[QE-users] dmat.exe error

[Максим Чекулаев]

Yes, it's Windows. I used singe quot (')

чт, 2 июл. 2020 г., 10:04 Paolo Giannozzi <p.giannozzi at gmail.com>:

> Are you working on windows? be careful with single quotes (') vs inverted
> quotes (`) vs apostrophe ( ’)
>
> Paolo
>
> On Thu, Jul 2, 2020 at 6:13 AM Максим Чекулаев <mchs89 at gmail.com> wrote:
>
>> Greetings,
>>
>> I'm trying to do dynmat.exe after ph.exe calculation and getting "Error
>> in routine dynmat (1): reading input namelis".
>>
>> Here is the input:
>> &input
>> fildyn = 'matdyn'
>> /
>>
>> and output:
>>
>>      Program DYNMAT v.6.2 starts on  2Jul2020 at  0:10:12
>>
>>      This program is part of the open-source Quantum ESPRESSO suite
>>      for quantum simulation of materials; please cite
>>          "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009);
>>          "P. Giannozzi et al., J. Phys.:Condens. Matter 29 465901 (2017);
>>           URL http://www.quantum-espresso.org",
>>      in publications or presentations arising from this work. More
>> details at
>>      http://www.quantum-espresso.org/quote
>>
>>      Parallel version (MPI & OpenMP), running on      12 processor cores
>>      Number of MPI processes:                 1
>>      Threads/MPI process:                    12
>>
>>      MPI processes distributed on     1 nodes
>>
>>
>>  %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
>>      Error in routine dynmat (1):
>>      reading input namelist
>>
>>  %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
>>
>>      stopping ...
>>
>> job aborted:
>> [ranks] message
>>
>> [0] application aborted
>> aborting MPI_COMM_WORLD (comm=0x44000000), error 1, comm rank 0
>>
>> Tried to do with "-in" before the input file, result is the same.
>>
>> What else should I write in the input file or in the command line to make
>> this calculation?
>>
>> --
>> With all the best wishes, Maksim Chekulaev
>>
>> _______________________________________________
>> Quantum ESPRESSO is supported by MaX (www.max-centre.eu/quantum-espresso)
>> 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 208, 33100 Udine, Italy
> Phone +39-0432-558216, fax +39-0432-558222
>
> _______________________________________________
> Quantum ESPRESSO is supported by MaX (www.max-centre.eu/quantum-espresso)
> users mailing list users at lists.quantum-espresso.org
> https://lists.quantum-espresso.org/mailman/listinfo/users
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