[Wien] Non-collinear spin structure

Peter Blaha pblaha at theochem.tuwien.ac.at
Wed Apr 18 21:41:37 CEST 2012


Of course you need wienncm for this.

Am 18.04.2012 21:16, schrieb Hena Das:
> Dear Wien2k developers and users,
>
> My aim is to do a total energy calculation for a particular non-collinear spin arrangement including spin-orbit interaction. Can you please tell me how to input the initial
> non-collinear spin arrangement? Do I need to use Wienncm?
>
> Thank you.
>
> Hena Das
>
>
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Peter Blaha
Inst. Materials Chemistry, TU Vienna
Getreidemarkt 9, A-1060 Vienna, Austria
Tel: +43-1-5880115671
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email: pblaha at theochem.tuwien.ac.at
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