MULTICENTER BOND INDEX - GRASSMANN ALGEBRA AND N-ORDER DENSITY-FUNCTIONAL

Authors
MUNDIM KC GIAMBIAGI M DEGIAMBIAGI MS
Citation
Kc. Mundim et al., MULTICENTER BOND INDEX - GRASSMANN ALGEBRA AND N-ORDER DENSITY-FUNCTIONAL, Journal of physical chemistry, 98(24), 1994, pp. 6118-6119
Citations number
18
Categorie Soggetti
Chemistry Physical
Journal title
Journal of physical chemistry → ACNP
ISSN journal
00223654
Volume
98
Issue
24
Year of publication
1994
Pages
6118 - 6119
Database
ISI
SICI code
0022-3654(1994)98:24<6118:MBI-GA>2.0.ZU;2-#
Abstract
Through the N-order density functional introduced using Grassmann alge bra, a straightforward meaning is attached to multicenter bond indices within the Hartree-Fock approximation; they represent the correlation between the fluctuations of the charges in each atomic center from th eir average values.