Enhancement of magnetocrystalline anisotropy in ferromagnetic Fe films by intra-atomic noncollinear magnetism

被引:75
作者
Nakamura, K [1 ]
Ito, T
Freeman, AJ
Zhong, LP
Fernandez-de-Castro, J
机构
[1] Mie Univ, Dept Engn Phys, Tsu, Mie 5148507, Japan
[2] Northwestern Univ, Dept Phys & Astron, Evanston, IL 60208 USA
[3] Seagate Technol LLC, Minneapolis, MN 55435 USA
关键词
D O I
10.1103/PhysRevB.67.014420
中图分类号
T [工业技术];
学科分类号
08 ;
摘要
We generalize the full-potential linearized augmented plane-wave method with a single slab geometry in order to treat noncollinear magnetism with no shape approximation for the magnetization, and apply this scheme to investigate free-standing Fe(001) monolayers with lattice constants matching those of fcc Ag(001) and Cu(001) substrates. Intra-atomic noncollinear magnetism on a smaller length scale inside the atom is observed in the ferromagnetic state, and is found to enhance the magnetocrystalline anisotropy energy (by 17similar to20%) compared to values determined for their collinear magnetic state.
引用
收藏
页数:6
相关论文
共 29 条
[1]  
BLAND JAC, 1994, ULTRATHIN MAGNETIC S, V2
[2]  
BLAND JAC, 1994, ULTRATHIN MAGNETIC S, V1
[3]   TIGHT-BINDING APPROACH TO THE ORBITAL MAGNETIC-MOMENT AND MAGNETOCRYSTALLINE ANISOTROPY OF TRANSITION-METAL MONOLAYERS [J].
BRUNO, P .
PHYSICAL REVIEW B, 1989, 39 (01) :865-868
[4]   ELECTRONIC-STRUCTURE THEORY OF SURFACE, INTERFACE AND THIN-FILM MAGNETISM [J].
FREEMAN, AJ ;
WU, RQ .
JOURNAL OF MAGNETISM AND MAGNETIC MATERIALS, 1991, 100 (1-3) :497-514
[5]   SPIN ANISOTROPY OF FERROMAGNETIC SLABS AND OVERLAYERS [J].
GAY, JG ;
RICHTER, R .
JOURNAL OF APPLIED PHYSICS, 1987, 61 (08) :3362-3365
[6]   SPIN ANISOTROPY OF FERROMAGNETIC-FILMS [J].
GAY, JG ;
RICHTER, R .
PHYSICAL REVIEW LETTERS, 1986, 56 (25) :2728-2731
[7]   EXPLICIT LOCAL EXCHANGE-CORRELATION POTENTIALS [J].
HEDIN, L ;
LUNDQVIS.BI .
JOURNAL OF PHYSICS PART C SOLID STATE PHYSICS, 1971, 4 (14) :2064-&
[8]   TECHNIQUE FOR RELATIVISTIC SPIN-POLARIZED CALCULATIONS [J].
KOELLING, DD ;
HARMON, BN .
JOURNAL OF PHYSICS C-SOLID STATE PHYSICS, 1977, 10 (16) :3107-3114
[9]   LINEARIZED AUGMENTED PLANE-WAVE METHOD FOR THE ELECTRONIC BAND-STRUCTURE OF THIN-FILMS [J].
KRAKAUER, H ;
POSTERNAK, M ;
FREEMAN, AJ .
PHYSICAL REVIEW B, 1979, 19 (04) :1706-1719
[10]   DENSITY FUNCTIONAL THEORY OF NON-COLLINEAR MAGNETISM [J].
KUBLER, J ;
HOCK, KH ;
STICHT, J ;
WILLIAMS, AR .
JOURNAL OF PHYSICS F-METAL PHYSICS, 1988, 18 (03) :469-483