Abstract
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 (ρ), 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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Elzain, M. et al. (2013). The hyperfine properties of a hydrogenated Fe/V superlattice. In: Yoshida, Y. (eds) ICAME 2011. Springer, Dordrecht. https://doi.org/10.1007/978-94-007-4762-3_97
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DOI: https://doi.org/10.1007/978-94-007-4762-3_97
Publisher Name: Springer, Dordrecht
Print ISBN: 978-94-007-4761-6
Online ISBN: 978-94-007-4762-3
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