SOME IDENTITIES IN DENSITY-FUNCTIONAL THEORY

Citation
Rg. Parr et al., SOME IDENTITIES IN DENSITY-FUNCTIONAL THEORY, Physical review. A, 52(2), 1995, pp. 969-976
Citations number
20
Categorie Soggetti
Physics
Journal title
ISSN journal
10502947
Volume
52
Issue
2
Year of publication
1995
Pages
969 - 976
Database
ISI
SICI code
1050-2947(1995)52:2<969:SIIDT>2.0.ZU;2-J
Abstract
Various density-functional relations are established involving functio nal expansions for quantities of interest. The central identity expres ses an arbitrary well-behaved functional F[rho] in terms of the actual density rho(x) and the functional derivatives of F[rho] evaluated at the density rho(x). A number of useful consequences of the formulas ar e given.