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Dear Professor Paulatto,<BR>
<BR>
thanks for bringing this up. Indeed, I was plotting the band energies of the regukar k grid instead. Everything seems right now..<BR>
<BR>
Regards<BR>
<BR>
Elie<BR> <BR>> To: pw_forum@pwscf.org<BR>> Date: Thu, 30 Sep 2010 17:46:39 +0200<BR>> From: Lorenzo.Paulatto@impmc.upmc.fr<BR>> Subject: Re: [Pw_forum] Bilayer graphene with an electric field applied<BR>> <BR>> In data 30 settembre 2010 alle ore 15:30:01, Elie Moujaes <BR>> <elie.moujaes@hotmail.co.uk> ha scritto:<BR>> > The thing is there are no problems in the DOS calculations; only in the <BR>> > band structure.<BR>> <BR>> Are you sure you did a proper band plot along a path in the Brillouin zone <BR>> (like example01) and not just plot of the band energies of the regular <BR>> grid of k-points?<BR>> <BR>> regards<BR>> <BR>> -- <BR>> Lorenzo Paulatto<BR>> post-doc @ IMPMC/UPMC - Université Paris 6<BR>> phone: +33 (0)1 44 27 74 89<BR>> www: http://www-int.impmc.upmc.fr/~paulatto/<BR>> <BR>> previously (take note of the change!):<BR>> phd student @ SISSA & DEMOCRITOS (Trieste)<BR>> phone: +39 040 3787 511<BR>> www: http://people.sissa.it/~paulatto/<BR>> _______________________________________________<BR>> Pw_forum mailing list<BR>> Pw_forum@pwscf.org<BR>> http://www.democritos.it/mailman/listinfo/pw_forum<BR> </body>
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