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

[Sujata Paul]

Hi,

I have a molecule adsorbed on metal[Pd-(001)] surface.
I was trying to do a Post Processing (pp.x) using "plot_num=9".
I used /espresso-4.0.4. I got this error:

%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
     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.

After I got this error I tried the "plan_avg.x" executable with this input
file:
=========================================
 &inputpp
    prefix='*',
    outdir = './'
    filplot = '*.psi-plan_avg.pot',
/
=========================================
This produced the output file without any CRASH file in the directory. The
output file stops after it wrote the usual header. In the directory there
is a "*.psi-plan_avg.pot" file but it was empty.

So I don't understand what is wrong? Please help me.

-- 
SUJATA PAUL
GRADUATE STUDENT
PHYSICS DEPARTMENT
NORTH CAROLINA STATE UNIVERSITY
USA