Comparative Study on the Charge-Ordered and Mixed-Valence Phases of LuFe2O4 via First-Principles Calculations
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DOI: 10.1007/s10948-017-4465-y
Abstract: The first-principles density functional theory calculations have been used to investigate the relation between magnetic and structural properties of LuFe2O4 for both the charge-ordered (CO) and the mixed-valence (MV) phases and also to compare the… read more here.
Keywords: valence phases; first principles; mixed valence; ordered mixed ... See more keywords