[Wien] Fixed spin calculations with antiferromagnetic order

tran at theochem.tuwien.ac.at tran at theochem.tuwien.ac.at
Sun Dec 1 10:00:32 CET 2013


Related to your question, recently a severe bug in the
script runfsm_lapw was fixed:

The following line has to be removed or commented
if ( "$orb2" == "-orb" ) goto lcore1

F. Tran

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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