CONSTRAINT SATISFACTION IN LOCAL AND GRADIENT SUSCEPTIBILITY APPROXIMATIONS - APPLICATION TO A VAN-DER-WAALS DENSITY-FUNCTIONAL

Citation
Jf. Dobson et Bp. Dinte, CONSTRAINT SATISFACTION IN LOCAL AND GRADIENT SUSCEPTIBILITY APPROXIMATIONS - APPLICATION TO A VAN-DER-WAALS DENSITY-FUNCTIONAL, Physical review letters, 76(11), 1996, pp. 1780-1783
Citations number
15
Categorie Soggetti
Physics
Journal title
ISSN journal
00319007
Volume
76
Issue
11
Year of publication
1996
Pages
1780 - 1783
Database
ISI
SICI code
0031-9007(1996)76:11<1780:CSILAG>2.0.ZU;2-1
Abstract
We show how charge conservation and reciprocity can be built into loca l density or gradient approximations for density-density response func tions (susceptibilities). We apply these ideas to derive from first pr inciples a variant of the Rapcewicz-Ashcroft formula for the van der W aals interaction. We also discuss how improved formulas may be obtaine d.