Effect of vanadium neighbors on the hyperfine properties of iron-vanadium alloys

Research output: Contribution to journalArticle

Abstract

The electronic and magnetic structures of Fe-V alloys are calculated using the discrete-variational and full-potential linearized-augmented-plane wave methods. The derived hyperfine properties at Fe sites are studied against the number of Fe atoms in the neighbouring shells. As expected the magnetic hyperfine field depends strongly on the number of Fe atoms in the first and second shells of neighbours while its dependence on the variation of atoms in the third shell is weak. The calculated distribution of the magnetic hyperfine fields at the Fe sites, are compared to the experimental data of Krause et al. (Phys Rev B 61:6196-6204, 2000). The contact charge densities and the magnetic moments are also calculated. It was found that the contact charge density increases with increasing V contents and this leads to negative isomer shift on addition of V.

Original languageEnglish
Pages (from-to)45-50
Number of pages6
JournalHyperfine Interactions
Volume184
Issue number1-3
DOIs
Publication statusPublished - Jun 2008

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vanadium alloys
Vanadium alloys
Vanadium
iron alloys
Iron alloys
vanadium
Charge density
Atoms
Magnetic fields
atoms
Magnetic structure
Magnetic moments
Isomers
Electronic structure
plane waves
isomers
magnetic moments
electronic structure
shift

ASJC Scopus subject areas

  • Condensed Matter Physics
  • Nuclear and High Energy Physics
  • Atomic and Molecular Physics, and Optics
  • Physical and Theoretical Chemistry

Cite this

Effect of vanadium neighbors on the hyperfine properties of iron-vanadium alloys. / Elzain, M.; Yousif, A.; Gismelseed, A.; Al Rawas, A.; Widatallah, H.; Bouziane, K.; Al-Omari, I.

In: Hyperfine Interactions, Vol. 184, No. 1-3, 06.2008, p. 45-50.

Research output: Contribution to journalArticle

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AU - Yousif, A.

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AU - Widatallah, H.

AU - Bouziane, K.

AU - Al-Omari, I.

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