Magnetism in V/Co(0001) hcp interfaces: Density functional calculations

作者: M.A. Leyva-Lucero , R.E. Félix-Medina , S. Meza-Aguilar , C. Demangeat

DOI: 10.1016/J.SUSC.2011.06.011

关键词: Magnetic momentElectron magnetic dipole momentAtomAtomic orbitalMagnetismGround stateChemistryRelaxation (NMR)Condensed matter physicsDensity functional theory

摘要: Abstract We investigate the magnetic properties of V/Co interfacial systems and adatoms within density functional theory taking into account structural relaxation. The hybridization between V Co orbitals results in a moment induced by surrounding atoms. ground state magnitudes range from ~ 0 to 2.17  μB /atom depending on specific local environment.

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