Browsing by Subject "Zinc"

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Open Access
Characterization of platinum nitride from first-principles calculations
(Institute of Physics Publishing, 2009) Yıldız, A.; Akıncı, Ü.; Gülseren, O.; Sökmen, İ.
We have performed a systematic study of the ground state properties of the zinc-blende, rock-salt, tetragonal, cuprite, fluorite and pyrite phases of platinum nitride by using the plane wave pseudopotential calculations within the density functional theory. The equilibrium structural parameters and bulk moduli are computed within both the local density approximation (LDA) and generalized gradient approximation (GGA). The comparison of the equation of state (EOS) calculated within the LDA for the pyrite structure with the experimental results demonstrates an excellent agreement, hence the use of the LDA rather than the GGA is essential. Complete sets of elastic moduli are presented for cubic forms. The analysis of the results reveal that the pyrite phase with PtN2 stoichiometry leads to the formation of a hard material with the shear modulus G = 206 GPa. The electronic structure of pyrite PtN2 is given, which shows a narrow indirect gap. The vibrational properties of platinum nitride are investigated in detail from lattice dynamical calculations. The calculations show that fluorite and pyrite structures are dynamically stable as well. However, the calculated vibrational modes of pyrite PtN2 do not show complete agreement with experimental Raman frequencies.
Open Access
Determination of trace element levels in human scalp hair in occupationally exposed subjects by XRF
(Akademiai Kiado Rt., 2001) Dede, Y.; Erten, H. N.; Zararsiz, A.; Efe, N.
Trace element levels in hair of individuals living in urban areas were determined by energy dispersive XRF. Two groups of subjects were investigated, the first group was assumed to be from a healthy environment, the other one was exposed to a high level of contamination due to working conditions. The results were compared to data reported in the literature. The concentrations of Ca, Fe, Cu, Zn and Pb in the scalp hair were determined and the correlation between hair trace element levels and environmental effects was discussed. The results given by the second group show that environmental exposure effects hair trace element levels which are related to body trace element concentrations.
Open Access
Effect of six weeks aerobic training upon blood trace metals levels
(2006) Savaş, S.; Şenel, Ö.; Çelikkan, H.; Uǧraş, A.; Aksu, M. L.
This study was carried out to investigate the effects of 6-week aerobic exercise program upon blood Zn and Cu levels. There were 12 male university students with an average age of 21.67+/-0.89 years and no regular training habits participated in the study. The participants were subjected three days a week 1 hour a day continuous running program on treadmill with an intensity of 60-70% for a period of six weeks. They were fed with zinc and copper free diet throughout the study and it was made sure that they were not using copper or zinc containing vitamin tablets. The difference between the pre and post study period were found to be statistically significant as regards to both resting and maximal loading conditions (p<0.01). The pre and post training maxVO2 values were also found to be positively correlated with the copper and zinc levels in blood. Both the copper and zinc blood levels were found decreased after the training period p<0.05.
Open Access
Electronic and magnetic properties of zinc blende half-metal superlattices
(A I P Publishing LLC, 2004) Fong, C. Y.; Qian, M. C.; Pask, J. E.; Yang, L. H.; Dag, S.
Zinc blende half-metallic compounds such as CrAs, with large magnetic moments and high Curie temperatures, are promising materials for spintronic applications. We explore layered materials, consisting of alternating layers of zinc blende half-metals, by first principles calculations, and find that superlattices of (CrAs)1(MnAs)1 and (CrAs)2(MnAs)2 are half-metallic with magnetic moments of 7.0mB and 14.0mB per unit cell, respectively. We discuss the nature of the bonding and half-metallicity in these materials and, based on the understanding acquired, develop a simple expression for the magnetic moment in such materials. We explore the range of lattice constants over which half-metallicity is manifested, and suggest corresponding substrates for growth in thin film form.
