[Pw_forum] pseudopotentials
Gabriele Sclauzero
sclauzer at sissa.it
Tue May 26 09:47:21 CEST 2009
Dear Sanjeev,
even if someone has all three ready for you (though i doubt it could be possible), I
hope you are well aware of the difficulties in threating such kind of elements (i.e.
Lanthanides, which have open-shell 4f electrons in valence) within DFT.
GS
Sanjeev K. Gupta wrote:
> Dear PWSCF Users,
>
> Please can anyone sent me pseudopotentials for praseodymium, Promethium
> and Samarium.
>
>
> Regards
> Sanjeev Gupta
>
> S. K. Gupta
>
> PhD Candidate,
>
> Dept. of Physics,
>
> Bhavnagar University.
>
> Bhavnagar, 364 002., Gujarat.
>
>
> <http://sigads.rediff.com/RealMedia/ads/click_nx.ads/www.rediffmail.com/signatureline.htm@Middle?>
>
>
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| Gabriele Sclauzero, PhD Student |
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