On Jan 14, 2013, at 17:19 , Nandan Tandon wrote: > does kpoints.x generate MP grid points?
I think so > I thought that since it's a uniform grid, the ranges of K_x, K_y > and K_z > would be identical and symmetric. i.e. for e.g. K_x varying between > -1.25 to 1.25 etc have a look at the complete list of k-points (not just those in the Irreducible Brillouin Zone). It will look more similar to what you expect. P. --- Paolo Giannozzi, Dept of Chemistry&Physics&Environment, Univ. Udine, via delle Scienze 208, 33100 Udine, Italy Phone +39-0432-558216, fax +39-0432-558222
