Dimensionality dependence of the self-interaction correction in the local-density approximation to density functional theory

被引:3
|
作者
Nagy, I. [1 ,2 ]
Echenique, P. M. [2 ,3 ,4 ]
机构
[1] Tech Univ Budapest, Inst Phys, Dept Theoret Phys, H-1521 Budapest, Hungary
[2] DIPC, San Sebastian 20018, Spain
[3] Univ Basque Country, Fac Ciencias Quim, CSIC, Dept Fis Mat,EHU, Sebastian 20080, Spain
[4] Univ Basque Country, Fac Ciencias Quim, CSIC, Ctr Mixto,EHU, Sebastian 20080, Spain
来源
PHYSICAL REVIEW B | 2010年 / 81卷 / 11期
关键词
ELECTRONS; METALS; ENERGY; ATOM;
D O I
10.1103/PhysRevB.81.113109
中图分类号
T [工业技术];
学科分类号
08 ;
摘要
The local-density approximation (LDA) to density functional theory is not self-interaction free. Motivated by this intellectual challenge, and the possible practical importance of strong electron-correlation in a Wigner-type model, the capability of LDA is investigated for a two-dimensional electron system in the low-density limit. It is found for this essentially single-electron limit that the performance of LDA is slightly better in two dimension than in the equivalent three-dimensional problem treated earlier in Phys. Rev. B 18, 6506 (1978). An a priori explanation of this fact is given in terms of the different characters of potential fields generated by normalized charge distributions in these dimensions.
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页数:3
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