[DFTB-Plus-User] Is the MPI parallel version dftb+ available now

Bálint Aradi balint.aradi at bccms.uni-bremen.de
Fri Jun 14 15:20:54 CEST 2013


On 06/13/2013 10:47 PM, Mingtao Li wrote:
> *Hi, dftb+ers,
> 
> I got to know that a mpi parallel version dftb+ is under development
> from this mailing list. Is the MPI parallel version dftb+ available
> now. I really want to use it to speed my molecular dynamics
> simulations. Thank you very much.

Yes it exists, it even seems to work well, but I still polish it and
need some testing. I'll try to make a snapshot available at the end of
this month.

  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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