[Pw_forum] ATOMIC_POSITIONS after 'final coordinates'

[Xijun Wang]

Thanks Paolo.
If this is true, then the 'final coordinates' is not actually final.

-Xijun

On Wed, Sep 7, 2011 at 11:45 AM, Paolo Giannozzi <giannozz at democritos.it> wrote:
> Most likely the damped dynamics algorithm updates the
> atomic positions one last time before printing them
>
> P.
> ---
> 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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