Sharif Digital Repository

X-ray Powder Diffraction beamline is one of the first priorities of Iranian Light Source Facility day-onebeamlines. This beamline will cover the research requirements of scientific community in the fields of physics, material science, chemistry, etc and also have benefits for industries. This paper shortly reports the ray tracing calculations for the optical design of this beamline. The results show that bending magnet source would satisfy the nowadays users requirements, although insertion device should also be considered for covering the requirements of the future users. In this paper the effects of the optical elements on the users' requirements have been discussed to obtain the... 

Prediction of stable orientations is a key subject in the crystal plasticity literature. This work deals with the effects of deformation mode on the resulted stable orientations and texture evolution of FCC materials. The simulations are based on the numerical procedure developed by the authors in previous works in which, a rate-sensitive crystal plasticity model with Secant hardening law was employed. The resulting non-linear system of equations is solved by the modified Newton-Raphson method. In order to obtain the stable orientations for a deformation mode, initial orientations evenly spaced in the Euler space are selected and their evolution into the stable orientations is tracked. The... 

A fluorometric method was developed for simultaneous determination of Cr(VI) and Cr(III) ions using graphitic carbon nitride nanosheets (g-C3N4 NS) as a nanosized fluorescent indicator probe. The g-C3N4 NS were prepared using high-temperature carbonization of melamine followed by ultrasonication-assisted liquid exfoliation. The g-C3N4 NS display fluorescence with excitation/emission peaks located at 320 and 450 nm. The chromium speciation is based on the quenching of g-C3N4 NS fluorescence. The total concentration of chromium is determined after oxidation of Cr(III) to Cr(VI). The Cr(III) content was then calculated by subtracting the concentration of Cr(VI) from that of total chromium. The... 

The morphological and microstructural changes during mechanical milling of Al powder mixed with 5 vol% nanoscaled alumina particles (35 nm) were studied. The milling was performed in a planetary ball mill under argon atmosphere for various times up to 24 h. The process was also conducted for Al and Al-5 vol% Al2O3 (1 μm) powders to explore the role of reinforcement nanoparticles on the mechanical milling stages. The results showed that the addition of hard particles accelerate the milling process, leading to faster work hardening rate and fracture of the aluminum matrix. Meanwhile, the structural evolution during mechanical milling of the microcomposite powder occurred faster than that of... 

Taking into account X-ray diffraction, one of the well-known methods for calculating the stress-strain of crystals is Williamson-Hall (W–H). The W-H method has three models, namely (1) Uniform deformation model (UDM); (2) Uniform stress deformation model (USDM); and (3) Uniform deformation energy density model (UDEDM). The USDM and UDEDM models are directly related to the modulus of elasticity (E). Young’s modulus is a key parameter in engineering design and materials development. Young’s modulus is considered in USDM and UDEDM models, but in all previous studies, researchers used the average values of Young’s modulus or they calculated Young’s modulus only for a sharp peak of an XRD pattern... 

This work presents a simple solvent-free route based on solid-state thermal decomposition approach to synthesize magnetic copper ferrite (CuFe2O4) microspheres and copper ferrite/metal oxide composites. For this purpose, [Cu(en)3]3[Fe(ox)3]2 complex (where en = ethylenediamine and ox = oxalate) was introduced as a new single-source precursor. Ferromagnetic property of the nanostructures was determined by alternating gradient force magnetometer. The effect of different ligands and temperatures on the morphology of the products was investigated. Solid-state thermal decomposition of the precursor at different temperatures in the range of 400–800 °C led to the fabrication of magnetic copper... 

The low temperature perovskite-type calcium titanate (CaTiO3) thin films and powders with nanocrystalline and mesoporous structure were prepared by a straightforward particulate sol-gel route. The prepared sol had a narrow particle size distribution about 17 nm. X-ray diffraction and Fourier transform infrared spectroscopy revealed that, the synthesized powders had highly pure and crystallized CaTiO3 structure with preferable orientation growth along (1 2 1) direction at 400-800 °C. The activation energy of crystal growth was calculated 5.73 kJ/mol. Furthermore, transmission electron microscope images showed that the average crystallite size of the powders annealed at 400 °C was around 3.5... 

