Reduced Density Matrix Inspired Approaches to Electronic Structure Theory
Ph. D. Thesis done at VU University Amsterdam, 2015.
- Reduced density matrices and their properties
- Introduction to the Density Matrix Functional Theory (DMFT) and a survey of exisiting approximations
- Basis set superposition effect and the counterpoise correction in intermolecular interactions
- The formulation of a density matrix functional for van der Waals interaction of like- and opposite-spin electrons in the helium dimer