[QE-users] Error in seqopn

precious Ekwere preciousekwere01 at gmail.com
Sat Jan 16 03:06:44 CET 2021


Thank you for your email.

Yes I use windows 10

And my QE is v 6.4.1

Thank you
Precious

On Fri, Jan 15, 2021, 1:45 PM Paolo Giannozzi <p.giannozzi at gmail.com> wrote:

> Are you by any chance running on Windows? which QE version?
>
> Paolo
>
> On Fri, Jan 15, 2021 at 11:59 AM precious Ekwere <
> preciousekwere01 at gmail.com> wrote:
>
>> Good day all,
>>
>>
>>
>> I am very new to computational chemistry and have just downloaded  QE I
>> tried to run an SCI calculation with the attached input script but keep
>> getting the error message
>>
>>  %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
>>      Error in routine seqopn (99):
>>      error opening ./out/\aiida.save\paw.txt
>>  %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
>>
>> I also tried to run relax following a youtube video, and I am getting
>> this error message.
>>
>>
>>
>> %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
>>
>>      Error in routine seqopn (99):
>>
>>      error opening ./out/\aiida.save\paw.txt
>>
>> %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
>>
>> I do not have an idea how to resolve this, and will appreciate your help.
>>
>>
>>
>> Regards,
>>
>> Precious Ekwere
>>
>>
>> _______________________________________________
>> Quantum ESPRESSO is supported by MaX (www.max-centre.eu)
>> users mailing list users at lists.quantum-espresso.org
>> https://lists.quantum-espresso.org/mailman/listinfo/users
>
>
>
> --
> 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
>
> _______________________________________________
> Quantum ESPRESSO is supported by MaX (www.max-centre.eu)
> users mailing list users at lists.quantum-espresso.org
> https://lists.quantum-espresso.org/mailman/listinfo/users
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