[Pw_forum] ATOMIC_POSITIONS after 'final coordinates'

[Xijun Wang]

On Wed, Sep 7, 2011 at 4:54 AM, Paolo Giannozzi <giannozz at democritos.it> wrote:
>
> On Sep 7, 2011, at 1:35 , Xijun Wang wrote:
>
>> There is an extra "ATOMIC_POSITIONS" section after the "final
>> coordinates". It is neither the final coordinates
>
> why are you saying this? P.

Because they are different.  -XJ

> ---
> Paolo Giannozzi, Dept of Chemistry&Physics&Environment,
> Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
> Phone +39-0432-558216, fax +39-0432-558222
>
>
>
>
> _______________________________________________
> Pw_forum mailing list
> Pw_forum at pwscf.org
> http://www.democritos.it/mailman/listinfo/pw_forum
>



-- 
Department of Chemistry and Biochemistry, Concordia University
7141 Sherbrooke Ouest, Montreal, QC H4B 1R6
Tel: 514-848-2424-#5835 (Lab) TA office: SP175.23