[Pw_forum] pseudopotential

Stefano de Gironcoli degironc at sissa.it
Wed Jul 25 23:14:52 CEST 2012


Dear Bani Adam
     maybe it would be more useful if you clarify what is your request 
about pseudopotential and vdW.

     are you referring to the XC functional to be used ? then of course 
one should use a pseudo generated with that XC, or in case this is not 
available with an XC as close as possible to it... and this was the 
meaning of Emine's reply
     or are you asking if some specific typer of pseudo can "by itself" 
give better descriptionof vdW system ?.. then please think about the 
lines suggested by Axel..

    or maybe you are thinking about  something else.. please clarify

    best,
stefano


On 07/25/2012 11:06 PM, bf azi wrote:
> Can you describe more?
> I can not understand What to do for creating vdW pseudopotential?
>
> Thanks a lot
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