One way of improving the magnetic properties of RECo5 (RE=rare earth) compounds, especially the magnetic anisotropy energy (MAE), is to dope them with some additives such as Fe, Ni, Cu. Those dopants bring changes in both lattice geometry and magnetic properties of the compounds. In this paper, the effects of doping on YCo5-xFex and YCo5-xAgx were studied in two simple but effective ways: first, the geometric effect induced by doping and then, the pure doping role namely without any geometric changes. The calculated results indicate that the magnetic moments of Co show a transition from a high spin state to a low one with the change of the volume of the cell in all YCo5, YCo3Fe2 and YCo3Ag2 alloys. The change of c/a ratio with constant lattice parameter a also influences drastically the magnetic moments and the MAE. As the geometric structure is not changed, it is found that the doping effects of magnetic element Fe and non-magnetic element Ag are quite different.
参考文献
[1] | Tellez-Blanco JC.;Turtelli RS.;Grossinger R. .Structure and magnetic properties of SmCo5-xCux alloys[J].Journal of Alloys and Compounds: An Interdisciplinary Journal of Materials Science and Solid-state Chemistry and Physics,1998(1):1-5. |
[2] | Tellez-Blanco J C;Grossinger R;Sato Turtelli R et al.Structure and magnetic properties of YCo5-xCux alloys[J].IEEE Transactions on Magnetics,2000,36:3333. |
[3] | Zhou J et al.Sm-Co-Cu-Ti high-temperature permanent magnets[J].Applied Physics Letters,2000,77:1514. |
[4] | Yamada H.;Ishikawa F.;Yamaguchi M.;Mitamura H.;Goto T.;Terao K. .Itinerant-electron metamagnetism of Y(Co, Ni)5[J].Journal of Physics. Condensed Matter,1999(2):483-492. |
[5] | Kitagawa I;Terao K;Aoki M et al.Electronic structure and magnetism of YCo5,YNi5 and YCo3Ni2[J].Journal of Physics:Condensed Matter,1997,9:321. |
[6] | Larson P;Mazin I I .Effect of impurities on magnetic properties of Y(Co5-xCux) and Y2(Co7-xNix)[J].Journal of Magnetism and Magnetic Materials,2004,269:176. |
[7] | Steinbeck L.;Eschrig H.;Richter M. .Itinerant-electron magnetocrystalline anisotropy energy of YCo5 and related compounds - art. no. 184431[J].Physical Review.B.Condensed Matter,2001(18):184431-1-184431-14. |
[8] | Larson P;Mazin I I;Papaconstantopoulos D A .Effects of doping on the magnetic anisotropy energy in SmCo5-xFex and YCo5-xFex[J].Physical Review B:Condensed Matter,2004,69:134408. |
[9] | Sabirianov RF;Kashyap A;Skomski R;Jaswal SS;Sellmyer DJ .First principles study of transition-metal substitutions in Sm-Co permanent magnets[J].Applied physics letters,2004(12):2286-2288. |
[10] | Larson P.;Mazin II. .Magnetic properties of SmCo5 and YCo5[J].Journal of Applied Physics,2003(10 Pt.2):6888-6890. |
[11] | Kresse G.;Furthmuller J. .EFFICIENT ITERATIVE SCHEMES FOR AB INITIO TOTAL-ENERGY CALCULATIONS USING A PLANE-WAVE BASIS SET[J].Physical Review.B.Condensed Matter,1996(16):11169-11186. |
[12] | Kresse G;Furthmuller J .Efficiency of ab initio total energy calculations for metals and semiconductors using a plane-wave basis set[J].Computational Materials Science,1996,6:15. |
[13] | Blochl PE Projector augmented-wave method[J].Physical Review B:Condensed Matter,1994,50:17953. |
[14] | Perdew J P;Wang Y .Accurate and simple analytic representation of the electron-gas correlation energy[J].Physical Review B:Condensed Matter,1992,45:13244. |
- 下载量()
- 访问量()
- 您的评分:
-
10%
-
20%
-
30%
-
40%
-
50%