[Pw_forum] monkhorst-pack grid

Ezad Shojaee ezadshojaee at hotmail.com
Wed May 9 16:20:33 CEST 2007

i have an amateur question !
when i read the monkhorst-pack article, i can not realize what is the input of the algorithme except 'q' which is the # of special points of the lattice. so does this algorithme needs the # of special points?! i thought that when we specify n1 n2 n3 in the auto-K_POINTS in the code, these #'s are going to make the grid !
News, entertainment and everything you care about at Live.com. Get it now!
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20070509/3d9538d3/attachment.html>

More information about the users mailing list