[Pw_forum] how to choose high-symmetry q points in the first irreducible Brillouin zone

[Cyrille Barreteau]

Dear Gao,

You might find this web site useful:
http://www.cryst.ehu.es/cryst/get_kvec.html

  cyrille

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Guoying Gao wrote:

>Dear everyone,
>
>     I 'm doing the calculation of the band structure for monoclinic
>based-centered cell. I define the lattice vector through ibrav=0 and
>CELL PARAMETERS.
>However, when I do the calculation of  the band structure, I didn't
>know how to choose the high-symmetry qpoints in the first irreducible
>Brillouin zone. Does
>anyone know this? Any suggestions will be appreciated.
>Thanks in advance.
>Best wishes.
>                                       Gao
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>