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Applications of Density Functional Theory in Chemistry

  • N. H. March
Part of the NATO ASI Series book series (NSSB, volume 337)

Abstract

Because the ground-state energy functional E[ρ] discussed by W. Kohn in his lectures in this Volume is not known, it will be useful to begin the discussion of the applications to atomic ions and to molecules by considering one-electron functionals.

Keywords

Density Functional Theory Neutral Atom Correlation Energy Orbital Energy Schrodinger Equation 
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 Science+Business Media New York 1995

Authors and Affiliations

  • N. H. March
    • 1
  1. 1.Theoretical Chemistry DepartmentUniversity of OxfordOxfordEngland

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