[Wien] Fixed spin calculations with antiferromagnetic order

tran at theochem.tuwien.ac.at tran at theochem.tuwien.ac.at
Sat Nov 30 21:06:48 CET 2013


No, it is not possible to fix the spin moment in a sphere. Only the total
spin moment in the unit cell can be fixed.

On Sat, 30 Nov 2013, Alaska Subedi wrote:

> Dear Prof. Blaha and others,
>
> Is it possible to do fixed spin moment calculations for
> antiferromagnetic order in Wien2k?
>
> Thanks,
> Alaska
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