[Pw_forum] SCF calculation don' converge for surface slab

patriot pershing science35 at gmail.com
Mon Nov 12 09:35:02 CET 2012


i talk on energy convergence of the system

2012/11/12 Paolo Giannozzi <giannozz at democritos.it>

> On Mon, 2012-11-12 at 08:12 +0100, patriot pershing wrote:
>
> > however the convergence was failed
>
> convergence of what?
>
>
> --
> Paolo Giannozzi, IOM-Democritos and University of Udine, Italy
>
>
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