Local curvature, or bending, of a graphene sheet is known to increase the chemical reactivity presenting an opportunity for templated chemical functionalisation. Using first-principles calculations based on density functional theory (DFT), we investigate the reaction barrier reduction for the adsorption of atomic hydrogen at linear bends in graphene. We find a significant barrier lowering (≈15%...

Leveraging nanotechnology for computing opens up exciting new avenues for breakthroughs. For example, graphene is an emerging nanoscale material and is believed to be a potential candidate for post-Si nanoelectronics due to high carrier mobility and extreme scalability. Recently, a new graphene nanoribbon crossbar (xGNR) device was proposed which exhibits negative differential resistance (NDR)....

Armchair graphene nanoribbons are considered unsuitable for spin caloritronic applications, due to the lack of intrinsic magnetism. Inspired by progress on fabricating carbon nanotubes with Janus edges Bets et al. (2019) [26], we construct edges, where one edge is armchair type and other possesses triangular protrusions zigzag-armchair or zigzag-zigzag sub-edges. By first-principles calculation...

graphene nanoribbon: A theoretical study Z. F. Wang, Qunxiang Li, Q. W. Shi, Xiaoping Wang, Jinlong Yang, J. G. Hou, and Jie Chen Hefei National Laboratory for Physical Sciences at Microscale, University of Science and Technology of China, Hefei, Anhui 230026, People’s Republic of China Department of Electrical and Computer Engineering, University of Alberta, AB T6G 2V4, Canada and National Res...

Abstract Graphene nanoribbons synthesized using bottom-up approaches can be structured with atomic precision, allowing their physical properties to precisely controlled. For applications in quantum technology, the manipulation of single charges, spins or photons is required. However, achieving this at level graphene experimentally challenging due difficulty contacting individual nanoribbons, pa...

A graphene nanoribbon with zigzag edges has a gapped magnetic ground state with an antiferromagnetic interedge superexchange interaction. We present a theory based on asymptotic properties of the Dirac-model ribbon wave function which predicts W-2 and W-1 ribbon-width dependencies for the superexchange interaction strength and the charge gap, respectively. We find that, unlike the case of conve...

Graphene nanoribbons display an imperfectly understood transport gap. We measure transport through nanoribbon devices of several lengths. In long (>/=250 nm) nanoribbons we observe transport through multiple quantum dots in series, while shorter (</=60 nm) constrictions display behavior characteristic of single and double quantum dots. New measurements indicate that dot size may scale with cons...