[Pw_forum] write a xsf file using pwi2xsf.sh
tone.kokalj at ijs.si
Fri Feb 10 16:37:05 CET 2012
On Thu, 2012-02-09 at 13:00 +0000, dt378 at bath.ac.uk wrote:
> I have just started to use Espresso so I apologise if my question is a
> bit silly.
> I would like to convert my input file in a xsf format but I can't.
> This is the error it punch out:
> chpc-aw7:zns davidetiana$ ~/espresso-4.3.2/pwtools/pwi2xsf.sh zns1.in
> At line 426 of file pwi2xsf.f
> Fortran runtime error: End of file
You compiled the pwi2xsf.f with new version of gfortran (e.g.
gfortran-4.6), right? It does not compile properly.
The code was adopted in the "failing" part. I attach the corrected
J. Stefan Institute, Jamova 39, 1000 Ljubljana, Slovenia
(tel: +386-1-477-3523 // fax:+386-1-477-3822)
Please, if possible, avoid sending me Word or PowerPoint attachments.
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