plotting PDOS

Marco synerg... at
Fri May 9 22:56:25 UTC 2014


You need to have the other python script ( in the working directory 
in which you are running the script. 
For example in Linux it would be something like:
mv pdos.txt
mv get-smearing-pdos.txt

python ALPHA.pdos BETA.pdos  

Hopefully that works.


On Friday, May 9, 2014 5:48:39 PM UTC-4, mohamed khuili wrote:
> Thanks Marco for your reply, 
> I tried with this script, but I do not get the output file 'smeared.dat'. 
> is that this script is available with all versions of cp2k? or I need to 
> introduce something to the PDOS section
> thank you very much
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