[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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