[Pw_forum] Error in routine Broyden
Paolo Giannozzi
paolo.giannozzi at uniud.it
Thu Oct 17 17:57:25 CEST 2013
On Wed, 2013-10-16 at 15:49 +0300, Elio Physics wrote:
> Error in routine broyden (1):
> factorization
unfortunately this is a very tough error to solve.
It usually points to really bad convergence problems,
due to a weird system, or bad pseudopotentials
P.
--
Paolo Giannozzi, Dept. Chemistry&Physics&Environment,
Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
Phone +39-0432-558216, fax +39-0432-558222
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