[Wien] LAPW2C stop

Laurence Marks L-marks at northwestern.edu
Mon Mar 12 00:44:00 CET 2012


The structure you are using is cubic, not primitive. Therefore that is
what you should do.

You need to read carefully the user guide. Maybe someone has notes in
languages other than English (French?) that might be useful to you --
if so they should respond.

On Sun, Mar 11, 2012 at 11:30 AM, Zahia Aboub <aboubz at yahoo.com> wrote:
> I using the primitive cellBecause we dent nospacegroup for Ni doped SrTiO3 are youknow? give mi pease
>
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-- 
Professor Laurence Marks
Department of Materials Science and Engineering
Northwestern University
www.numis.northwestern.edu 1-847-491-3996
"Research is to see what everybody else has seen, and to think what
nobody else has thought"
Albert Szent-Gyorgi


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