[DFTB-Plus-User] Update MPI-branch

Bálint Aradi balint.aradi at bccms.uni-bremen.de
Mon Sep 9 12:35:47 CEST 2013


Dear all,

for those who are interested in the MPI-version, I uploaded a recent
snapshot (r4473) of the MPI-development-branch. This fixes the problem
of concurrent writing of the charges.bin file by different processes,
which lead to a significant delay time at the end of every total energy
calculation.

  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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