[Pw_forum] folder corresponding to outdir is empty

dario rocca roccad at gmail.com
Thu Mar 9 07:47:18 CET 2017


Dear Kajal,
try by removing disk_io = 'none'
Best,
Dario Rocca

On Wed, Mar 8, 2017 at 9:35 PM, Kajal Jindal <kajalmh18 at gmail.com> wrote:

> Dear pwscf users,
>
> I am trying to calculate the band structure of BFO. The scf calculation
> runs successfully. However, the folder corresponding to outdir is empty
> after scf calculation. So, i am unable to proceed with bands calculation.
> Output file of bands calculation stops with the following error:
>
> Error in routine pw_readfile(1):
> Error opening xml datafile.
>
> I am attaching the scf input and output files along.
>
> Kindly suggest the problem.
>
> Regards,
> Kajal Jindal,
> University of Delhi
> India
>
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> Pw_forum at pwscf.org
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>
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