[Pw_forum] Error in routine cdiaghg S matrix not positive definite
giannozz at democritos.it
Tue Sep 25 08:18:00 CEST 2012
On Sep 24, 2012, at 22:28 , Jennifer Wohlwend wrote:
> Parallel version (MPI), running on 32 processors
> R & G space division: proc/pool = 32
32 processors for crystal Al? wow!
As a rule, parallellism should work even for too many processors,
but if you push the code into extreme regions, it may still fail.
Paolo Giannozzi, Dept of Chemistry&Physics&Environment,
Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
Phone +39-0432-558216, fax +39-0432-558222
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