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- W1974476103 abstract "The electronic, structural, and magnetic properties of the perovskite Co-doped BiFeO3 have been investigated using density functional theory within the generalized gradient approximation plus Hubbard U correction (GGA+U). We discuss the changes that occur in the structural parameters, electronic structure, and magnetic properties of the Co-doped BiFeO3 under the consideration of the impact of the 3d electrons. The results show that a substitutional Co for Fe in BiFeO3 produces a magnetic moment of −1.0 μB and a half-metallic property emerges. The ferromagnetic (FM) coupling is more stable and still presents a half-metallic property when two Co atoms substitute for Fe atoms in BiFeO3." @default.
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- W1974476103 date "2015-01-01" @default.
- W1974476103 modified "2023-10-17" @default.
- W1974476103 title "First-principles study of magnetic properties in Co-doped BiFeO3" @default.
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- W1974476103 doi "https://doi.org/10.1016/j.physb.2014.08.028" @default.
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