[PDF][PDF] Band-structure calculations of GaAs within semiempirical large unit cell method

HR Jappor - European Journal of Scientific Research, 2011‏ - researchgate.net
Self-consistent within the framework of large unit cell (LUC) formalism of eight atoms using
intermediate neglect of differential overlap (INDO) is used to simulate electronic band …

OLIFE: tight binding code for transmission coefficient calculation

ZY Mijbil - Journal of Physics: Conference Series, 2018‏ - iopscience.iop.org
A new and human friendly transport calculation code has been developed. It requires a
simple tight binding Hamiltonian as the only input file and uses a convenient graphical user …

Stress reduction in cubic boron nitride by oxygen addition: Explanation of the mechanism by ab-initio simulations

J Houska, S Ulrich - Surface and Coatings Technology, 2012‏ - Elsevier
We report ab-initio calculations of the effect of oxygen addition on the characteristics of c-BN.
We focus on the lattice constants, bulk modulus, cohesive energy, stress and on the …

Heat dissipation property of cover glasses with heat sink films for transparent organic light-emitting diodes

JW Park, JH Lee - Semiconductor Science and Technology, 2014‏ - iopscience.iop.org
We investigate the thermal property of cover glasses with heat sink films and provide useful
design guidelines of heat sinks for transparent organic light-emitting diodes (OLEDs). To this …

[PDF][PDF] Structural properties and temperature dependence of phase transition point of zinc blende clusters: BN, BP, AlN, and AlP

ZY Mijbil - Chemistry and Materials Research, 2012‏ - academia.edu
Ab initio calculation with restricted Hartree-Fock method (RHF) for eight-atom zinc blende
lattices (BN, BP, AlN, and AlP) has been used to study the structural properties and the …

[PDF][PDF] Size Variation Effect of In1-xAlxP Nanocrystal Alloying Composition Using Density Functional Theory

AK Kaka - 2015‏ - researchgate.net
Firstly, I would like to express my gratefulness and appreciation to University of Baghdad,
College of Science, Head, Profs. and all the group members of the thin film at the …

[HTML][HTML] ATTI DELLA" FONDAZIONE GIORGIO RONCHI" ANNO LXVII, 2012-N. 2

KHB AL-AMMAR, HR JAPPOR… - Atti Della Fondazione …‏ - books.google.com
We present the structural and electronic properties of GaAs under the effect of pressure
using large unit cell method within the framework of intermediate neglect of differential …