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Publication details
Magnetism of Ni3Al and Fe3Al under extreme pressure and shape deformation: An ab initio study
Authors | |
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Year of publication | 2004 |
Type | Article in Periodical |
Magazine / Source | Journal of Magnetism and Magnetic Materials |
MU Faculty or unit | |
Citation | |
Field | Solid matter physics and magnetism |
Keywords | ab initio calculations; magnetic phase transformations; volume and shape deformation |
Description | Total energies and magnetic moments in Ni3Al and Fe3Al are calculated along the tetragonal and trigonal transformation paths at various volumes by means of the FLAPW method. Whereas magnetism does not play an important role in stabilization of the L12 structure in Ni3Al, the magnetic effects in Fe3Al are vital. |
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