Facile band gap tuning in graphene-brucite heterojunctions.

ABSTRACT: The zero band gap of pure graphene is a well-known issue that limits some specific applications of graphene in opto- and microelectronics. This led to several research studies in the so-called van der Waals composites (known as heterostructures, or heterojunctions), where two monolayers of different materials are stacked and held together by dispersive interactions. In this paper, we introduced and considered a single layer of brucite Mg(OH)₂, an overlooked 2D material that can be easily produced by exfoliation (like graphene from graphite), for the creation of the heterojunction. First principles simulations showed that brucite/graphene composites can modify the electronic properties (position of the Dirac cone with respect to the Fermi level and band gap) according to the crys

SUBMITTER: Ulian G 

PROVIDER: S-EPMC10754930 | biostudies-literature | 2023 Dec

REPOSITORIES: biostudies-literature