SELF-CONSISTENT SEMI-RELATIVISTIC ENERGY BAND STRUCTURE OF fcc AND TETRAGONAL Ni METAL.

T. Jarlborg, Arthur J Freeman

Research output: Contribution to journalArticle

14 Citations (Scopus)

Abstract

Results are reported of semi-relativistic self-consistent spin-polarized linear muffin-tin orbital (LMTO) energy band calculations of both fcc and tetragonal Ni (with lattice parameters chosen to approximate those appropriate for the CuNi coherent modulated film system). Ferromagnetic Ni is perhaps the best studied (both experimentally and theoretically) of the magnetic transition metals. Hence, its study permits a detailed comparison of the prediction of present semi-relativistic self-consistent LMTO scheme with experiment and those of other theoretical approaches. The good agreement obtained here serves to establish its accuracy and reliability for treating the electronic structure and properties of magnetic metals, in general, and that of tetragonal Ni, in particular.

Original languageEnglish
Pages (from-to)6-14
Number of pages9
JournalJournal of Magnetism and Magnetic Materials
Volume22
Issue number1
DOIs
Publication statusPublished - Dec 1980

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magnetic metals
Tin
Band structure
energy bands
tin
orbitals
Electronic properties
Lattice constants
Electronic structure
Transition metals
lattice parameters
Metals
transition metals
electronic structure
predictions
Experiments

ASJC Scopus subject areas

  • Condensed Matter Physics

Cite this

SELF-CONSISTENT SEMI-RELATIVISTIC ENERGY BAND STRUCTURE OF fcc AND TETRAGONAL Ni METAL. / Jarlborg, T.; Freeman, Arthur J.

In: Journal of Magnetism and Magnetic Materials, Vol. 22, No. 1, 12.1980, p. 6-14.

Research output: Contribution to journalArticle

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