Dear Dr Nick I got my results matched but I saw this in the out file:
superc: Internal auxiliary supercell: 1 x 1 x 6 = 6 superc: Number of atoms, orbitals, and projectors: 60 684 876 I put no of atoms as 10 Is somthing wrong? Thanking you With Regards Rajan On Fri, Apr 29, 2016 at 6:02 PM, RAJAN SINGH <[email protected]> wrote: > Dear Dr Nick thank you I will try to implement this as soon as possible. > > With Regards > Rajan Singh > > On Fri, Apr 29, 2016 at 5:27 PM, Nick Papior <[email protected]> wrote: > >> 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 >> > >
