In data 31 luglio 2009 alle ore 16:25:39, Manoj Srivastava <manoj at phys.ufl.edu> ha scritto:
> Dear All, > I was wondering if someone can tell me, how to generate k point weights > in the BZ. Reference of a paper would be great! Dear Manoj, you can find the algorithm tha tgenerates points and weights in pwtools/kpoints.f The obvious reference is the original article from Monkhorst and Pack: Phys. Rev. B 13, 5188 - 5192 (1976), although I don't know if they give an explicit formulation for the weights there (weights depend on how many symmetry-equivalent copies of a point are present in the set, not on the generation algorithm). cheers -- Lorenzo Paulatto SISSA & DEMOCRITOS (Trieste) phone: +39 040 3787 511 skype: paulatz www: http://people.sissa.it/~paulatto/ *** save italian brains *** http://saveitalianbrains.wordpress.com/
