[Pw_forum] Mn PAW PP

Pietro Bonfa' pietro.bonfa at fis.unipr.it
Thu Apr 4 12:22:35 CEST 2013


Dear Mohnish,

there's a Mn pseudopotential in the pslibrary:

http://qe-forge.org/gf/project/pslibrary/

It's inside: paw_ps_collection_tot.job

>From the code's comments:
#
#  Be careful these PPs might have problems.
#

Kind regards,
Pietro Bonfa'




On 04/04/13 10:13, mohnish pandey wrote:
> Dear QE users,
> 
> Does anybody have Mn PAW PP. I checked on QE PP database but its not
> available. If anybody of you have it, can you please provide me? Thanks
> a lot in advance.
> 
> -- 
> Regards,
> MOHNISH,
> -----------------------------------------------------------------
> Mohnish Pandey,
> PhD Student,
> Center for Atomic Scale Materials Design,
> Department of Physics,
> Technical University of Denmark
> -----------------------------------------------------------------
> 
> 
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-- 
Pietro Bonfa' - PhD student
Dipartimento di Fisica e Scienze della Terra "Macedonio Melloni"
Viale delle Scienze 7A
43124 Parma - Italy



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