Electronic properties of small free Co clusters

Citation
F. Aguilera-granja et al., Electronic properties of small free Co clusters, PHYS ST S-B, 220(1), 2000, pp. 455-460
Citations number
19
Categorie Soggetti
Apllied Physucs/Condensed Matter/Materiales Science
Journal title
PHYSICA STATUS SOLIDI B-BASIC RESEARCH
ISSN journal
03701972 → ACNP
Volume
220
Issue
1
Year of publication
2000
Pages
455 - 460
Database
ISI
SICI code
0370-1972(200007)220:1<455:EPOSFC>2.0.ZU;2-4
Abstract
We present a systematic study of the average magnetic moments and the non-m etal-metal transition of free Co-N clusters having different geometries: he xahedral, octahedral and decahedral. The electronic structure is calculated with a parameterized Hubbard Hamiltonian with spd electrons within the unr estricted Hartree-Fock approximation, and spill-over effects are considered . We compare our calculations with other theoretical calculations in the li terature. We also comment on the experimental results.