[Pw_forum] eigenvalues not converged
Paolo Giannozzi
giannozz at democritos.it
Sun Jun 21 13:47:05 CEST 2009
On Jun 21, 2009, at 7:20 , Mozahar Ali wrote:
> WARNING: 3 eigenvalues not converged
> ...
> ethr = 4.35E-11, avg # of iterations = 41.4
> But run is complete successfully.
> Is it serious error?
please see the user guide, troubleshooting section, item 1.26
P.
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Paolo Giannozzi, Dept of Physics, University of Udine
via delle Scienze 208, 33100 Udine, Italy
Phone +39-0432-558216, fax +39-0432-558222
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