[Pw_forum] Drawing 2D plane using XCRYSDEN

Jibiao Li jibiaoli at gmail.com
Wed Mar 10 19:30:31 CET 2010


pls specify two vectors in pp.input file for the plane of your interest
e.g. vector E1 and E2 represent the plane
e1(1)=1, e1(2)=1, e1(3)=0
e2(1)=0, e2(2)=0, e2(3)=0


On Wed, Mar 10, 2010 at 6:28 PM, Bipul Rakshit <bipulrr at gmail.com> wrote:

> Dear PWSCF users,
> I have a zince blende crystal ZnS. Now i want to see how the 110 plane
> (or any plane) in that crystal structure.
> So can anybody tell me how to ( with which command) to see a plane
> with the help of pwscf input file and xcrysden?
>
> To view the structure i am using
>
> xcrysden --pwi ZnS.scf.in
>
>
>
> --
> Bipul Rakshit
> Research Fellow,
> S N Bose Centre for Basic Sciences,
> Salt Lake,
> Kolkata 700 098
> India
> _______________________________________________
> Pw_forum mailing list
> Pw_forum at pwscf.org
> http://www.democritos.it/mailman/listinfo/pw_forum
>



-- 
Jibiao Li

AlbaNova University Center
Department of Physics
Stockholm University
Tel. :  08-55378720 (office)
Email: jibiaoli at gmail.com
         jibiao.li at hotmail.com
         jibiao at fysik.su.se
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