First-Principles Study of Lattice Dynamics and Thermal Properties of Alkaline-Earth Metal Nitrides CaN, SrN, and BaN
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DOI: 10.1007/s10948-017-4007-7
Abstract: We have performed first-principles calculations to investigate the structural, electronic, magnetic, lattice dynamics, and thermodynamic properties of ferromagnetic alkaline earth metal nitrides CaN, SrN, and BaN in the rocksalt structure using the plane-wave pseudopotential approach… read more here.
Keywords: earth metal; lattice dynamics; nitrides srn; metal nitrides ... See more keywords