First-principles calculation of the structural and magnetic properties of Fe/Au and Cr/Au monatomic multilayers

Jian Tao Wang, Zhi Qiang Li, Yoshiyuki Kawazoe

研究成果: Article査読

14 被引用数 (Scopus)

抄録

The structural and magnetic properties of Fe/Au and Cr/Au monatomic multilayers with the tetragonal L10 ordered structure in paramagnetic, ferromagnetic, and antiferromagnetic states are studied by means of the self-consistent full-potential linearized augmented-plane-wave method. It is found that the L10 ordered Fe/Au monatomic multilayer has a ferromagnetic ground state with an enhanced moment of 2.76μg of Fe. On the other hand, the L10 ordered Cr/Au monatomic multilayer has an antiferromagnetic ground state with a large local moment 3.18μg of Cr. By total energy minimization, the lattice constants for their ground states are determined.

本文言語English
ページ(範囲)4549-4556
ページ数8
ジャーナルJournal of Physics Condensed Matter
9
22
DOI
出版ステータスPublished - 1997 6月 2

ASJC Scopus subject areas

  • 材料科学(全般)
  • 凝縮系物理学

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