ELECTRIC-FIELD GRADIENTS FOR SMALL ANTIMONY BASED ZINTL CLUSTERS FROMHARTREE-FOCK INVESTIGATIONS

Citation
F. Hagelberg et al., ELECTRIC-FIELD GRADIENTS FOR SMALL ANTIMONY BASED ZINTL CLUSTERS FROMHARTREE-FOCK INVESTIGATIONS, Zeitschrift fur Naturforschung. A, A journal of physical sciences, 51(5-6), 1996, pp. 557-559
Citations number
8
Categorie Soggetti
Chemistry Physical",Physics
ISSN journal
09320784
Volume
51
Issue
5-6
Year of publication
1996
Pages
557 - 559
Database
ISI
SICI code
0932-0784(1996)51:5-6<557:EGFSAB>2.0.ZU;2-H
Abstract
Electric Field Gradient (EFG) calculations have been carried out for A ntimony based clusters with 20 and with 22 valence electrons. It is sh own that EFGs are very sensitive to structural changes of the clusters under study. This feature can be used to demonstrate the validity of the Zintl-Klemm-Busmann principle for these systems through EFG determ inations.