Sahni, Viraht
Quantal Density Functional Theory II
1. Introduction
Viraht Sahni
2. Schrödinger Theory from a “Newtonian” Perspective
Viraht Sahni
3. Quantal Density Functional Theory
Viraht Sahni
4. New Perspectives on Hohenberg–Kohn–Sham Density Functional Theory
Viraht Sahni
5. Nonuniqueness of the Effective Potential Energy and Wave Function in Quantal Density Functional Theory
Viraht Sahni
6.
Viraht Sahni
7. Analytical Asymptotic Structure in the Classically Forbidden Region of Atoms
Viraht Sahni
8. Analytical Asymptotic Structure At and Near the Nucleus of Atoms
Viraht Sahni
9. Application of the Q-DFT Hartree Uncorrelated Approximation to Atoms
Viraht Sahni
10. Application of the Q-DFT Pauli Correlated Approximation to Atoms and Negative Ions
Viraht Sahni
11. Quantal Density Functional Theory of the Density Amplitude: Application to Atoms
Viraht Sahni
12. Application of the Irrotational Component Approximation to Nonspherical Density Atoms
Viraht Sahni
13. Application of Q-DFT to Atoms in Excited States
Viraht Sahni
14. Application of the Multi-Component Q-DFT Pauli Approximation to the Anion–Positron Complex: Energies, Positron and Positronium Affinities
Viraht Sahni
15. Application of the Q-DFT Fully Correlated Approximation to the Helium Atom
Viraht Sahni
16. Application of the Q-DFT Fully Correlated Approximation to the Hydrogen Molecule
Viraht Sahni
17. Application of Q-DFT to the Metal–Vacuum Interface
Viraht Sahni
18. Many-Body and Pseudo Møller-Plesset Perturbation Theory within Quantal Density Functional Theory
Viraht Sahni
19. Epilogue
Viraht Sahni
Keywords: Physics, Theoretical, Mathematical and Computational Physics, Math. Applications in Chemistry, Surfaces and Interfaces, Thin Films
- Author(s)
- Sahni, Viraht
- Publisher
- Springer
- Publication year
- 2009
- Language
- en
- Edition
- 1
- Page amount
- 15 pages
- Category
- Natural Sciences
- Format
- Ebook
- eISBN (PDF)
- 9783540922292