https://doi.org/10.1140/epjd/e2003-00060-6
Magnetism in Rh clusters under hydrostatic deformations
1
Instituto de Física, Universidad Autónoma de
San Luis Potosí, 78000 San Luis Potosí, S.L.P., Mexico
2
Instituto Potosino de Investigación Científica y
Tecnológica, Apartado Postal 3-74 Tangamanga, 78231 San Luis
Potosí,
S.L.P., Mexico
3
Departamento de Física Teórica, Atómica,
Molecular y Nuclear, Universidad de Valladolid,
47011 Valladolid, Spain
Corresponding author: a berlanga@dec1.ifisica.uaslp.mx
Received:
5
August
2002
Revised:
10
January
2003
Published online:
4
March
2003
The magnetic behavior of rhodium clusters RhN (N=4–38) under hydrostatic deformations was investigated. The starting cluster structures were obtained from an evolutionary search algorithm applied to a Gupta potential. The spin-polarized electronic structure and related magnetic properties were calculated using a self-consistent spd tight-binding Hamiltonian within the unrestricted Hartree-Fock approximation. The magnetic behavior was analyzed in terms of the interdependence between the geometrical parameters and the electronic structure. Anomalous magnetic effects were found in some cases.
PACS: 36.40.Cg – Electronic and magnetic properties of clusters / 61.46.+w – Nanoscale materials: clusters, nanoparticles, nanotubes, and nanocrystals
© EDP Sciences, Società Italiana di Fisica, Springer-Verlag, 2003