[Wien] Magnetic moments!!

[Lyudmila Dobysheva]

On Fri, 17 Oct 2003 zufengxia at sohu.com wrote:

> I am calculating an ferromagnetic system including metal-ion Ni, the magnetic moments of Ni are 2.21 according experimental data, while my results show it is only 1.59, and the parameter Rmt=2.0 for Ni,which has already reach the maximum.
> How to increase the magnetic moments of Ni? What parameters should be changed ? Would you please give me some suggestions?  

You are saying about spin magnetic moment only, maybe in your compound
there is a contribution of the orbital moment. An example for
antiferromagnetic NiO, some different schemes of calculation and the
experimental data are given in 
PHYSICAL REVIEW B    VOLUME 62, NUMBER 1 p.73   1 JULY 2000-I
Unquenched large orbital magnetic moment in NiO
S. K. Kwon and B. I. Min

Best regards
  Lyudmila Dobysheva 
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