[CP2K:1401] Core level shift

[Marcella Iannuzzi]

Dear Carlo,

I have many examples of input-files to simulate core level spectroscopy
with GAPW and using all-electron calculations.
Core level spectroscopy done within the pseudo-potential approximation  
is not implemented in
CP2K.
ciao
Marcella

On 6 Oct 2008, at 11:53, c.pignedoli wrote:

>
> Dear all,
> does anybody have an input example  to compute core level shifts in
> GPW?
>
> Thanks in advance,
>
> Carlo
>
>
>
> >