INTEGRAL-REPRESENTATION OF THE FERMI DISTRIBUTION AND ITS APPLICATIONS IN ELECTRONIC-STRUCTURE CALCULATIONS
被引:34
作者:
GOEDECKER, S
论文数: 0引用数: 0
h-index: 0
机构:Cornell Theory Center, Ithaca
GOEDECKER, S
机构:
[1] Cornell Theory Center, Ithaca
来源:
PHYSICAL REVIEW B
|
1993年
/
48卷
/
23期
关键词:
D O I:
10.1103/PhysRevB.48.17573
中图分类号:
T [工业技术];
学科分类号:
08 ;
摘要:
We show that the Fermi distribution can be represented by an infinite sum of contour integrals in the complex energy plane. The expansion converges very rapidly and a few terms are sufficient to obtain high accuracy.