Artigo
Structural phase transition study of FePt alloys using ab initio calculation
Fecha
2009-09-25Registro en:
Materials Science and Engineering A-structural Materials Properties Microstructure and Processing. Lausanne: Elsevier B.V. Sa, v. 521-22, p. 167-168, 2009.
0921-5093
10.1016/j.msea.2008.09.111
WOS:000270330700041
Autor
Universidade Estadual Paulista (Unesp)
Universidade de São Paulo (USP)
Resumen
The FePt alloy undergoes the cubic to tetragonal lattice transformation in the ferromagnetic state. We calculated the electronic structure for both cubic and tetragonal structures using the FPLAPW method with APW + lo. Comparing the density of states of the cubic and tetragonal structures, it is expected that the lattice transformation is caused by the band Jahn-Teller effect. (C) 2009 Elsevier B.V. All rights reserved.