On Nov 6, 2007, at 13:48 , Guoying Gao wrote: > [...] I didn't know how to choose the high-symmetry qpoints > in the first irreducible Brillouin zone. Does anyone know this?
it is explained in textbooks. One book that contains everything you may want to know about symmetry in solids is "The mathematical theory of symmetry in solids", by Bradley and Cracknell. It is a tough book, though. Paolo --- Paolo Giannozzi, Dept of Physics, University of Udine via delle Scienze 208, 33100 Udine, Italy Phone +39-0432-558216, fax +39-0432-558222
