In data 21 ottobre 2011 alle ore 07:50:39, mohnish pandey <mohnish.iitk at gmail.com> ha scritto: > The automatically generated k-points may not be in the high symmetry > direction in which one may want to plot the band structure. Am I right?
Indeed, i did not notice it was a band calculation.. yet the points chosen by Debbichi are not forming a typical BZ path either; I guess everybody is free to put his k-points wherever he wishes :-) -- Lorenzo Paulatto IdR @ IMPMC/UPMC CNRS & Universit? Paris 6 phone: +33 (0)1 44275 084 / skype: paulatz www: http://www.impmc.upmc.fr/~paulatto/ mail: 23-24/4?14 Bo?te courrier 115, 4 place Jussieu 75252 Paris C?dex 05
