[Pw_forum] (no subject)
Stefano de Gironcoli
degironc at sissa.it
Mon Mar 24 06:06:59 CET 2003
On the vanderbilt's US pseudopotential page (linked to from the PWSCF
pseudopotential page) there is the input file to generate a
pseudopotential for Ru (perdew-wang 91).
If you need another XC it should be rather straightforward to modify the
input accordingly.
Don't forget to have a look to the provided tranferibility tests.
stefano
Raghani Pushpa wrote:
>Dear users,
>
>Could you please tell me, where can I get the pseudopotential for Ru atom
>from?
>
>Thanks,
>Pushpa
>
>
>
>
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