4.1 Article

Pole-Based Approximation of the Fermi-Dirac Function

期刊

CHINESE ANNALS OF MATHEMATICS SERIES B
卷 30, 期 6, 页码 729-742

出版社

SHANGHAI SCIENTIFIC TECHNOLOGY LITERATURE PUBLISHING HOUSE
DOI: 10.1007/s11401-009-0201-7

关键词

Contour integral; Fermi-Dirac function; Rational approximation

资金

  1. Department of Energy [DE-FG02-03ER25587]
  2. Office of Naval Research [N00014-01-1-0674]
  3. Alfred P. Sloan Research Fellowship
  4. University of Texas at Austin

向作者/读者索取更多资源

Two approaches for the efficient rational approximation of the Fermi-Dirac function axe discussed: one uses the contour integral representation and conformal mapping, and the other is based on a version of the multipole representation of the Fermi-Dirac function that uses only simple poles. Both representations have logarithmic computational complexity. They are of great interest for electronic structure calculations.

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