Liu, Try increasing the value of the 'maxb' parameter in gnubands.f, (increasing from 100 to something like 5000) and then re-compiling gnubands.f and then trying it again.
Best, On Mon, Nov 5, 2012 at 6:15 AM, liuyunlong0902 <[email protected]>wrote: > Dear all, > I have difficulty in post-processing the energy band. When the > generated '*.bands' file is handled by 'gnubands', warning is that > 'Dimensions in gnubands too small'. Would anyone help me solve the problem? > > Regards, > > --- > Liu > > -- *Abraham Hmiel* Katherine Belz Groves Fellow in Nanoscience Xue Group, College of Nanoscale Science and Engineering at SUNY Albany http://abehmiel.net/about
