Correlated Electrons

German Research School for Simulation Sciences and RWTH Aachen University
SS 2011, Do 15:00-16:30 and 16:45-17:30, Lecture Hall, GRS Jülich
CAMPUS link
exams: Mo 25 July 2011, 10:00-12:00, GRS lecture hall, Jülich

Lectures

  1. Introduction
    Theory of Almost Everything
    periodic table (pse tool)
    atomic orbitals, shell structure
    atoms in crystals
    example: magnetite
    atomic units
    slides and exercises
  2. angular momentum
    general properties
    adding angular momenta
    slides and exercises
  3. fine structure of hydrogen
    multi-electron atoms: self-consistent central-field approximation
    slides and exercises
  4. Russel-Saunders Coupling and Hund's rules
    slides and exercises
  5. direct exchange
    calculation of multiplet splitting: p2
    Slater integrals and Gaunt coefficients
    slides and exercises
  6. direct exchange: orthogonal and non-orthogonal orbitals
    kinetic exchange
    slides and exercises
  7. second quantization, field operators
    slides and exercises
  8. second quantization: Slater determinants, Operators
    slides and projects
  9. perovskite structure
    crystal-field theory: introduction to group theory
    slides and projects
  10. octahedral crystal-field splitting
    Jahn-Teller effect
    slides

Student Projects

  • Self-consistent calculations for atoms in the spherical-field approximation
    Kaustubh Bhat
  • Multiplet energies from diagonalizing the Coulomb matrix
    Dimitrios Kyranas

Textbook


Patrik Fazekas
Lectures on Electron Correlation and Magnetism
World Scientific, 1999

book cover


Erik Koch