Open Access
Electronic properties of graphene nanoribbons doped with zinc, cadmium, mercury atoms
(Elsevier B.V., 2018) Ömeroğlu, O.; Kutlu, E.; Narin, P.; Lisesivdin, S. B.; Özbay, Ekmel
The effect of substitutional impurities as Zinc (Zn), Cadmium (Cd) and Mercury (Hg) on electronic properties of graphene nanoribbons (GNRs) was investigated by using Density Functional Theory (DFT). A substantial change in the electronic properties of GNR structures was observed while changing the position of dopant atom from the edge to the center of armchair graphene nanoribbons (AGNRs) and zigzag graphene nanoribbons (ZGNRs). The calculations are shown that the electronic band gap of GNRs can be controlled depending on the position of dopant atoms. The calculated electronic band structures for both AGNRs and ZGNRs show spin-dependent metallic or semiconductor behavior according to the position of dopant atoms. From the Density of States (DOS) information, quasi-zero-dimensional (Q0D) and quasi-one-dimensional (Q1D) type behaviors are observed. It is shown that because the doped ZGNRs had the lowest total energies, ZGNRs are energetically more stable than AGNRs.
Open Access
Evaluate of braze joint strength and microstructure characterize of titanium-CP with Ag-based filler alloy
(2012) Ganjeh, E.; Sarkhosh H.; Khorsand H.; Sabet H.; Dehkordi, E.H.; Ghaffari, M.
This research investigates the influences of brazing parameters (temperature and time) on microstructures and the mechanical properties of commercially pure (CP) titanium sheet when it is brazed with CBS34 (Ag-20Cu-22Zn-24Cd) braze filler foil. Brazing was performed in a conventional atmosphere control furnace. The brazing temperatures and holding times employed in this study were 800-870°C and 10-20min, respectively. The qualities of the brazed joints were evaluated by ultrasonic test and the microstructure and phase constitution of the bonded joints were analyzed by means of metallography, scanning electron microscope (SEM) and X-ray diffraction (XRD). The mechanical properties of brazed joints were evaluated by microhardness and shear tests. The diffusion between Ti, Ag, Cu, Zn and Cd from substrate and braze alloy, developed a strong reaction between each other. A number of intermetallic phases, such as TiCu and Ti2Cu in the Ag-Zn solid solution matrix have been identified especially at 870°C - 20min. Both the brazing temperature and the holding time are critical factors for controlling the microstructure and hence the mechanical properties of the brazed joints. The optimum brazing parameters was achieved at 870°C - 20min. Based on the shear test result, all cracks propagate along the brittle intermetallic compounds like Ti2Cu in the reaction layer which typically are composed of quasi-cleavage (Ag-Zn matrix) and brittle appearance. © 2012 Elsevier Ltd.
Open Access
Fast and quick degradation properties of doped and capped ZnO nanoparticles under UV-Visible light radiations
(Elsevier Ltd, 2016) Mittal, M.; Sharma, M.; Pandey, O. P.
Undoped and Manganese (Mn) doped zinc oxide (ZnO) (Zn1- xMnxO, x=0.005, 0.01, 0.015 and 0.02) nanoparticles (NPs) capped with (1.0%) Thioglycerol (TG) has been successfully synthesized by co-precipitation method. Optical and morphological studies have been done for photophysical and structural analysis of synthesized materials. The photocatalytic activity of undoped and Mn doped ZnO NPs were investigated by degradation of crystal violet (CV) dye under UV-Visible light radiations. It has been found that Mn (1.0%) doping concentration is optimal for photophysical and photocatalytic properties. When the pH of as synthesized optimum doped ZnO NPs varied from natural pH i.e. from 6.7 to 8.0 and 10.0, the degradation of CV dye increases from 92% to 95% and 98% in 180min respectively. Further on increasing the pH of optimum doped synthesized NPs to 12.0, almost 100% degradation has been achieved in 150min. Optimum doped photocatalyst synthesized at pH-12.0 has also effectively degraded the CV dye solution in acidic and basic medium thus showed its utility in various industries. However, it has been found that 100% of CV dye quickly degraded in 30min when only 1.0% of hydrogen peroxide (H2O2) was introduced along with optimized NPs synthesized at pH-12. Kinetic studies show that the degradation of CV dye follows pseudo first and second-order kinetic law. Further an industrial anionic polyazo Sirius red F3B (SRF3B) dye has been degraded to 100% with optimized NPs synthesized at pH-12.0 in 15min only.
Open Access
Induction of triacylglycerol production in Chlamydomonas reinhardtii: comparative analysis of different element regimes
(Elsevier, 2014) Çakmak, Z. E.; Ölmez, T. T.; Çakmak, T.; Menemen, Y.; Tekinay, T.