Pd doped WO3 fibers were synthesized by electro-spinning. The sol gel method was employed to prepare peroxopolytungstic acid (P-PTA). Palladium chloride and Polyvinyl pyrrolidone (PVP) was dissolved in the sol Pd:WO3 = 10% molar ratio. The prepared sol was loaded into a syringe connected to a high voltage of 18.3 kV and electrospun fibers were collected on the alumina substrates. Scanning electron microscope (SEM), X-ray powder diffraction (XRD) and X-ray photoelectron spectroscopy (XPS) techniques were used to analyze the crystal structure and chemical composition of the fibers after heat treatment at 500 °C. Resistance-sensing measurements exhibited a sensitivity of about 30 at 500 ppm... 

In the present study the behavior of Ti-Al-C ternary system is investigated during mechanical alloying. The mixture of Ti, Al and C powders was used with initial stoichiometric composition of Ti3AlC2. X-ray diffraction (XRD) was used to characterize the milled powders and a thermodynamic analysis of the process was then carried out using Miedema model. This thermodynamic analysis showed that for all binary Ti-C, Al-C, Ti-Al systems and ternary Ti-Al-C systems, among all compositions, the thermodynamic driving force for intermetallic phase formation is much greater when compared with the formation of solid solutions or amorphous phases. Finally the reactions that are feasible to occur during... 

In this research, bioactive glass (BG) of the type CaO-P2O 5-SiO2 and nanocrystalline forsterite (NF) bioceramic were successfully synthesized via sol-gel processing method. Heat-treatment process was done to obtain phase-pure nanopowders. After characterization of each sample, the nanocomposite samples were prepared by cold pressing method and sintered at 1000°C. The samples were fully characterized by X-ray powder diffraction (XRD), scanning electron microscope (SEM), energy dispersive spectroscopy (EDX), Fourier transform infrared spectroscopy (FTIR) analyses. The average nanocrystallite size was determined using the Debye-Scherrer's formula 19.6 nm. The bioactivity was examined in vitro... 

A novel mesoporous MCM-41 with remarkable wide channel diameters and thick walls was synthesized. The procedure involved the acid-catalyzed hydrolysis of tetraetheylorthosilicate (TEOS) in a water/ethanol/isopropoanol solvent mixture while employing 1-hexadecylamine as a templating agent and mesitylene as an auxiliary agent. After removal of the template by either extraction or calcination at 560 °C, the resulting mesoporous materials had surface areas of 1,289 and 1,210 m2/g.The channel diameterswere found to be 46.8-51.2 Å ,while thewall thicknesses were 20.9-21.1 Å. X-ray powder diffraction proved that the synthesized mesoporous structure belongs to MCM-41 family. Notably, they displayed... 

In this study hydroxyapatite (HA)/zirconia/alumina composite coatings on titanium metal was carried out using Sol-Gel dip coating and calcination process. Hydroxyapatite-Alumina-Zirconia sol, coated samples in three processes by changing final sol stirring time, aging time, calcination temperature of synthesized powder and prepared coating and rate of coating. Some parts of prepared sol were also synthesized and became powder in all three processes. Scanning electron microscopy was used to estimate the particle size of the surface and for morphological analysis. The functional group and crystallization characteristics of the powders were analyzed using (FTIR) and X-Ray diffraction (XRD).... 

A facile sonochemical method has been developed to prepare very small zinc sulfide nanoparticles (ZnS NPs) of extremely small size about 1. nm in diameter using a set of ionic liquids based on the bis (trifluoromethylsulfonyl) imide anion and different cations of 1-alkyl-3-methyl-imidazolium. The structural features and optical properties of the NPs were determined in depth with X-ray powder diffraction (XRD), transmission electron microscopy (TEM), high-resolution TEM (HRTEM), Fourier transform infrared (FTIR) spectroscopy, dynamic light scattering (DLS) analysis, and UV-vis absorption spectroscopy. The energy band gap measurements of ZnS NPs were calculated by UV-vis absorption... 

In this study, two different chemical solution methods were used to synthesize Zinc oxide nanostructures via a simple and fast microwave assisted method. Afterwards, the photocatalytic performances of the produced ZnO powders were investigated using methylene blue (MB) photodegradation with UV lamp irradiation. The obtained ZnO nanostructures showed spherical and flower-like morphologies. The average crystallite size of the flower-like and spherical nanostructures were determined to be about 55 nm and 28 nm, respectively. X-ray diffraction (XRD), scanning electronic microscopy (SEM), Brunauer-Emmett-Teller (BET), room temperature photoluminescence (RT-PL) and UV-vis analysis were used for... 

