[Pw_forum] folder corresponding to outdir is empty

Kajal Jindal kajalmh18 at gmail.com
Thu Mar 9 10:18:13 CET 2017


Thanks a lot sir..It works now.

Regards,
Kajal Jindal

On 09-Mar-2017 12:17 pm, "dario rocca" <roccad at gmail.com> wrote:

> 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 mailing list
>> Pw_forum at pwscf.org
>> http://pwscf.org/mailman/listinfo/pw_forum
>>
>
>
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