Possible magnetism in small palladium clusters
- 1 August 1998
- journal article
- research article
- Published by American Physical Society (APS) in Physical Review B
- Vol. 58 (5) , 2391-2394
- https://doi.org/10.1103/physrevb.58.2391
Abstract
Possible magnetism of small palladium clusters having cubic geometry has been studied using the Gaussian orbital basis and the local spin-density approximation. Extensive calculations have been done on clusters with face-centered-cubic symmetry by varying atomic spacing parameters. Possible magnetism of the cluster with body-centered-cubic symmetry has also been studied. Fixed moment calculations were done to find all possible metastable states of the cluster. In addition to a nonmagnetic state, the cluster is found to have a magnetic state with a moment of The two states are very close in total energy but the magnetic state has slightly lower total energy. The cluster is found to have only one magnetic state with a moment of From our calculations, we conclude that palladium clusters are very likely to be magnetic although the magnetic moment is very small.
Keywords
This publication has 18 references indexed in Scilit:
- Size and structural dependence of the magnetic properties of rhodium clustersPhysical Review B, 1997
- Possible large magnetic moments in 4d transition metal clustersThe European Physical Journal D, 1997
- Magnetic properties oftransition-metal clustersPhysical Review B, 1996
- Ionization of helium by a short pulse of radiation: A Fermi molecular-dynamics calculationPhysical Review A, 1994
- Giant magnetic moments in 4dclustersPhysical Review Letters, 1993
- Magnetic studies of free nonferromagnetic clustersPhysical Review B, 1992
- Magnetism in small vanadium clustersPhysical Review B, 1991
- Spin relaxation in small free iron clustersPhysical Review Letters, 1990
- Electronic structure of small iron clustersPhysical Review B, 1984
- Quantum chemistry and catalysisPhysics Today, 1974