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Further optical properties of CdX (X¼ S, Te) compounds under quantum dot diameter effect: Ab initio method
(Elsevier Ltd., 2012-09)
For energy band calculations, the indirect energy gap (G X) is calculated using density functional theory
(DFT) of the full potential-linearized augmented plane wave (FP-LAPW) method as implemented in
WIEN2K code. The ...
First-principles calculations to investigate optical properties of B yAl xIn 1-x-yN alloys for optoelectronic devices
(Elsevier Ltd., 2012-03)
First-principles density-functional theory of Full-Potential Linear Augmented Plane Wave (FP-LAPW) within local density approximation (LDA) of the optical properties of B yAl xIn 1- x-yN systems (with x = 0.187 and y = ...
Morphology, analysis and properties studies of CdS nanostructures under thiourea concentration effect for photovoltaic applications
(Electrochemical Science Group, 2013-08)
CdS nanostructures are prepared by sol-gel spin coating method using different thiourea concentrations. The thiourea concentration effect for CdS nanostructures deposited on quartz substrate is studied. The CdS nanostructures ...
Electronic band structure and optical properties of titanium oxyphosphates Li0.50Co0.25TiO(PO4) single crystals: An ab-initio calculations
(Elsevier Inc., 2011-08)
From the refined atomic positions obtained by Belmal et al. (2004) using X-ray diffraction for Li0.50Co0.25TiO(PO4), we have performed a structural optimization by minimizing the forces acting on the atoms keeping the ...
FP-LAPW investigation of structural, electronic, linear and nonlinear optical properties of ZnIn2Te4 defect-chalcopyrite
(Elsevier B. V., 2010-12)
A theoretical study of structural, electronic, linear and nonlinear optical properties of ZnIn2Te4 defect-chalcopyrite is presented using the full-potential linearized augmented plane-wave (FP-LAPW) method. The exchange ...