Browsing School of Microelectronic Engineering (Articles) by Author "Kityk, I. V."
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Density functional calculations, electronic structure, and optical properties of molybdenum bimetallic nitrides Pt2Mo3N and Pd2Mo3N
Ali Hussain, Reshak, Prof. Dr.; Auluck, S.; Kityk, I. V. (American Chemical Society, 2011-04-07)The electronic band structure, origin of chemical bonds, and dispersion of linear optical susceptibilities for Pt2Mo3N and Pd 2Mo3N have been investigated within the framework of density functional theory (DFT). The atomic ... -
Dispersion of linear and nonlinear optical susceptibilities and the hyperpolarizability of 3-methyl-4-phenyl-5-(2-pyridyl)-1,2,4-triazole
Ali Hussain, Reshak; Stys, D.; Auluck, S.; Kityk, I. V. (Royal Society of Chemistry (RSC) Publishing, 2011-02-21)As a starting point for our calculation of 3-methyl-4-phenyl-5-(2-pyridyl)- 1,2,4-triazole we used the XRD data obtained by C. Liu, Z. Wang, H. Xiao, Y. Lan, X. Li, S. Wang, Jie Tang, Z. Chen, J. Chem. Crystallogr., 2009 ... -
Electronic properties of orthorhombic LiGaS2 and LiGaSe 2
Reshak, Ali H.; Auluck, S.; Kityk, I. V.; Yarub K.A, Al-Douri; Khenata, R.; Bouhemadou, A. (Springer Berlin/Heidelberg, 2009)We report theoretical calculations of the band structure and density of states for orthorhombic LiGaS2 (LGS) and LiGaSe2 (LGSe). These calculations are based on the full potential linear augmented plane wave (FP-LAPW) ... -
First-principles calculations of structural, elastic, electronic, and optical properties of perovskite-type KMgH3 crystals: Novel hydrogen storage material
Ali Hussain, Reshak, Prof. Dr.; Mikhail Y., Shalaginov; Yasir, Saeed; Kityk, I. V.; Auluck, S. (American Chemical Society, 2011-03-31)We report a first-principles study of structural and phase stability in three different structures of perovskite-types KMgH3 according to H position. While electronic and optical properties were measured only for stable ... -
Photoinduced absorption and nonlinear optics of triglycine selenate single crystals under uniaxial pressure
Ozga, K.; Ali Hussein, Reshak, Prof. Dr.; Berdowski, J.; Tylczyński, Z.; Wojciechowski, A.; Ślȩzak, A.; Kityk, I. V. (Elsevier B.V., 2011-06-15)We studied an influence of uniaxial pressure on the triglycine selenate single crystals during simultaneous illumination by the continuous wave 532 laser at power about 300 mW. Simultaneously we have studied two-photon ... -
Photoinduced effects in TiO2 nanocrystalline films with different morphology
Djaoued, Yahia; Ozga, K.; Wojciechowski, A.; Ali H. Reshak, Al-Jaary; Robichaud, J.; Kityk, I. V. (Elsevier B. V., 2010-10-22)The complex studies of photoinduced absorption, second harmonic generation and third harmonic generation were performed for TiO2 films of different morphology. In particular we have studied the influence of a bicolor laser ...