Correlation energy of the spin-polarized uniform electron gas at high density

被引:22
|
作者
Loos, Pierre-Francois [1 ]
Gill, Peter M. W. [1 ]
机构
[1] Australian Natl Univ, Res Sch Chem, Canberra, ACT 0200, Australia
基金
澳大利亚研究理事会;
关键词
COLLECTIVE DESCRIPTION; GROUND-STATE; ACCURATE;
D O I
10.1103/PhysRevB.84.033103
中图分类号
T [工业技术];
学科分类号
08 ;
摘要
The correlation energy per electron in the high-density uniform electron gas can be written as E-c(r(s),zeta) = lambda(0)(zeta) 1n r(s) + epsilon(0)(zeta) + lambda(1)(zeta) r(s) 1n r(s) + O(r(s)), where r(s) is the Seitz radius and zeta is the relative spin polarization. We derive an expression for lambda(1)(zeta) that is exact for any zeta, including the paramagnetic and ferromagnetic limits lambda(1)(0) and lambda(1)(1), and discover that the previously published lambda(1)(1) value is incorrect. We trace this error to an integration and limit that do not commute. The spin resolution of lambda(1)(zeta) into contributions of electron pairs is also derived.
引用
收藏
页数:4
相关论文
共 50 条
  • [1] THE CORRELATION-ENERGY OF THE SPIN-POLARIZED UNIFORM ELECTRON-GAS
    ORTIZ, G
    BALLONE, P
    EUROPHYSICS LETTERS, 1993, 23 (01): : 7 - 13
  • [2] CORRELATION-ENERGY OF A SPIN-POLARIZED ELECTRON-GAS AT HIGH-DENSITY
    HOFFMAN, GG
    PHYSICAL REVIEW B, 1992, 45 (15): : 8730 - 8733
  • [3] EXCHANGE AND CORRELATION ENERGY OF A SPIN-POLARIZED ELECTRON-GAS
    STODDART, JC
    HANKS, P
    JOURNAL OF PHYSICS C-SOLID STATE PHYSICS, 1977, 10 (16): : 3167 - 3178
  • [4] Correlation energies of the high-density spin-polarized electron gas to meV accuracy
    Ruggeri, Michele
    Rios, Pablo Lopez
    Alavi, Ali
    PHYSICAL REVIEW B, 2018, 98 (16)
  • [5] Spin-resolved correlation kinetic energy of the spin-polarized electron gas
    Dobson, JF
    Le, HM
    Vignale, G
    PHYSICAL REVIEW B, 2004, 70 (20) : 205126 - 1
  • [6] Using the spin-resolved electronic direct correlation function to estimate the correlation energy of the spin-polarized uniform electron gas
    Cuevas-Saavedra, Rogelio
    Ayers, Paul W.
    JOURNAL OF PHYSICS AND CHEMISTRY OF SOLIDS, 2012, 73 (05) : 670 - 673
  • [7] Exact energy of the spin-polarized two-dimensional electron gas at high density
    Loos, Pierre-Francois
    Gill, Peter M. W.
    PHYSICAL REVIEW B, 2011, 83 (23)
  • [8] Correlation holes in a spin-polarized dense electron gas
    Rassolov, VA
    Pople, JA
    Ratner, MA
    PHYSICAL REVIEW B, 1999, 59 (24) : 15625 - 15631
  • [9] Correlation energy in a spin-polarized two-dimensional electron liquid in the high-density limit
    Chesi, Stefano
    Giuliani, Gabriele F.
    PHYSICAL REVIEW B, 2007, 75 (15):
  • [10] Comment on "Correlation holes in a spin-polarized dense electron gas"
    Schmidt, K
    Kurth, S
    Tao, JM
    Perdew, JP
    PHYSICAL REVIEW B, 2000, 62 (03) : 2227 - 2231