Heusler clusters
ORAL
Abstract
Real space pseudopotential calculations are used in order to investigate the properties of Heusler clusters. Bulk-like clusters with various Ni-Mn-Ga compositions have been examined in the size range from 15 up to 169 atoms. Among these compositions the closest to the stoichiometric Ni$_2$MnGa are the most stable. These clusters retain tendency for tetragonal distortion, which is inhabited from the bulk properties. Although, the surface effects dominate suppressing the tetragonal structure in the smaller clusters, the bigger clusters develop a bulk-like tetragonal distortion. We predict the existence of switchable Ni-Mn-Ga clusters, which might be of great interest for the nano-Magnetic-Shape-Memory technology.
*This work was supported by the National Science Foundation under Contract No. DMR-0551195, by the U.S. Dept. of Energy under Grants No. DE-FG02-06ER46286 and DE-FG02-06ER15760, by the Computational Material Science Network of the U.S. Dept. of Energy.
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