Quantal Density Functional Theory [E-Book] / by Viraht Sahni.
Sahni, Viraht, (author)
Berlin, Heidelberg : Springer, 2004
XIV, 256 p. online resource.
englisch
9783662096246
10.1007/978-3-662-09624-6
Full Text
Table of Contents:
  • 1. Introduction
  • 2. Schrödinger Theory from the Perspective of ‘Classical’ Fields Derived from Quantal Sources
  • 3. Quantal Density Functional Theory
  • 4. The Hohenberg-Kohn Theorems and Kohn-Sham Density Functional Theory
  • 5. Physical Interpretation of Kohn-Sham Density Functional Theory
  • 6. Quantal Density Functional Theory of the Density Amplitude
  • 7. Quantal Density Functional Theory of the Discontinuity in the Electron-Interaction Potential Energy
  • 8. Further Insights Derived Via Quantal Density Functional Theory
  • 9. Epilogue
  • Appendices
  • A. Proof of the Pure State Differential Virial Theorem
  • B. Proof of the Harmonic Potential Theorem
  • C. Analytical Expressions for the Properties of the Ground and First Excited Singlet States of the Hooke’s Atom
  • D. Derivation of the Kinetic-Energy-Density Tensor for Hooke’s Atom in Its Ground State
  • E. Proof of the S System Differential Virial Theorem
  • F. Derivation of the Pair-Correlation Density in the Local Density Approximation for Exchange
  • References.