First-principles characterization of ferromagnetism in N-doped SrTiO3 and BaTiO3 - art. no. 062409

[摘要]：The spin-polarization and magnetic coupling character of N-doped SrTiO3 (STO) and BaTiO3 (BTO) 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.

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