ABSTRACT

Graphene demonstrates unique mechanical, electronic, and magnetic properties that can be varied by size and chirality. The peak near the Fermi level for all structures typical for armchair graphene can be clearly seen. The graphs clearly show high density of states for all types of composites, which indicate the prospects of these materials in different applications. Methods of mathematical modeling are helpful for studying properties of graphene/graphane nanostructures. By the method of molecular dynamics on the basis of the adaptive intermolecular reactive empirical bond order potential, mathematical models of graphene/graphane composites with different types of packing were derived. The main role in optical properties of graphene/graphane superlattices is played by the graphene’s width and the graphane’s coplanar states of 2px, 2py. It was found that all considered superlattices demonstrated high reflective polarization along with low reflectivity and high transmissivity, which is good for application in ultraweak photon emission source.