[Pw_forum] Changing nr3

[Varadharajan Srinivasan]

Dear all,

Thanks. I suspected this was the problem but was confused by the fact that
earlier versions seem to allow the change. And as far as I could tell I
didn't get an error in the output file (in 5.0.2).

Anyway, it works will all the nr's specified. The Si example was a for
instance but my real system is tetragonal so I needed to change only the
nr3.

Thanks,
Vardha.

On Sat, Mar 2, 2013 at 6:38 PM, Lorenzo Paulatto <
lorenzo.paulatto at impmc.upmc.fr> wrote:

> You must set all the three dimensions: nr1, nr2 and nr3 for your
> setting to be taken in account. In the most recent versions of the
> code there is a warning in the output if you specify only one of the
> dimensions, I'll add a comment in the manual too.
>
> best regards
>
>
>
> --
> Dr. Lorenzo Paulatto
> IdR @ IMPMC -- CNRS & Université Paris 6
> phone: +33 (0)1 44275 084 / skype: paulatz
> www:   http://www-int.impmc.upmc.fr/~paulatto/
> mail:  23-24/4é16 Boîte courrier 115, 4 place Jussieu 75252 Paris Cédex 05
>
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