Computer Simulation of Spin Filtration Properties of Zigzag-Edged Octagraphene Nanoribbon Saturated with Hydrogen Atoms
Sign Up to like & getrecommendations! Published in 2020 at "Russian Physics Journal"
DOI: 10.1007/s11182-020-02036-0
Abstract: The paper deals with the properties of octagraphene nanoribbon determined in terms of the local spin density approximation and nonequilibrium Green’s function, namely transmission spectra, current–voltage characteristics (I–V curves), and differential conductivity of the zigzag-edged… read more here.
Keywords: octagraphene nanoribbon; edged octagraphene; spin; hydrogen atoms ... See more keywords
Structural, electronic, and magnetic properties of zigzag-edged BN nanoribbons with 558-type line defects
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DOI: 10.1016/j.orgel.2017.02.022
Abstract: Abstract The 558-type line defect is introduced into zigzag-edged BN nanoribbons (ZBNNRs), similar to that be found in graphene, and the structural, electronic, and magnetic properties for such defective ZBNNRs are investigated systematically. It shows… read more here.
Keywords: line defect; line; edged nanoribbons; type line ... See more keywords
Hydrogen Adsorption on Nearly Zigzag-Edged Nanoribbons: A Density Functional Theory Study
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DOI: 10.1038/s41598-017-14189-z
Abstract: The realistic shapes of N doped graphene nanoribbons (GNRs) can be realized by considering nearly zigzag-edged (NZE) imperfections and pyridine defects (3NV). The paper focuses on NZE-GNRs with 3NV that is populated by Scandium abbreviated… read more here.
Keywords: density functional; hydrogen; nze 3nvgnrs; nearly zigzag ... See more keywords