[DFTB-Plus-User] Error regarding
Bálint Aradi
aradi at uni-bremen.de
Fri Oct 20 10:03:01 CEST 2023
Dear Dr. K. Raja,
I think the error is obvious: The feature had not been implemented yet.
Actually, we are actively working on it, but it might take some time,
until this enters the main branch...
Best regards,
Bálint
On 18.10.23 13:15, karreddula RAJA wrote:
>
> good Afternoon sir
> i got error when i am trying dftb plus
>
> ERROR!
> -> Linear response calc. does not work with MPI yet
> Abort(1) on node 0 (rank 0 in comm 0): application called
> MPI_Abort(MPI_COMM_WORLD, 1) - process 0
> how can i overcome this problem?
>
> --
> Thanks & Regards:
> Dr. K. Raja
>
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--
Dr. Bálint Aradi
Bremen Center for Computational Materials Science, University of Bremen
http://www.bccms.uni-bremen.de/cms/people/b-aradi/
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