Exact and approximate Kohn-Sham potentials in ensemble density-functional theory

Abstract

Zeng-hui Yang,1 John R. Trail,2 Aurora Pribram-Jones,3 Kieron Burke,3 Richard J. Needs,2 and Carsten A. Ullrich1 1Department of Physics and Astronomy, University of Missouri, Columbia, Missouri 65211, USA 2Theory of Condensed Matter Group, Cavendish Laboratory, University of Cambridge, Cambridge CB3 0HE, United Kingdom 3Department of Chemistry, University of California, Irvine, California 92697, USA (Received 13 February 2014; revised manuscript received 1 September 2014; published 2 October 2014)

Cite this paper

@inproceedings{Yang2014ExactAA, title={Exact and approximate Kohn-Sham potentials in ensemble density-functional theory}, author={Zeng-hui Yang and J R Trail and Aurora Pribram-Jones and Kieron Burke and Richard J. Needs and Carsten A. Ullrich}, year={2014} }