Electronic properties of edge-functionalized zigzag graphene nanoribbons on SiO2substrate

D M Zhang, Z Li, J F Zhong, L Miao, J J Jiang
2011 Nanotechnology  
Based on first-principles calculations, electronic properties of edge-functionalized zigzag graphene nanoribbons (ZGNRs) on SiO2 substrate are presented. Metallic or semiconducting properties of ZGNRs are revealed due to various interactions between edge-hydrogenated ZGNRs and different SiO2 (0001) surfaces. Bivalent functional groups decorating ZGNRs serve as the bridge between active edges of ZGNRs and SiO2. These functional groups stabilize ZGNRs on substrate, as well as modify the edge
more » ... s of ZGNRs and further affect their electronic properties. Band gaps are opened owing to edge states destruction and distorted lattice in ZGNRs.
doi:10.1088/0957-4484/22/26/265702 pmid:21576802 fatcat:r2xnqd3dz5fcxarxvjds7h5rhy