Recent advances in experimental techniques allow for the fabrication of hybrid structures.
Here, we study the electronic and molecular adsorption properties of the graphene
(G)/hexagonal boron nitride (h-BN)-MXenes (Mo 2 C) hybrid nanosheets. We use first-
principles calculations to explore the structure and electronic properties of the hybrid
structures of G-2H-Mo 2 C and h-BN-2H-Mo 2 C with two different oxygen terminations of the
Mo 2 C surface. The embedding of G or h-BN patches creates structural defects at the patch …

Recent advances in experimental techniques allow for the fabrication of hybrid structures.
Here, we study the electronic and molecular adsorption properties of the graphene
(G)/hexagonal boron nitride (h-BN)-MXenes (Mo2C) hybrid nanosheets. We use first-
principles calculations to explore the structure and electronic properties of the hybrid
structures of G-2H-Mo2C and h-BN-2H-Mo2C with two different oxygen terminations of the
Mo2C surface. The embedding of G or h-BN patches creates structural defects at the patch …