[Wien] magnetic moment

physics phys wien.phy at gmail.com
Wed Aug 4 17:39:28 CEST 2010


please
for example
when i calculate magnetic moment using wien2k for XY4Z type of compond (5
independent atoms and total 12 atoms in unit cell)

suppose the magnetic moment reads

*moment of X=1
momnet of Y=2
momnet of Z= 3
total moment =18*

(which is 3 x moment of  X + 3 x moment of Y+ 3 x mommet of Z = 3 x 1 + 3x 2
+3x3 = 3 + 6+ 9)

Now, to compare an experimental magnetic moment for XY4Z = 3.

How can i compare? is it that i do 18 divided by 5(no of ind. atoms) =
3.6???
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