we study the coherent spin-polarized transport through a zigzag-edge graphene flake (zgf), using hubbard model in the nearest neighbor approximation within the framework of the green function’s technique and landauer formalism. the system considered consists of electrode/ (zgf)/electrode, in which the electrodes are chosen to be armchair nanoribbons. the study was performed for two types of ele...

sp(2)-Bonded boron nitride aerogels are synthesized from graphene aerogels via carbothermal reduction of boron oxide and simultaneous nitridation. The color and chemical composition of the original gel change dramatically, while structural features down to the nanometer scale are maintained, suggesting a direct conversion of the carbon lattice to boron nitride. Scanning and transmission electro...

We study hydrogen chemisorption at full coverage and low concentrations on hexagonal boron nitride (h-BN). Chemisorption trends reveal the complex nature of hydrogenation. Barriers for diffusion are found to be significantly altered by the presence of additional H atoms. Moreover, the presence of a Stone-Wales defect may dramatically enhance the bond strength of H to the h-BN surface. These fin...

A simple method is presented for exfoliating and suspending hexagonal boron nitride using a co-solvent approach. A 60 w/w% concentration of tert-butanol in water is very effective at exfoliating boron nitride especially when compared to the individual components alone as indicated by UV-vis and transmission electron microscopy. Molecular weight and surface tension are found to play inverse role...

We present experimental evidence that the room temperature thermal conductivity (kappa) of individual multiwalled carbon and boron-nitride nanotubes does not obey Fourier's empirical law of thermal conduction. Because of isotopic disorder, kappa's of carbon nanotubes and boron-nitride nanotubes show different length dependence behavior. Moreover, for these systems we find that Fourier's law is ...

We propose an analytical formulation to extract from energy equivalence principles the equivalent thickness and in-plane mechanical properties (tensile and shear rigidity, and Poisson's ratio) of hexagonal boron nitride (h-BN) nanosheets. The model developed provides not only very good agreement with existing data available in the open literature from experimental, density functional theory (DF...

Boron nitride nanoribbons (BNNRs) have very attractive electrical and optical properties due to their unique edge states and width-related properties. Herein, for the first time, BNNRs were produced by a simple reflux of boron nitride nanotubes (BNNTs) in nitric acid containing water, which had led to unzipped sidewalls through hydrolysis. Their high reactivity that originated from edges was ve...

This study focuses on hexagonal boron nitride as an ultra-thin van der Waals dielectric substrate for the epitaxial growth of highly ordered crystalline networks of the organic semiconductor parahexaphenyl. Atomic force microscopy based morphology analysis combined with density functional theory simulations reveal their epitaxial relation. As a consequence, needle-like crystallites of parahexap...

The first molecular dynamics (MD) study was conducted to explore mechanical-failure response of ultrafine grained single-layer boron-nitride films. We used MD simulations to construct relatively large molecular models of polycrystalline structures with random grain configurations. By applying uniaxial tensile loading, we then studied the grain size effect on the mechanical response of polycryst...