Thumbnail
Access Restriction
Open

Author Zein, N. E. ♦ Antropov, V. P.
Sponsorship (US)
Source United States Department of Energy Office of Scientific and Technical Information
Content type Text
Publisher The American Physical Society
Language English
Subject Keyword CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSICS ♦ ELECTRONIC STRUCTURE ♦ FERMI LEVEL ♦ FUNCTIONALS ♦ PHYSICS ♦ TRANSITION ELEMENTS
Abstract We present an approach for obtaining generating functionals for density-functional-like theory, which takes into account the structure of electronic levels near Fermi surface and density variations at distances exceeding the screening radius in metals. Materials-specific information is contained mainly in these structure-dependent terms, while other terms depend mainly on the local density. We used proposed method to study the electronic structure of ferromagnetic Fe and Ni and obtain reasonable agreement with previous local density calculations and experiment. {copyright} 2001 American Institute of Physics.
ISSN 00218979
Educational Use Research
Learning Resource Type Article
Publisher Date 2001-06-01
Publisher Place United States
Journal Journal of Applied Physics
Volume Number 89
Issue Number 11


Open content in new tab

   Open content in new tab