[QE-users] Error in average.x

Ubaid Mohd onlymubaid at gmail.com
Tue Mar 12 13:53:51 CET 2019


Actually sir my input file is
1
bpcn.pot
1.D0
1440
3
3.835000000
Before doing this I use the pp.in as:
&inputpp
    outdir = 'BPC3N'
    prefix = 'bl'
    filplot = 'bpcn.pot'
    plot_num = 11
  /
  &plot
     iflag = 3
     output_format = 5

  /
it gave me bpcn.pot file

*Mohammad Ubaid*
*PhD Research Scholar*
*Department of Physics*
*Jamia Millia Islamia University*
*New Delhi - 110025*


On Tue, Mar 12, 2019 at 5:23 PM Giovanni Cantele <
giovanni.cantele at spin.cnr.it> wrote:

> quite strange, the file looks ok, are you sure that this is just the input
> you’re using? Maybe any special (hidden) character
> is present in the file?
>
> I tried to run average.x with your input and it works, in that it passes
> the line that gives you the error and of course complains
> about the inexistent WS2.pot file (as it should do).
>
> Giovanni
>
> On 12 Mar 2019, at 12:41, Ubaid Mohd <onlymubaid at gmail.com> wrote:
>
> Dear All QE Users,
>
> I am using the average.x now and the read the input file as follow :
>
> 1
> WS2.pot1.D0
> 1440
> 31.461144408
>
> but when run this it has the follow error:
>
>      Error in routine average (1):
>      nfile is wrong
>
> nfile should be right, I have read the source file, only when nfile <=0
> or >7 will show this error, but in my input file it is set to be 1. Would
> you please give me some suggestion on what might be the issue? Thanks very
> much.
>
> Best wishes
> *Mohammad Ubaid*
> *PhD Research Scholar*
> *Department of Physics*
> *Jamia Millia Islamia University*
> *New Delhi - 110025*
> _______________________________________________
> users mailing list
> users at lists.quantum-espresso.org
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>
>
> --
>
> Giovanni Cantele, PhD
>
> CNR-SPIN
> c/o Dipartimento di Fisica
> Universita' di Napoli "Federico II"
> Complesso Universitario M. S. Angelo - Ed. 6
> Via Cintia, I-80126, Napoli, Italy
>
> e-mail: giovanni.cantele at spin.cnr.it <giovanni.cantele at spin.cnr.it>
>             gcantele at gmail.com
> Phone: +39 081 676910
> Skype contact: giocan74
> Web page: https://sites.google.com/view/giovanni-cantele
>
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