[Pw_forum] Getting error in pp.x run

[Paolo Giannozzi]

Not sure why it doesn't apear in the printout, but if you look for the
message "read above" where it occurs (file PP/src/chdens.f90), you will
find the following lines:

             WRITE(stdout,'(/"BEWARE: plot requiring G-space
interpolation",&
                            &" not implemented for Gamma only!",/, &
                            &"SOLUTION: restart this calculation with", &
                            &" emtpy namelist &inputpp")')
             CALL errore ('chdens','Not implemented, please read above',1)


Paolo

On Mon, Apr 25, 2016 at 11:59 AM, Sourav Mondal <souravchembwn at gmail.com>
wrote:

> Dear Sirs,
>
>   I want to generate STM images using Quantum espresso but I am facing
> difficulties in running pp.x. I have run a scf calculation to generate
> output files before running pp.x. scf calculation was terminated
> normally.But when I have tried to run the pp.x, I got the following type of
> error
>
>
>
>
>
>
> *%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%     Error in
> routine chdens (1):     Not implemented, please read
> above %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
> stopping .*..
>
> I have tried to run with different version of espresso but in every case I
> got the same error.
>
> I am attaching files with this mail  :
>
> 1. input for scf calculation
> 2.input for pp.x run
> 3. output of pp.x
>
> Input for scf has 545 atomic coordinates. This is an input for a slab
> calculation of two layer thickness.
>
> Please help me to sort out this problem.
>
> Thanks
> --------------------------------------------
> Sourav Mondal
> PhD Student
> JNCASR , Bangalore
> Pin- 560064
> India
>
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>



-- 
Paolo Giannozzi, Dip. Scienze Matematiche Informatiche e Fisiche,
Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
Phone +39-0432-558216, fax +39-0432-558222
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