Dear Ashkan,
Yes, due to back-folding - unless you perform the "back-folding". Jonas
Björk told me that they have a public code for doing this and it should
also work with QE (I have not tried it myself though, even if I should
have applied it recently - sorry Jonas!)
Greetings,
apsi
-=*=-=*=-=*=-=*=-=*=-=*=-=*=-=*=-=*=-=*=-=*=-=*=-=*=-=*=-=*=-=*=-=*=-=*=-=*=-
Ari Paavo Seitsonen / [email protected] / http://www.iki.fi/~apsi/
Ecole Normale Supérieure (ENS), Département de Chimie, Paris
Mobile (F) : +33 789 37 24 25 (CH) : +41 79 71 90 935
On Wed, 6 Apr 2016, ashkan shekaari wrote:
Dear QE users,
Does the 2*2 supercell of mos2 monolayer have a different band structure than
that of the single unit cell?
--
Best regards,
Ashkan Shekaari
Plasma Physics Research Center, Science and Research Branch,
I A U, 14778-93855 Tehran, Iran.
Mobile: +98 (933) 459 7122
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