[Pw_forum] PP for Planar average of all |psi|^2

[Gabriele Sclauzero]

sujata Paul wrote:
> Dear Dr. Giannozzi,
>                   Thanks for your reply. I set the prefix properly from
> scf to PP calculation. When I wrote you earlier I just wanted to write
> the namelist and parameters I used for my calculations. Sorry for the
> inconvenience. 
> So could you please tell me how can I make the post processing work when
> I want to use plot_num=9?

It was written in the error message you posted at the beginning:

%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
      from punch_plot : error #         1
      no longer implemented, see PP/plan_avg.f90
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
So I guessed "plot_num=9" is not implemented in post processing.

You have to use the program plan_avg.x in place of pp.x for this task.
Though I never used it, from a glance to the source I guess it should be simple to use:

NAMELIST / inputpp / outdir, prefix, filplot

You simply need to specify these three strings...


GS




> 
> Thanks and Regards
> Sujata Paul  
> 
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