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- W3100131099 abstract "The spin-polarization and magnetic coupling character of N-doped SrTiO3 and BaTiO3 are studied through first-principles calculations. The substitutional N doping at O sites leads to a half-metallic property and produces a magnetic moment of 1.0 {mu}B. The magnetic interaction between the nearest and next-nearest N dopants results in a strong ferromagnetic coupling. When the distance between the N dopants is larger than 7 {AA}, the ground state of the system tends to be paramagnetic. A nitrogen-concentration threshold to produce the ferromagnetism is estimated. The calculated results give a good explanation for the experimentally observed ferromagnetism in N-doped SrTiO3 and BaTiO3." @default.
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- W3100131099 date "2012-02-06" @default.
- W3100131099 modified "2023-10-03" @default.
- W3100131099 title "First-principles characterization of ferromagnetism in N-doped SrTiO3 and BaTiO3" @default.
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