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Abstract
Electronic structure of hcp rare earth metals Gd, Tb, Dy, Lu and rare-earth-like Y is calculated using the spin-polarized version of the full potential LAPW method. The electric field gradient at the nucleus site is determined from the nonspherical part of the charge density. Crystal field parameters are obtained from the nonspherical components of self-consistent potential. The influence of the state of the 4f-system on the valence and semi-core electrons is investigated.
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