Bi2O3 compositions were prepared to investigate the effect of rare earth metal oxides as co-dopants on phase stability of bismuth oxide. Compositions containing 9-14 mol% of Y2O3 and Er2O3 were synthesized by solid state reaction. The structural characterization was carried out using X-ray powder diffraction. The XRD results show that the samples containing 12 and 14 mol% total dopants had cubic structure, whereas the samples with lower dopant concentrations were tetragonal. Comparing the lattice parameters of the cubic phases of (Bi 2O3)0.88(Y2O3) 0.06(Er2O3)0.06 and (Bi 2O3)0.86(Y2O3) 0.07(Er2O3)0.07 revealed that lattice parameter decreases by increasing the dopant concentration. The XRD... 

In the present study, we performed hydrothermal method as a simple and efficient route for the synthesis of rutile TiO 2 nanostructures in various concentrations of lithium hydroxide solutions. TiO 2 nanopowders with average sizes of 15 and 23 nm were prepared using 4 M and 7 M LiOH solutions. X-ray diffraction analysis (XRD), transmission electron microscope (FEG-STEM), scanning electron microscopy (SEM), and Brunauer-Emmet-Teller (BET) analyses were used in order to characterize the obtained products and comparison of the morphology of the powders obtained in different concentrations of LiOH solvent. It was shown that alkali solution concentration has affected the crystallinity,... 

Palladium nanocatalysts supported on reduced graphene oxide (rGO), multi walled carbon nanotubes (MWCNT), and rGO/CNT composite were synthesized by a wet impregnation method using PdCl2 as a precursor. Palladium loading was 0.3 wt %, and the catalysts were reduced at 300°C. The catalysts were characterized by inductively coupled plasma, Brunauer-Emmett-Teller (BET) analysis, Fourier transform infrared spectroscopy, X-ray powder diffraction, transmission electron microscopy, temperatue-programmed reduction, temperatue-programmed desorption, and Raman spectroscopy. The performance of the catalysts was investigated for hydro-purification of crude terephthalic acid (CTA) containing... 

Nanostructured CoTiO3 thin films and powders were prepared by a straightforward aqueous particulate sol–gel route. Titanium(IV) isopropoxide and cobalt chloride were used as titanium and cobalt precursors, respectively. Also, hydroxypropyl cellulose was used as a polymeric fugitive agent in order to increase the specific surface area. The effect of Co:Ti molar ratio and annealing temperature were studied on the crystallization behavior and chemical properties of the products. X-ray diffraction and Fourier transform infrared spectroscopy revealed that the powders crystallized at the low annealing temperature of 300 °C for 1 h, containing anatase-TiO2,... 

Salep, known as a biodegradable polysaccharide, is hydrolyzed and used as both a reducing agent and stabilizer for graphene oxide (GO). The functionalized reduced graphene oxide (f-rGO) is homogenously dispersed in an aqueous solution of poly(vinyl alcohol) (PVA). PVA based hydrogel and film nanocomposites are prepared and proposed as new biomaterials for tissue engineering applications. The mechanical properties of the film nanocomposites are investigated with varying content of f-rGO, glycerol and citric acid as a reinforcing agent, a plasticizer agent and a cross linking agent respectively. For the first time, chemically cross linked PVA hydrogels are synthesized using... 

VO2(picolinichydrazone) complex as a catalyst was stabilized on a SBA-15 mesoporous silica as a catalytic support by using (3-chloropropyl)triethoxysilane as a connector. SBA-15 is nanoporous and has a high ratio of surface area to volume. The immobilization of a metal–Schiff base complex to the surface area of SBA-15 can improve its catalytic effects by increasing the catalytic surface area. Unlike homogeneous catalysts, heterogeneous catalysts can be recovered and reused several times without any significant loss of catalytic activity. A vanadium–Schiff base complex-functionalized SBA-15 was synthesized by covalency connected by a pre-synthesised VO2(picolinichydrazone) complex to...