On the lower bound on the exchange-correlation energy in two dimensions


Autoria(s): RASANEN, E.; PITTALIS, S.; PROETTO, C. R.; CAPELLE, Klaus
Contribuinte(s)

UNIVERSIDADE DE SÃO PAULO

Data(s)

20/10/2012

20/10/2012

2010

Resumo

We study the properties of the lower bound on the exchange-correlation energy in two dimensions. First we review the derivation of the bound and show how it can be written in a simple density-functional form. This form allows an explicit determination of the prefactor of the bound and testing its tightness. Next we focus on finite two-dimensional systems and examine how their distance from the bound depends on the system geometry. The results for the high-density limit suggest that a finite system that comes as close as possible to the ultimate bound on the exchange-correlation energy has circular geometry and a weak confining potential with a negative curvature. (c) 2009 Elsevier B.V. All rights reserved.

Identificador

PHYSICA E-LOW-DIMENSIONAL SYSTEMS & NANOSTRUCTURES, v.42, n.4, p.1236-1238, 2010

1386-9477

http://producao.usp.br/handle/BDPI/29894

10.1016/j.physe.2009.11.126

http://dx.doi.org/10.1016/j.physe.2009.11.126

Idioma(s)

eng

Publicador

ELSEVIER SCIENCE BV

Relação

Physica E-low-dimensional Systems & Nanostructures

Direitos

restrictedAccess

Copyright ELSEVIER SCIENCE BV

Palavras-Chave #Lieb-Oxford bound #Density-functional theory #Quantum dot #QUANTUM DOTS #ELECTRONS #OCTOPUS #TOOL #Nanoscience & Nanotechnology #Physics, Condensed Matter
Tipo

article

proceedings paper

publishedVersion