Among graphene-like family, phosphorene is a typical semiconducting layered material, which can also be a superconductor in low temperature. Applying pressure or tension on phosphorene lattice results in changing the hopping terms, which change the energy bands of the material. In this research we use the tight-binding Hamiltonian, including relevant hopping terms, to calculate energy bands of ...

to investigate the electromagnetic interaction of molecules inside the nanotubes, first, the structure of nanotubes b16n16 was optimized with hybrid density functional theory (b3lyp) using the epr-ii basis set, then cu, cu+, cu++ were located in nanotube and we studied the total energy, band gap energy, electrical potential, changes of band gap energy in terms of total energy and dipole moment ...

Cadmium oxide (CdO) thin films were deposited on the glass substrate by the modified SILAR method, using cadmium acetate dihydrate and ammonium hydroxide aqueous solution as precursors. The structural, surface morphological, elemental composition and optical properties of the deposited films were investigated via X-Ray Diffraction (XRD), scanning electron microscopy, EDAX,...

Thin films of binary Bi 0 -TeO and Bi 0 -V 0 systems were prepared by the thermal co-evaporation technique in a vacuum at room temperature. The optical absorption edge of these systems are studied in the wavelength of 200-800 nm using a PERKIN-ELMER uv/Vis spectrophotometer. It is found that the value of n=3/2 in the Davis-Mott equation is best fitted for the fundamental absorption edge f...

Data from the H1 detector at HERA have been used to study photoproduction events which have two or more jets. The data were taken in 1996 and correspond to an integrated luminosity of 6.63 pb−1. Events were studied in the photon-proton centre of mass energy range 165 GeV < W < 243 GeV and with Q < 0.01 GeV. Jets were defined using the longitudinally invariant kt algorithm. Events selected had o...

Cr(1-x)Al(x) exhibits semiconducting behavior for x = 0.15-0.26. This Letter uses hard x-ray photoemission spectroscopy and density functional theory to further understand the semiconducting behavior. Photoemission measurements of an epitaxial Cr(0.80)Al(0.20) thin film show several features in the valence band region, including a gap at the Fermi energy (E(F)) for which the valence band edge i...

the structure and the electronic properties of single-walled zigzag bn and b3c2n3 nanotubes (n, 0; n=4–10) were investigated using first-principles calculations based on a density functional theory. a plane–wave basis set with periodic boundary conditions in conjunction with vanderbilt ultrasoft pseudo-potential was employed. the energy gap of zb3c2n3nts was calculated and compared with the cor...

Spatially resolved electron-energy-loss scattering has been used to study changes in the inelastic scattering near the bulk band-gap energy for locations near the GaAs-Ga0. 85Ino. [5As interface. %e observe the expected bulk band gap on either side of the interface. At a single interface-misfit dislocation we observe scatterIng which is consistent with an excitation of transitions between a loc...