[ase-users] Building primitive cell

[Tristan Maxson]

I implemented this originally so I will go ahead and update the
documentation.  The module was moved a while back, eventually there might
be a gui element for this as well.  Thanks for reporting this problem.

Thank you,
Tristan Maxson

On Tue, Apr 25, 2017 at 5:21 PM, utsab via ase-users <
ase-users at listserv.fysik.dtu.dk> wrote:

> Hi Korina,
>
>
> Thanks for the reply.
>
>
>
> Regards,
>
> Utsab
> ------------------------------
> *From:* Korina Kuhar <Kokuha at fysik.dtu.dk>
> *Sent:* 25 April 2017 14:52:15
> *To:* Guharoy U Mr (PG/R - Chem. & Proc. Eng.);
> ase-users at listserv.fysik.dtu.dk
> *Subject:* RE: Building primitive cell
>
> Hi Utsab,
>
> For me it works:
> from ase.build.root import root_surface
>
> I believe things have been moves around but not documented.
> Maybe someone could update the example?
>
>
> Best regards,
> korina
>
> Korina Kuhar
> PhD student
> DTU Physics
>
>
> Technical University of Denmark
> Department of Physics
> Fysikvej
> Building 307
> 2800 Kgs. Lyngby
> Denmark
> Direct +45 45253293 <+45%2045%2025%2032%2093>
> kokuha at fysik.dtu.dk
> www.fysik.dtu.dk
> ------------------------------
> *From:* ase-users-bounces at listserv.fysik.dtu.dk [
> ase-users-bounces at listserv.fysik.dtu.dk] on behalf of utsab via ase-users
> [ase-users at listserv.fysik.dtu.dk]
> *Sent:* Tuesday, April 25, 2017 2:40 PM
> *To:* ase-users at listserv.fysik.dtu.dk
> *Subject:* [ase-users] Building primitive cell
>
> Dear All,
>
>
> I am a beginner in ASE. I actually want to build a (3x3)  3
> layer primitive cell for
>
> Ni 111 surface. I was trying to run the example of Ag given under root
> _surface
>
> building primitive cell, but I am getting the following error;
>
>
>
> from ase.lattice.root import root_surface
> ImportError: No module named root
>
> I will be very grateful for any suggestions!
>
> With best regards,
>
> Utsab Guharoy
> PhD student
> University of Surrey, U.K
>
>
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