In this study, impacts of different element absence (nitrogen, sulfur, phosphorus and magnesium) and supplementation (nitrogen and zinc) on element uptake and triacylglycerol production was followed in wild type Chlamydomonas reinhardtii CC-124 strain. Macro- and microelement composition of C. reinhardtii greatly differed under element regimes studied. In particular, heavy metal quotas of the microalgae increased strikingly under zinc supplementation. Growth was suppressed, cell biovolume, carbohydrate, total neutral lipid and triacylglycerol levels increased when microalgae were incubated under these element regimes. Most of the intracellular space was occupied by lipid bodies under all nutrient starvations, as observed by confocal microscopy and transmission electron micrographs. Results suggest that sulfur, magnesium and phosphorus deprivations are superior to nitrogen deprivation for the induction triacylglycerol production in C. reinhardtii. On the other hand, FAME profiles of the nitrogen, sulfur and phosphorus deprived cells were found to meet the requirements of international standards for biodiesel.
Open Access
Low power zinc-oxide based charge trapping memory with embedded silicon nanoparticles via poole-frenkel hole emission
(2014) El-Atab, N.; Ozcan, A.; Alkis, S.; Okyay, Ali Kemal; Nayfeh, A.
A low power zinc-oxide (ZnO) charge trapping memory with embedded silicon (Si) nanoparticles is demonstrated. The charge trapping layer is formed by spin coating 2 nm silicon nanoparticles between Atomic Layer Deposited ZnO steps. The threshold voltage shift (ΔVt) vs. programming voltage is studied with and without the silicon nanoparticles. Applying -1 V for 5 s at the gate of the memory with nanoparticles results in a ΔVt of 3.4 V, and the memory window can be up to 8 V with an excellent retention characteristic (>10 yr). Without nanoparticles, at -1 V programming voltage, the ΔVt is negligible. In order to get ΔVt of 3.4 V without nanoparticles, programming voltage in excess of 10 V is required. The negative voltage on the gate programs the memory indicating that holes are being trapped in the charge trapping layer. In addition, at 1 V the electric field across the 3.6 nm tunnel oxide is calculated to be 0.36 MV/cm, which is too small for significant tunneling. Moreover, the ΔVt vs. electric field across the tunnel oxide shows square root dependence at low fields (E 1 MV/cm) and a square dependence at higher fields (E > 2.7 MV/cm). This indicates that Poole-Frenkel Effect is the main mechanism for holes emission at low fields and Phonon Assisted Tunneling at higher fields. © 2014 AIP Publishing LLC.
Open Access
Lyotropic liquid-crystalline mesophases of [Zn(H2O)6](NO3)2-C12EO10-CTAB-H2O and [Zn(H2O)6](NO3)2-C12EO10-SDS-H2O systems
(2008) Albayrak, C.; Soylu, A. M.; Dag, Ö.
The mixture of two surfactants (C12EO10-CTAB and C 12EO10-SDS) forms lyotropic liquid-crystalline (LLC) mesophases with [Zn(H2O)6](NO3)2 in the presence of a minimum concentration of 1.75 H2O per C 12EO10. The metal ion/C12EO10 mole ratio can be increased up to 8.0, which is a record high metal ion density in an LLC mesophase. The metal ion concentration can be increased in the medium by increasing the CTAB/C12EO10 or SDS/C12EO 10 mole ratio at the expense of the stability of the LLC mesophase. The structure and some thermal properties of the new mesophase have been investigated using XRD, POM, FTIR, and Raman techniques. © 2008 American Chemical Society.
Open Access
Near-IR-triggered, remote-controlled release of metal ions: A novel strategy for caged ions
(Wiley-VCH Verlag, 2014) Atilgan, A.; Eçik, E. T.; Guliyev, R.; Uyar, T. B.; Erbas-Cakmak, S.; Akkaya, E. U.
A ligand incorporating a dithioethenyl moiety is cleaved into fragments which have a lower metal-ion affinity upon irradiation with low-energy red/near-IR light. The cleavage is a result of singlet oxygen generation which occurs on excitation of the photosensitizer modules. The method has many tunable factors that could make it a satisfactory caging strategy for metal ions.
Open Access
Novel molecular building blocks based on the boradiazaindacene chromophore: applications in fluorescent metallosupramolecular coordination polymers
(2009) Bozdemir, Ö. A.; Büyükcakir, O.; Akkaya, E. U.
