[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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