Citation
Am. Lee et Pmw. Gill, COULOMB ENERGIES VIA STEWART DENSITIES, Chemical physics letters, 286(3-4), 1998, pp. 226-232
Citations number
28
Categorie Soggetti
Physics, Atomic, Molecular & Chemical
Journal title
ISSN journal
00092614
Volume
286
Issue
3-4
Year of publication
1998
Pages
226 - 232
Database
ISI
SICI code
0009-2614(1998)286:3-4<226:CEVSD>2.0.ZU;2-Y
Abstract
We show that the long-range part of the Coulomb self-energy of an elec
tron density rho(r) is almost identical to that of its associated Stew
art density <(rho)over tilde>(r). Since the latter is obtained by fitt
ing rho(r) within an auxiliary basis of only s functions, our proposal
can be viewed as a hybrid of the RI (resolution of the identity) and
KWIK methods. (C) 1998 Elsevier Science B.V.