On Jul 14, 2009, at 23:21 , jtmullen at ncsu.edu wrote: > I have a need to generate k points which cover the complete first > BZ, not > just the irreducible BZ. I notice a subroutine in PW/ > kpoint_grid.f90 which > returns k points in the IBZ given grid dimensions (nk1, nk2, nk3)
and in the complete BZ if you answer "t" to the question "write all k" P. --- Paolo Giannozzi, Dept of Physics, University of Udine via delle Scienze 208, 33100 Udine, Italy Phone +39-0432-558216, fax +39-0432-558222
