[QE-users] error in routine read_conf_from_file

Mehboob Alam mehboob.cu at gmail.com
Sun Feb 21 20:43:57 CET 2021


Dear Paolo,

Thank you very much for your reply. I understand the error. But I checked
the folder it indeed has the data-file-schema.xml file. It would be great
if a solution is suggested.

Best Regards,
Dr. Md. Mehboob Alam
Assistant Professor
Department of Chemistry
IIT Bhilai, India


On Sat, Feb 20, 2021 at 7:39 PM Paolo Giannozzi <p.giannozzi at gmail.com>
wrote:

> On Fri, Feb 19, 2021 at 10:47 PM Mehboob Alam <mehboob.cu at gmail.com>
> wrote:
>
> I'm trying to run an NSCF calculation on a test system. I've already run
>> SCF befor this calculation and the data-file-schema.xml is already present
>> in a directory.
>>
>
> the code doesn't think so:
>
> > xml data file ./outdir/pwscf.save/data-file-schema.xml not found
>
> Paolo
> --
> Paolo Giannozzi, Dip. Scienze Matematiche Informatiche e Fisiche,
> Univ. Udine, via delle Scienze 206, 33100 Udine, Italy
> Phone +39-0432-558216, fax +39-0432-558222
>
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