[Pw_forum] PAW pseudopotential

Lorenzo Paulatto paulatto at sissa.it
Thu Apr 29 16:27:27 CEST 2010


On Thu, 29 Apr 2010 13:25:25 +0200, <kazempoor at ph.iut.ac.ir> wrote:
> Thanks for the input file.I am testing and will inform you .Is it  
> possible to make and use norm-conserving PAW pseudopotential? I ask this  
> since I need NCPP to do GW calculation.

You can impose norm-conservation on a PAW dataset (not pseudopotential!),  
but you will still get something totally different from a norm-conserving  
pseudopotential.

In brief: no.

regards


-- 
Lorenzo Paulatto

*** Note: my affiliation has changed! please send future
correspondence to: <Lorenzo.Paulatto at impmc.upmc.fr> ***

post-doc @ IMPMC/UPMC - Université Paris 6
phone: +33 (0)1 44 27 74 89
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previously:
phd student @ SISSA  &  DEMOCRITOS (Trieste)
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