My Community

Im working in Monolayer graphene.

In graphene supercell, two sheets are separated by 15 ang. Is it correct using two sheets in a unit cell, or need to build single sheet in a unitcell. And, My band structure for the graphene supercell doesnot give as reported.

For that what shall i do?

Thank You

Each of the two sheets separated by 15A behaves as a single sheet. It is therefore enough to work with just a single sheet. The band-structure of a supercell is not identical with that of the irreducible cell because of the band folding.

Thank You very much sir