We designed and synthesized novel boradiazaindacene (Bodipy) derivatives that are appropriately functionalized for metal-ion-mediated supramolecular polymerization. Thus, ligands for 2-terpyridyl-, 2,6-terpyridyl-, and bipyridyl-functionalized Bodipy dyes were synthesized through Sonogashira couplings. These fluorescent building blocks are responsive to metal ions in a stoichiometry-dependent manner. Octahedral coordinating metal ions such as Zn II result in polymerization at a stoichiometry corresponding to two terpyridyl ligands to one Zn II ion. However, at increased metal ion concentrations, the dynamic equilibria are re-established in such a way that the monomeric metal complex dominates. The position of equilibria can easily be monitored by 1H NMR and fluorescence spectroscopies. As expected, although open-shell Fe II ions form similar complex structures, these cations quench the fluorescence emission of all four functionalized Bodipy ligands. © 2009 Wiley-VCH Verlag GmbH & Co. KGaA.
Open Access
Role of zinc interstitials and oxygen vacancies of ZnO in photocatalysis: a bottom-up approach to control the defect density
(Royal Society of Chemistry, 2014-06-09) Kayaci, F.; Vempati S.; Donmez, I.; Bıyıklı, Necmi; Uyar, Tamer
Oxygen vacancies (VOs) in ZnO are well-known to enhance photocatalytic activity (PCA) despite various other intrinsic crystal defects. In this study, we aim to elucidate the effect of zinc interstitials (Zn i) and VOs on PCA, which has applied as well as fundamental interest. To achieve this, the major hurdle of fabricating ZnO with controlled defect density requires to be overcome, where it is acknowledged that defect level control in ZnO is significantly difficult. In the present context, we fabricated nanostructures and thoroughly characterized their morphological (SEM, TEM), structural (XRD, TEM), chemical (XPS) and optical (photoluminescence, PL) properties. To fabricate the nanostructures, we adopted atomic layer deposition (ALD), which is a powerful bottom-up approach. However, to control defects, we chose polysulfone electrospun nanofibers as a substrate on which the non-uniform adsorption of ALD precursors is inevitable because of the differences in the hydrophilic nature of the functional groups. For the first 100 cycles, Znis were predominant in ZnO quantum dots (QDs), while the presence of VOs was negligible. As the ALD cycle number increased, VOs were introduced, whereas the density of Zni remained unchanged. We employed PL spectra to identify and quantify the density of each defect for all the samples. PCA was performed on all the samples, and the percent change in the decay constant for each sample was juxtaposed with the relative densities of Znis and VOs. A logical comparison of the relative defect densities of Znis and VOs suggested that the former are less efficient than the latter because of the differences in the intrinsic nature and the physical accessibility of the defects. Other reasons for the efficiency differences were elaborated.
Open Access
A sensitive and selective ratiometric near IR fluorescent probe for zinc ions based on the distyryl-bodipy fluorophore
(2008) Atilgan, S.; Ozdemir, T.; Akkaya, E. U.
(Chemical Equation Presented) A novel distyryl-substituted boradiazaindacene (bodipy) dye with an emission peak moving hypsochromically from 730 to 680 nm on Zn(II) ion binding seems to be promising as one of the very few water-soluble fluorescent chemosensors emitting in the near IR region. © 2008 American Chemical Society.
Open Access
Sorption behavior of Co2+, Zn2+ and Ba2+ ions on alumina, kaolinite and magnesite
(Kluwer Academic Publishers, 1994) Erten, H. N.; Gokmenoglu, Z.
The sorption behavior of Ba2+, Co2+ and Zn2+ ions on alumina, kaolinite and magnesite have been investigated using the batch method.60Co,65Zn and133Ba were used as radiotracers. The mineral samples were separated into different particle size fractions using an Andreasen Pipette. The particle sizes used in the sorption experiments were all less than 38 μm. Synthetic groundwaters were used which had compositions similar to those from the regions where the minerals were recovered. The samples were shaken with a lateral shaker at 190 rpm, the phases were separated by centrifuging and adioactivity counted using a NaI(Tl) detector. Kinetic studies indicated that sorption onto the minerals took place in two stages with the slower process dominating. The highest sorption was observed on alumina. Both Freundlich and Dubinin-Radushkevich type isotherms were found to describe the sorption process well. The distribution ratio, Rd was found to be a function of the liquid volume to solid mass ratio. The Rd's for sorption on binary mixtures of minerals were experimentally determined and compared with those predicted from Rd values of each individual mineral. © 1994 Akadémiai Kiadó.
