First principles study on spin and orbital magnetism of 3d transition metal monatomic nanowires (Mn, Fe and Co)

We have demonstrated the electronic structure and magnetic properties of 3d transition metal nanowires (Mn, Fe and Co) in the framework of relativistic density functional theory. The equilibrium bond lengths were optimized using the generalized gradient approximation. In a full relativistic regime i...

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Veröffentlicht in:	Journal of physics. Condensed matter 2011-03, Vol.23 (12), p.125301-5
Hauptverfasser:	Sargolzaei, Mahdi, Samaneh Ataee, S
Format:	Artikel
Sprache:	eng
Schlagworte:	Condensed matter Condensed matter: electronic structure, electrical, magnetic, and optical properties Electronic structure and electrical properties of surfaces, interfaces, thin films and low-dimensional structures Electronic structure of nanoscale materials : clusters, nanoparticles, nanotubes, and nanocrystals Exact sciences and technology Iron Manganese Mathematical models Nanowires Orbitals Physics Polarization Transition metals
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