[DFTB-Plus-User] DFTB+ stopped with no errors
Bálint Aradi
balint.aradi at bccms.uni-bremen.de
Wed Jun 11 01:07:09 CEST 2014
Dear Riccardo,
On 06/10/2014 08:42 PM, Riccardo Petraglia wrote:
> It solved the problem... is it the runtime slower with this keyword?
No, it is not. Usually DivideAndConqer and RelativelyRobust are
comparable in speed. In the next version of the code, the
RelativelyRobust solver will be probably the default one anyway, due to
this annoying bug in LAPACK's divide and conquer routine.
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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