Structural stability and magnetism of FeN from first principles
Langue
en
Article de revue
Ce document a été publié dans
Physical Review B: Condensed Matter and Materials Physics (1998-2015). 2007, vol. 75, n° 6, p. 064420 (6 p.)
American Physical Society
Résumé en anglais
In the framework of density-functional theory, the structural and magnetic properties of FeN mononitride have been investigated using the all-electron augmented spherical wave method with a generalized gradient approximation ...Lire la suite >
In the framework of density-functional theory, the structural and magnetic properties of FeN mononitride have been investigated using the all-electron augmented spherical wave method with a generalized gradient approximation functional for treating the effects of exchange and correlation...< Réduire
Mots clés en anglais
Density functional theory
FeN
Inorganic compounds
Spin
Polarization
Transport phenomena
Metal
Origine
Importé de halUnités de recherche