Title of article
Compton scattering studies and electronic properties of cerium
Author/Authors
Gopal Choudhary، نويسنده , , Veera Raykar، نويسنده , , Alpa Dashora c، نويسنده , , Jagrati Sahariya، نويسنده , , B.L. Ahuja c، نويسنده ,
Issue Information
روزنامه با شماره پیاپی سال 2011
Pages
6
From page
804
To page
809
Abstract
Experimental electron momentum density of γ-Ce was measured at an intermediate resolution (0.38 a.u.) using 20 Ci 137Cs Compton spectrometer. The experiment was compared with the first ever theoretical Compton profiles computed using spin polarized relativistic Korringa-Kohn-Rostoker (SPR-KKR) method within atomic sphere approximation; and linear combination of atomic orbitals (LCAO) within generalised gradient approximation (GGA) and recently developed second order generalised gradient approximation (SOGGA). It was seen that the Compton profile derived from LCAO with GGA and SOGGA schemes gave a reasonable agreement with the experimental Compton line shape. Theoretical anisotropies in Compton profiles derived along [100], [110] and [111] directions were explained in terms of degenerate states in the energy bands.
Keywords
Density functional theory , X-Ray scattering , rare earth metals and alloys
Journal title
Journal of Rare Earths
Serial Year
2011
Journal title
Journal of Rare Earths
Record number
1246321
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