180 research outputs found
Fully relativistic calculation of magnetic properties of Fe, Co and Ni adclusters on Ag(100)
We present first principles calculations of the magnetic moments and magnetic
anisotropy energies of small Fe, Co and Ni clusters on top of a Ag(100) surface
as well as the exchange-coupling energy between two single adatoms of Fe or Co
on Ag(100). The calculations are performed fully relativistically using the
embedding technique within the Korringa-Kohn-Rostoker method. The magnetic
anisotropy and the exchange-coupling energies are calculated by means of the
force theorem. In the case of adatoms and dimers of iron and cobalt we obtain
enhanced spin moments and, especially, unusually large orbital moments, while
for nickel our calculations predict a complete absence of magnetism. For larger
clusters, the magnitudes of the local moments of the atoms in the center of the
cluster are very close to those calculated for the corresponding monolayers.
Similar to the orbital moments, the contributions of the individual atoms to
the magnetic anisotropy energy strongly depend on the position, hence, on the
local environment of a particular atom within a given cluster. We find strong
ferromagnetic coupling between two neighboring Fe or Co atoms and a rapid,
oscillatory decay of the exchange-coupling energy with increasing distance
between these two adatoms.Comment: 8 pages, ReVTeX + 4 figures (Encapsulated Postscript), submitted to
PR
Ab initio study of mirages and magnetic interactions in quantum corrals
The state of the art ab initio calculations of quantum mirages,the
spin-polarization of surface-state electrons and the exchange interaction
between magnetic adatoms in Cu and Co corrals on Cu(111) are presented. We find
that the spin-polarization of the surface-state electrons caused by magnetic
adatoms can be projected to a remote location and can be strongly enhanced in
corrals compared to an open surface.Our studies give a clear evidence that
quantum corrals could permit to tailor the exchange interaction between
magnetic adatoms at large separations. The spin-polarization of surface-state
electrons at the empty focus in the Co corral used in the experimental setup of
Manoharan et al., (Nature 403, 512 (2000)) is revealed.Comment: Submitted to Physical Review Letter
Tailoring exchange interactions in engineered nanostructures: Ab initio study
We present a novel approach to spin manipulation in atomic-scale
nanostructures. Our ab initio calculations clearly demonstrate that it is
possible to tune magnetic properties of sub-nanometer structures by adjusting
the geometry of the system. By the example of two surface-based systems we
demonstrate that (i) the magnetic moment of a single adatom coupled to a buried
magnetic Co layer can be stabilized in either a ferromagnetic or an
antiferromagnetic configuration depending on the spacer thickness. It is found
that a buried Co layer has a profound effect on the exchange interaction
between two magnetic impurities on the surface. (ii) The exchange interaction
between magnetic adatoms can be manipulated by introducing artificial
nonmagnetic Cu chains to link them.Comment: 4 pages, submitted to PR
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