[Thermo_pw-forum] related to thermo_pw

[Andrea Dal Corso]

This question has been already discussed in the forum,
please check previous answers.

Andrea

Quoting anisha lamba <anishalamba2 at gmail.com>:

> Greetings,
> Please suggest me, how can we calculate the elastic constant of 2D system
> using thermo_pw?
> i will be very thankful to you
> i got an error
>
> %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
>      Error in routine initialize_elastic_cons (1):
>      Laue class not available
>   
> %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
>
>      stopping ...
> --------------------------------------------------------------------------
> MPI_ABORT was invoked on rank 2 in communicator MPI_COMM_WORLD
> with errorcode 1.
>
> NOTE: invoking MPI_ABORT causes Open MPI to kill all MPI processes.
> You may or may not see output from other processes, depending on
> exactly when Open MPI kills them.