[Pw_forum] problems with examples

Paolo Giannozzi giannozz at democritos.it
Wed Sep 21 18:13:47 CEST 2011


On Wed, 2011-09-21 at 10:29 -0500, Jose Luis Gordillo Ruiz wrote:

>   serial in both cases (internal and MKL)

I see; I had the version with EXX compiled. It is an unfortunate
case in which at the very end a too small convergence threshold 
is set, resulting in non-convergence.

P.
-- 
Paolo Giannozzi, IOM-Democritos and University of Udine, Italy





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