[Pw_forum] ultrasoft Cs pseudopotential
Nicola Marzari
marzari at MIT.EDU
Thu Jul 1 16:25:49 CEST 2010
Dear Suza W,
There is a norm-conserving PBE pseudo on the website, with all the
details needed to
generate again using LDA.
Alkali metals have very soft pseudopotentials to begin with, so you
should be fine.
nicola
Suza W wrote:
> Dear QE USERS,
>
> QE pseudo site does not have Cs ultrasoft pseudo-potential.
> Can you anybody help me to get the ultasoft (LDA&GGA)
> pseudo-potential for Cs?
> I have got the following link in the forum :
> http://www.fisica.uniud.it/~giannozz/public/Cs.tar.gz
> <http://www.fisica.uniud.it/%7Egiannozz/public/Cs.tar.gz>
> but not able to open this. It seems that the above link is dead.
> Any help in this regard will be highly appreciated.
>
> Yours sincerely,
>
> Suza W.
> Ph. D. student
> RRI, India
>
> ------------------------------------------------------------------------
>
> _______________________________________________
> Pw_forum mailing list
> Pw_forum at pwscf.org
> http://www.democritos.it/mailman/listinfo/pw_forum
>
--
---------------------------------------------------------------------
Prof Nicola Marzari Department of Materials Science and Engineering
13-5066 MIT 77 Massachusetts Avenue Cambridge MA 02139-4307 USA
tel 617.4522758 fax 2586534 marzari at mit.edu http://quasiamore.mit.edu
More information about the users
mailing list