Search Results - "Rezouali, K."
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Strong excitonic effects in hydrogen-graphene-fluorine janus graphene
Published in Physica Status Solidi. B: Basic Solid State Physics (01-04-2016)“…authoren We present a first‐principles many‐body Green's function method (GW approximation and Bethe–Salpeter equation) of the electronic and optical…”
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Ab Initio Study of Confinement and Surface Effects in AlN Nanowires
Published in Journal of physical chemistry. C (08-07-2010)“…Electronic structures and imaginary parts of dielectric functions of AlN nanowires are calculated using density functional theory. It is found that the surface…”
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Properties of neutral and charged cobalt-doped arsenic CoAsn(0±1) (n=1–15) clusters by density functional theory
Published in Computational and theoretical chemistry (15-08-2016)“…[Display omitted] •Structure of CoAsn differs from that of Asn+1 clusters.•Structures of charged CoAsn+ and CoAsn− differ from the corresponding neutral…”
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Ab initio study of confinement and surface effects in hexagonal AlN nanotubes
Published in Computational materials science (01-04-2009)“…Thickness dependence of electronic and optical properties of AlN nanotubes is studied using density functional theory. It is found that the surface atoms…”
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An ab initio Study of a Model of Single Wall GaN Nanotubes with Oxygen and Zinc as Impurities: Structural and Electronic Properties
Published in Acta physica Polonica, A (01-02-2008)Get full text
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Phonons in MoSe2/WSe2 van der Waals heterobilayer
Published 24-05-2021“…We report first-principles calculations of the structural and vibrational properties of the synthesized two-dimensional van der Waals heterostructures formed…”
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Electronic and magnetic properties of VOCl/FeOCl antiferromagnetic heterobilayers
Published 16-04-2021“…We study the electronic properties of the heterobilayer of vanadium and iron oxychlorides, VOCl and FeOCl, two layered air stable van der Waals insulating…”
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