[Pw_forum] PDOS

[Karoly Nemeth]

Hi,

please ignore my previous request as I have found the answer on a previous 
PWSCF forum site 
(http://www.democritos.it/pipermail/pw_forum/2004-May/001081.html).

Thanks:

Karoly

On Tue, 13 Jan 2009, Karoly Nemeth wrote:

>
> Hi,
>
> I recently calculated PDOS of a system using the pseudopotential file 
> Ni.pbe-nd-rrkjus.UPF. The output does not contain any PDOS for 4P of Ni, only 
> PDOS for atomic orbitals occupied in the Ni 3d9 4s1
> electron configuration (used in the pseudopotential file) are given. Is there 
> any way to set up the PROJWFC calculation such that it delivers the missing 
> PDOS (for 4P of Ni) as well?
> Thanks:
>
> Karoly
>
>
>