Open Access
Spin-polarized ballistic transport in a thin superlattice of zinc blende half-metallic compounds
(The American Physical Society, 2005) Qian, M. C.; Fong, C. Y.; Pickett, W. E.; Pask, J. E.; Yang, L. H.; Dag, S.
We examine theoretically ballistic conduction in thin layers of zinc blende half metals, considering as an example a superlattice consisting of monolayers of GaAs and MnAs, a bilayer of CrAs, and a bilayer of GaAs. By artificially separating bilayers, we show that surface states thwart half metallicity. However, capping the metal-As bilayers restores half metallicity, and ballistic conduction of electrons within ∼0.3 eV of the Fermi level will give nearly 100% spin-polarized transmission in the direction of the superlattice. Recent developments suggest atomic layer epitaxy can be used to produce such thin layers for spintronic applications.
Open Access
Surface ionic states and structure of titanate nanotubes
(Royal Society of Chemistry, 2015) Vempati S.; Kayaci-Senirmak, F.; Ozgit Akgun, C.; Bıyıklı, Necmi; Uyar, Tamer
Here we present an investigation on Zn-Ti-O ternary (zinc titanate) nanostructures which were prepared by a combination of electrospinning and atomic layer deposition. Depending on the ZnO and TiO2 molar ratio, two titanates and one mix phased compound were synthesized by varying the post-annealing temperatures. Specifically Zn2TiO4, ZnTiO3 and ZnO/TiO2 nanostructures were fabricated via thermal treatments (900, 700, 800 °C, respectively). Structural studies unveiled the titanate phase of the nanostructures. Furthermore, the ionic states of the titanate nanostructures on the surface are revealed to be Ti3+ and Zn2+. Spin-orbit splitting of Zn2p and Ti2p doublets were, however, not identical for all titanates which vary from 23.09-23.10 eV and 5.67-5.69 eV respectively. Oxygen vacancies were found on the surface of all titanates. The valance band region was analyzed for Zn3d, Ti3p, O2s and O2p and their hybridization, while the edge (below Fermi level) was determined to be at 2.14 eV, 2.00 eV and 1.99 eV for Zn2TiO4, ZnTiO3 and ZnO/TiO2 respectively.
Open Access
Synthesis and optical properties of Co and Zn-based metal oxide nanoparticle thin films
(Polish Academy of Sciences, 2017) Gungor, E.; Gungor, T.; Calıskan, D.; Özbay, Ekmel
ZnO, Co doped ZnO (ZnO:Co) and CoO thin films were deposited on glass substrates by using the spark discharge technique with Zn-Zn, Zn-Co and Co-Co metal electrodes (tips). The structural and optical properties of the films were characterized by X-ray diffraction, scanning electron microscopy measurements and UV-Vis spectrometry. Cubic phase reflection of CoO (200) was observed in the samples containing Co. The size of nanoparticles had varied between 38 nm and 200 nm in ZnO thin films. When Co electrode was used, spherical structure had deteriorated and clusters of particles, with smaller radii, were observed. In addition, when Co-Co electrode pairs were used, various cavities with different sizes were formed. Especially, it was observed that the optical transmittance had generally increased with the decreasing spark (charge) voltage, while increasing with the number of sparks. The Co-containing samples were green in color and it was observed that the loss of transmission appears in a specific region in the Co-doped ZnO thin films due to characteristic d-d transition of Co2+ ions. The thickness of the films had decreased with the increasing number of sparks. In addition, the band gap energy, Eg, evaluated by UV-Vis spectroscopy measurements has been shifted to higher wavelengths (red shift) for the ZnO:Co thin films.
Open Access
Zno nanostructures via hydrothermal synthesis on atomic layer deposited seed-layers
(IEEE, 2015) Orlov, A.; Ulianova, V.; Bogdan, O.; Pashkevich, G.; Bıyıklı, Necmi; Goldenberg, Eda; Haider, Ali
The original results of two different types of ZnO nanostructures grown via hydrothermal synthesis on ZnO seed-layers coated by atomic layer deposition process on Si substrates were presented. Scanning electron microscopy and X-ray diffractometry were used for the analysis of resulting nanostructured ZnO samples. The influence of annealing on crystal properties of the ZnO nanostructures was shown. It was ascertained that solution composition had a significant influence on the morphology of nanostructures and post-growth annealing modified the crystal properties of nanostructures. © 2015 IEEE.