VARIATION OF THE GROUND-STATE CORRELATION-ENERGY OF ATOMS WITH ATOMIC-NUMBER

Citation
Ja. Alonso et Na. Cordero, VARIATION OF THE GROUND-STATE CORRELATION-ENERGY OF ATOMS WITH ATOMIC-NUMBER, Journal of physics. B, Atomic molecular and optical physics, 29(9), 1996, pp. 1629-1636
Citations number
20
Categorie Soggetti
Physics, Atomic, Molecular & Chemical",Optics
ISSN journal
09534075
Volume
29
Issue
9
Year of publication
1996
Pages
1629 - 1636
Database
ISI
SICI code
0953-4075(1996)29:9<1629:VOTGCO>2.0.ZU;2-S
Abstract
The empirical correlation energy of atoms and singly charged positive and negative ions in their ground state shows a roughly linear depende nce with respect to the number of electrons. However, the deviations f rom this linear behaviour follow a well defined trend. A formulation b ased on density functional theory allows us to understand these featur es. This formulation focuses on the number of pairings between antipar allel-spin electrons in the same main shell.