[Pw_forum] Could PWscf code handle the atom or molecule in external magnetic field ?

陳 少華 chen_shao_hua197 at yahoo.com.tw
Mon Dec 17 13:34:31 CET 2007


I see.
Thanks for your reply.

max
Physics department, National Taiwan University, Taiwan


--- Davide Ceresoli <ceresoli at sissa.it> 說:

> 陳 少華 wrote:
> > Dear forum's members,
> > 
> > I wonder could PWscf code handle the atom or
> molecule
> > in external magnetic field ?
> The quick answer is:
> finite magnetic field -> NO (not yet!)
> vanishing magnetic field -> YES (in perturbation
> theory, via the GIPAW code).
> 
> Davide
> 
> -- 
>
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>    Davide Ceresoli <ceresoli at sissa.it>
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