Sharif Digital Repository

A five-coordinated Fe(III) complex with the distorted trigonal bipyramidal configuration was synthesized by reactions of FeCl36H2O and 2-(2′-hydroxyphenyl)oxazoline (Hphox) as a bidentate ON donor oxazoline ligand. Complex [Fe(phox)2Cl] was fully characterized, including by single-crystal X-ray structure analysis. DFT calculations were accompanied with experimental results in order to obtain a deeper insight into the electronic structure and vibrational normal modes of complex. Oxidation of sulfides to sulfoxides in one-step was conducted by this complex as catalyst using urea hydrogen peroxide (UHP) in mixture of CH2Cl 2/CH3OH (1:1) under air at room temperature. The results show that using... 

The use of adjusted/optimized saline water categorized into two different classes namely smart water (SW) and low salinity (LoSal) water injection has been proposed for more oil recovery from specific types of oil reservoirs. There are possible mechanisms concerning SW flooding that have been proposed in the literature, some of them are still subject to more examination. In this study, an experimental investigation is performed to determine the influence of type and amount of salt to the surface properties including interfacial tension (IFT) and contact angle (CA) of aqueous solution + acidic and asphaltenic crude oil + carbonate rock systems. For this purpose, the concentration of different... 

The effect of pulse reverse current (PRC) method on Ni-Mo coatings electroplated from chloride solution was investigated by various plating parameters such as plating duration, the anodic duty cycle, the anodic current density and the cathodic current density. By increasing the anodic duty cycle and anodic current density, the Mo content of coatings reached 68wt.% and 78wt.%, respectively at cathodic current densities of 500 and 300mAcm-2. The Mo content of coatings increases by the preferential dissolution of Ni on the anodic pulse and also by the replenishment of Mo complexes in the diffusion layer near the substrate surface during the anodic pulse. In comparison with the direct current... 

Ag and Ni are immiscible, mainly due to their large lattice mismatch. This paper reports on their nanoscale formation of solid solution at room temperature by simple reduction reactions which lead to the amorphous Ag-Ni alloy nanoparticles (ANPs) with mono-disperse distribution. Microscopic and spectroscopic studies confirmed dependence of the alloy composition on size of nanoparticles. In the presence of different ligands such as sodium citrate, polyvinyl alcohol and potassium carbonate a mixture of silver oxide and Ag-Ni ANPs was achieved. Stoichiometry of the Ag-Ni ANPs was also found to be strongly dependent on ligands of the reduction reaction and further study shows without any ligand... 

In this study, the corrosion behaviour of Ni-Co alloys with low Co content, electroplated on steel substrate in sulphate bath, was investigated. The morphology of coatings was studied by optical and SEM microscopy. The corrosion products were analyzed using EDX. The results showed that Ni-1%Co coatings had a better corrosion resistance 0.30, 0.92 and 3.75 mpy for atmospheric, salt spray and polarization tests, respectively. These are 0.41, 1.20 and 5.40 mpy for pure nickel coatings that indicate the least corrosion resistance. Surface analysis revealed the presence of oxides, sulphides and chlorides in corrosion products  

SrFe12-xTix/2Zn x/2O19 (x = 0-2.5) powders were synthesized by use of chlorides through co-precipitation method. The obtained powders were then milled by high energy ball mill to crash hard agglomerates and achieve nanoparticles. In order to evaluate microwave absorption versus frequency, composites including ferrite, as a filler, and matrix of polyvinylchloride (PVC) with weight ratio of 70% ferrite were prepared. X-ray diffraction (XRD), Fourier transform infrared spectroscopy (FTIR), field emission scanning electron microscopy (FE-SEM), vibrating sample magnetometer (VSM) and vector network analyzer (VNA) were employed to study the structural, magnetic and microwave absorption properties... 

Anatase nanostructured coating has been prepared on 316 L stainless steel by sol-gel dip coating. The topography of the coatings surface has been analyzed using atomic force microscopy. The anticorrosion performance of the coatings has been evaluated using polarization curves. Effects of calcination temperature, withdrawal speed and times of coating on corrosion protection have been studied. The results showed calcination temperature of 400°C and withdrawal speed of 10 cm/min are desirable conditions to achieve high corrosion protection of 316 L stainless steel in chloride containing environments. Coatings with 3 times exhibit better resistance against corrosion in 0.5 molar NaCl solutions.... 

