Title of article :
A new spd tight-binding model of magnetism in transition metals
Author/Authors :
Barreteau، نويسنده , , C and Guirado-L?pez، نويسنده , , M.C. Desjonquères، نويسنده , , M.C and Spanjaard، نويسنده , , D and Ole?، نويسنده , , A.M، نويسنده ,
Issue Information :
روزنامه با شماره پیاپی سال 2000
Pages :
6
From page :
211
To page :
216
Abstract :
We present the extension of an efficient spd tight-binding model to the case of spin polarized materials by including electron–electron interactions, in an extended Hubbard–Hartree–Fock formalism. It is applied with success to rhodium and palladium clusters and slabs.
Keywords :
Electron–electron interactions , Transition metals , Surface and cluster magnetism , Semi-empirical models
Journal title :
Computational Materials Science
Serial Year :
2000
Journal title :
Computational Materials Science
Record number :
1678471
Link To Document :
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