Exchange-energy functionals for finite two-dimensional systems
Strongly Correlated Electrons
2008-05-08 v3
Abstract
Implicit and explicit density functionals for the exchange energy in finite two-dimensional systems are developed following the approach of Becke and Roussel [Phys. Rev. A 39, 3761 (1989)]. Excellent agreement for the exchange-hole potentials and exchange energies is found when compared with the exact-exchange reference data for the two-dimensional uniform electron gas and few-electron quantum dots, respectively. Thereby, this work significantly improves the availability of approximate density functionals for dealing with electrons in quasi-two-dimensional structures, which have various applications in semiconductor nanotechnology.
Cite
@article{arxiv.0710.0718,
title = {Exchange-energy functionals for finite two-dimensional systems},
author = {S. Pittalis and E. Rasanen and N. Helbig and E. K. U. Gross},
journal= {arXiv preprint arXiv:0710.0718},
year = {2008}
}
Comments
5 pages, 3 figures