Phys. Rev. 136, B864–B871 (1964)Inhomogeneous Electron Gas
See accompanying Physics Focus This paper deals with the ground state of an interacting electron gas in an external potential v(r). It is proved that there exists a universal functional of the density, F[n(r)], independent of v(r), such that the expression E≡∫v(r)n(r)dr+F[n(r)] has as its minimum value the correct ground-state energy associated with v(r). The functional F[n(r)] is then discussed for two situations: (1) n(r)=n0+ñ(r), ñ/n0≪1, and (2) n(r)=ϕ(r/r0) with ϕ arbitrary and r0→∞. In both cases F can be expressed entirely in terms of the correlation energy and linear and higher order electronic polarizabilities of a uniform electron gas. This approach also sheds some light on generalized Thomas-Fermi methods and their limitations. Some new extensions of these methods are presented. © 1964 The American Physical Society URL:
http://link.aps.org/doi/10.1103/PhysRev.136.B864
DOI:
10.1103/PhysRev.136.B864
PACS:
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