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The theory of optical effects in hydrogenated graphene (graphane) in terahertz and infrared range is developed, including the analysis of complex conductivity, reflection coefficient for graphane on a substrate and dispersion of surface…

Mesoscale and Nanoscale Physics · Physics 2022-10-19 E. I. Preobrazhensky , I. V. Oladyshkin , M. D. Tokman

We here report a detailed high-pressure infrared transmission study of BiTeCl and BiTeBr. We follow the evolution of two band transitions: the optical excitation $\beta$ between two Rashba-split conduction bands, and the absorption $\gamma$…

Materials Science · Physics 2017-01-18 I. Crassee , F. Borondics , M. K. Tran , G. Autès , A. Magrez , P. Bugnon , H. Berger , J. Teyssier , O. V. Yazyev , M. Orlita , A. Akrap

Edge states in narrow quasi two-dimensional nanostructures determine, to a large extent, their electric, thermoelectric and magnetic properties. Non-magnetic edge states may quite often lead to topological insulator type behavior. However…

Mesoscale and Nanoscale Physics · Physics 2017-10-31 Stefan Krompiewski , Gianaurelio Cuniberti

A first-principles study has been performed to evaluate the electronic and optical properties of wurtzite Zn1-xCdxO up to x=0.25. We have employed the Perdew-Burke-Ernzerhof (PBE) form of generalized gradient approximation within the…

Materials Science · Physics 2012-10-02 X. D. Zhang , M. L. Guo , W. X. Li , C. L. Liu

By modifying the density of optical states at the location of an emitter, weak cavity-emitter coupling can enable a host of potential applications in quantum optics, from the development of low- threshold lasers to brighter single-photon…

Optics · Physics 2011-11-03 Kasey J. Russell , Tsung-Li Liu , Shanying Cui , Evelyn L. Hu

We report optical enhancement in polarization and dielectric constant near room temperature in Pb0.6Li0.2Bi0.2Zr0.2Ti0.8O3 (PLBZT) electro-ceramics; these are doubly substituted members of the most important commercial ferroelectric…

Materials Science · Physics 2017-06-27 Hitesh Borkar , Vaibhav Rao , M Tomar , Vinay Gupta , J. F. Scott , Ashok Kumar

We have calculated the effects of structural distortions of armchair carbon nanotubes on their electrical transport properties. We found that the bending of the nanotubes decreases their transmission function in certain energy ranges and…

Mesoscale and Nanoscale Physics · Physics 2015-06-25 A. Rochefort , F. Lesage , D. R. Salahub , Ph. Avouris

A novel method for the direct correlation at the nanoscale of structural and optical properties of single GaAs nanowires is reported. Nanowires consisting of 100% wurtzite and nanowires presenting zinc-blende/wurtzite polytypism are…

We present a theoretical study of Ge-core/Si-shell nanocrystals in a wide bandgap matrix and compare the results with experimental data obtained from the samples prepared by co-sputtering. The empirical tight-binding technique allows us to…

Mesoscale and Nanoscale Physics · Physics 2017-03-07 M. O. Nestoklon , A. N. Poddubny , P. Voisin , K. Dohnalova

In this work we analyze the electronic structure at the junction between a SrTiO3 (001) single crystal and a thin tetragonal CuO layer, grown by off-axis RF-sputtering. A detailed characterization of the film growth, based on atomic force…

Samarium doped Na$_2$O-ZnO-TeO$_2$ (NZT) glasses were prepared by the melt quenching method. The glass-forming ability and glass stability of prepared glass was estimated by Hruby parameter using Differential Thermal Analysis (DTA) and…

The discovery of two-dimensional (2D) materials possessing switchable spontaneous polarization with atomic thickness opens up exciting opportunities to realize ultrathin, high-density electronic devices with potential applications ranging…

Materials Science · Physics 2020-11-04 Jiawei Huang , Sang-Hoon Lee , Andrew Supka , Young-Woo Son , Shi Liu

A first-principles study on the quasiparticles energy and optical absorption spectrum of fluorographene is presented by employing the GW + Bethe-Salpeter Equation (BSE) method with many-electron effects included. The calculated band gap is…

Mesoscale and Nanoscale Physics · Physics 2019-06-05 Yufeng Liang , Li Yang

Highly dispersive photonic band-gap-edge optofluidic biosensors are studied theoretically. We demonstrate that these structures are strongly sensitive to the refractive index of the liquid, which is used to tune dispersion of the photonic…

Optics · Physics 2007-05-23 Sanshui Xiao , Niels Asger Mortensen

We observe significant effects of structural distortion on electronic and optical properties of CdGa_2X_4 (X = S, Se, Te) defect chalcopyrite. The calculation is carried out within Density functional theory based tight binding linear muffin…

Materials Science · Physics 2015-12-09 Surabala Mishra , Biplab Ganguli

The electronic structure and chemical bonding in reactively magnetron sputtered ZrHx (x=0.15, 0.30, 1.16) thin films with oxygen content as low as 0.2 at% are investigated by 4d valence band, shallow 4p core-level and 3d core-level X-ray…

Materials Science · Physics 2017-11-07 Martin Magnuson , Susann Schmidt , Lars Hultman , Hans Högberg

A GW calculation based on a truncated Coulomb interaction with an added small q limit was applied to 2D van der Waals heterolayered structures, and the Kane dispersion model was used to determine the accurate band gap edge. All ab initio…

Materials Science · Physics 2025-06-25 Eyasu Tadesse Muda , Tewodros Eyob Ada , Kenate Nemera Nigussa , Cecil N. M. Ouma

The electronic structure of finite-length armchair carbon nanotubes has been studied using several ab-initio and semi-empirical quantum computational techniques. The additional confinement of the electrons along the tube axis leads to the…

Materials Science · Physics 2007-05-23 Alain Rochefort , Dennis R. Salahub , Phaedon Avouris

The complex optical properties of the iron-chalcogenide superconductor FeTe0.55Se0.45 with Tc=14K have been examined over a wide frequency range for light polarized in the Fe-Te(Se) planes above and below Tc. At room temperature the optical…

Superconductivity · Physics 2010-11-02 Christopher C. Homes , Ana Akrap , Jinsheng Wen , Zhijun Xu , Zhi Wei Lin , Qiang Li , Genda Gu

Angle resolved photoemission spectroscopy is used to observe changes in the electronic structure of bulk-doped topological insulator Cu$_x$Bi$_2$Se$_3$ as additional copper atoms are deposited onto the cleaved crystal surface. Carrier…

Superconductivity · Physics 2015-06-16 L. A. Wray , S. Xu , M. Neupane , A. V. Fedorov , Y. S. Hor , R. J. Cava , M. Z. Hasan