMoscowUSSR
  2. 2.Laboratory of Surface and Interface PhysicsEotvos UniversityBudapestHungary
  3. 3.Department of Solid State PhysicsVoronezh State UniversityVoronezhUSSR

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