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 - Universit? 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/
