Browsing School of Materials Engineering (Articles) by Author "zalahmed@ksu.edu.sa"
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DFT calculation of the electronic and optical properties of Ag 2PdO2 from X-ray and neutron crystallographic data
Zeyad A., Alahmed; Ali Hussain, Reshak, Prof. Dr. (Elsevier B.V., 2013)Electronic and optical properties of ternary silver palladium oxide (Ag2PdO2) are investigated using density functional theory. Two different possible approximations for the exchange correlation potentials were employed. ... -
DFT calculation of the electronic structure and optical properties of two strontium germanium nitrides: α-Sr2GeN2 and β-Sr2GeN2
Zeyad A., Alahmed; Ali Hussain, Reshak, Prof. Dr. (Elsevier B.V., 2013-05-15)The existence of α-Sr2GeN2 and β-Sr 2GeN2 were reported recently with their structural properties. In this paper, electronic and optical properties have been investigated using density functional theory. The Perdew-Burke-Ernzerhof ...