Try and reduce your nanoribbon to the smallest unit cell possible. This will prevent you from getting folded bands.
2016-04-29 13:49 GMT+02:00 RAJAN SINGH <[email protected]>: > Dear Siesta Users > > I am trying to implement the PRB paper attach with this mail, I am unable > to figure out why my results are not matching. > > My input fdf file as well as output E-k plot file (nanoribbon.dat) both > are attached with this mail. > > Kindly help me with this problem, I will be highly obliged. > > Thanking you > > With regards > Rajan Singh > > > > -- Kind regards Nick
