Magnetic and hyperfine properties of fcc Fe

Diana Guenzburger*, D. E. Ellis

*Corresponding author for this work

Research output: Contribution to journalArticlepeer-review

26 Scopus citations

Abstract

First-principles electronic-structure calculations based on density-functional theory were performed for 62-atom embedded clusters representing fcc iron with antiferromagnetic and ferromagnetic spin structures. The results obtained indicate that the large difference observed experimentally in the magnitude of the hyperfine fields of antiferromagnetic and ferromagnetic γ-Fe originates mainly from different signs of the conduction electrons' contribution, and not from large differences in the Fe magnetic moment.

Original languageEnglish (US)
Pages (from-to)12519-12522
Number of pages4
JournalPhysical Review B
Volume51
Issue number18
DOIs
StatePublished - Jan 1 1995

ASJC Scopus subject areas

  • Condensed Matter Physics

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