[Pw_forum] band structure

[Lorenzo Paulatto]

On Mon, 08 Nov 2010 08:31:04 +0100, bayo mus <abmus911 at yahoo.ie> wrote:
> From the examples i learnt so far on QE about band structure, I observed  
> that they r just fore simple system Si Ni Al e.t.c Please I want to ask  
> if QE can be used to calculate the band structure of systems like SiO2,  
> ZnO, KAl Si3O8 e.t.c.

Dear Musari,
those are just examples, of course you can compute the band structure for  
any material.


> If yes then I would be grateful for any materials that would be of  
> assistance.

The procedure is exactly the same as in the examples. If you have any  
specific problem, please ask.

best regards


-- 
Lorenzo Paulatto
post-doc @ IMPMC/UPMC - Université Paris 6
phone: +33 (0)1 44 27 74 89
www:   http://www-int.impmc.upmc.fr/~paulatto/

previously (take note of the change!):
phd student @ SISSA  &  DEMOCRITOS (Trieste)
phone: +39 040 3787 511
www:   http://people.sissa.it/~paulatto/