[Pw_forum] Use of Pseudo potential for functional blyp in the calculation with B3LYP functional

Duy Le ttduyle at gmail.com
Thu Oct 8 17:17:45 CEST 2009


BLYP was not mentioned in what can qe do (QE website)
--------------------------------------------------
Duy Le
PhD Student
Department of Physics
University of Central Florida.


On Thu, Oct 8, 2009 at 10:38 AM, Luciano C. <aqswde30 at gmail.com> wrote:

> Hello,
>
> I have a question about the use of pseudopotenciais. I could use a pseudo
> potential generated for the functional blyp in the calculation with the
> B3LYP functional ???
>
> Grateful
>
> Luciano
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