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Ferromagnetic calculation of Ni


a=b=c= 6.7 bohr
alpha=betha=gama= 90
Ni(0,0,0)
Rmt=2.3
k.points= 3000

The other values:The default values

The values given by the userguide:

MMINT= -0.03130
MMI001= 0.66198
MMTOT= 0.63068

The values found with the using of the version 2008 of wien2k are:

MMINT= -0.02749
MMI001= 0.65886
MMTOT= 0.63137
ENE= -3041.6518 Ry

Note: MMTOT= MMINT+MMI001
MMINT: Magnetic moment in the interstitiel region
MMI001: Magnetic moment in the  sphere 1 (here, there is one sphere)
MMTOT: Magnetic moment in the unit cell

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