Hauptseminar Theorie und Simulation der weichen Materie SS 2013/Grundlagen DFT

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Density Functional Theory

Contents

  • Foundations (Hohenberg Kohn theorems, Levy approach)
  • Examples (exact density functionals, random phase approximation, weighted density approximation, fundamental measure theory)
  • Applications (thermodynamics, structure of fluids at interfaces and surfaces)

Literature

[1] R. Evans, Adv. Phys. 28, 143 (1979).

[2] M. Levy, Proc. Natl. Acad. Sci. USA 76, 6062 (1979).

[3] P. Tarazona, Phys. Rev. A 31, 2672 (1985).

[4] Y. Rosenfeld, M. Schmidt, H. Lowen, and P. Tarazona, Phys. Rev. E 55, 4245 (1997).

[5] R. Roth, R. Evans, A. Lang, and G. Kahl, J. Phys. Condens. Matter 14, 12063 (2002).