The hyperfine properties of a hydrogenated Fe/V superlattice

Physics – Condensed Matter – Materials Science

Scientific paper

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6 pages, 2 figures, 3 tables, ICAME 2011 conference (Kobe, Japan)

Scientific paper

: We study the effect of hydrogen on the electronic, magnetic and hyperfine structures of an iron-vanadium superlattice consisting of three Fe monolayers and nine V monolayers. The contact charge density ({\rho}), the contact hyperfine field (Bhf) and the electronic field gradient (EFG) at the Fe sites for different H locations and H fillings are calculated using the first principle full-potential linear-augmented-plane-wave (FP-LAPW) method . It is found that sizeable changes in the hyperfine properties are obtained only when H is in the interface region.

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