[DFTB-Plus-User] an error in running DFTB_MPI

Bálint Aradi aradi at uni-bremen.de
Fri Oct 3 10:00:32 CEST 2014


Dear Xiaobao Zhang,

it still seems to be some error with your local MPI installation. Did
you manage to run the hello_world MPI example correctly?

Also, unrelated, but please note, that you do not have to provide the
input dftb_in.hsd on stdin to dftb+, it would read it automatically from
the local directory, so

mpirun -np 4 ./dftbmpi+

should suffice. But, this is definitely not related to the MPI problems
there. I'd suggest to contact the local system administrator for some help.

  Best regards,

  Bálint


-- 
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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