[Pw_forum] Getting error in pp.x run

[Arles V. Gil Rebaza]

dear Sourav, the prefix='Au_Ge' of the PP input file, must be equal of the
SCF input file (prefix = 'Au_Ge-stm'). Please read the QE manual.

Best

Arles V. GIl Rebaza
IFLP - Argentina.

2016-04-25 6:59 GMT-03:00 Sourav Mondal <souravchembwn at gmail.com>:

> 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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