An ecofriendly one-pot multicomponent reaction of 1,3-dicarbonyl compounds, aldehydes, and malononitrile was carried out in a different deep eutectic solvent (DES) based on choline chloride, to synthesize highly functionalized benzopyran and pyran derivatives under catalyst-free conditions. The results showed that urea:choline chloride based DES is the best solvent and is successfully applicable to a wide range of aldehydes, active methylene compounds with high yields (75-95%) and short reaction times (1-4 h)  

The hardness of the Ni-Cr alloy which is electrodeposited in chloride solution, is optimized by design of experiment method (central composite design). Various parameters were evaluated in order to find significant factors in this process. Frequency, duty cycle, current density and temperature were selected as effective factors. Analyses of variance (ANOVA) were performed on the results of the designed experiments. The best model which can predict the hardness of the Ni-Cr alloy electrodeposits was found whereas the frequency and quadratic behaviour of the current density were the most significant model terms. Serious interaction of the current density with frequency and duty cycle also were... 

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... 

The geometry structures of hexa-coordinated [NiLX]X complexes (X = Cl -, Br-, I-) {L = 8,9,18,19-tetrahydro-7H,17H- dibenzo[f,o] [1,5,9,13]dioxadiaza cyclohexadecine-8,18-diol} are optimized by density functional theory (DFT) using B3LYP/LANL2DZ. The calculated geometric parameters are in good agreement with the corresponding experimental values. Calculation results about these complexes show that dipole moment decreases, and the energy levels of HOMOs descend from iodo-complex to chloro-complex. The energy levels of HOMOs descend gently from iodo-complex to chloro-complex, while the energy levels of LUMOs in the present complexes are almost similar; therefore the energy gapes between HOMOs... 

Synthesis of poly(2,5-dimethoxyanilie) (PDMA) catalyzed by nano reengineered horseradish peroxidase (HRP) with dendritic macromolecules, was studied as a function of reaction media. UV-vis, gel permeation chromatography and conductivity measurements were used to explain how the reaction media compositions influence the physical properties of PDMA. Nanostructured PDMA was also synthesized by oxidative polymerization in a novel and green bi-catalyst system involving HRP and ferric chloride. FTIR and UV-vis analysis confirmed the formation of emeraldine salt state of PDMA. The thermal stability of reengineered HRP granted further studies on the polymerization using bi-catalyst system at... 

A new cationic flocculant was synthesized by graft copolymerization of acrylamide (AM) and 3-(methacryloylamino)propyl]trimethylammonium chloride (MAPTAC) onto salep using free radical polymerization initiated by ammonium persulfate (APS) to produce cationic salep [S-g-P(AM-co-MAPTAC)]. Reaction parameters (monomers/salep ratio, concentration of reactants, MAPTAC/AM ratio, and APS) were optimized using a full factorial experimental design to obtain the highest settling rate for cement suspensions. The best performing product was characterized by gel permeation chromatography (GPC), FTIR, 1H NMR spectroscopy, and thermogravimetric analysis (TGA). The resulted cationic flocculant may be... 

The 2,6-bis(diphenylphosphino)pyridine/palladium catalytic system successfully catalyzes the Heck coupling reaction of less reactive aryl chlorides as well as aryl bromides with styrene to give the corresponding olefins in reasonable yields. TBAB (tetrabutylammoniumbromide) as an additive was found to be essential for these reactions. The results of Heck reaction exhibited a high selectivity (>99/1) favoring the trans product  

Pechini process was used for preparation of three kinds of nanocrystalline powders of yttria-stabilized zirconia (YSZ): doped with 1.5 mol% nickel oxide, doped with 15 mol% ceria, and doped with 1.5 mol% nickel oxide plus 15 mol% ceria. Zirconium chloride, yttrium nitrate, cerium nitrate, nickel nitrate, citric acid and ethylene glycol were polymerized at 80 °C to produce a gel. XRD, SEM and TEM analyses were used to investigate the crystalline phases and microstructures of obtained compounds. The results of XRD revealed the formation of nanocrystalline powder at 900 °C. Morphology of the powder calcined at 900 °C, examined with a scanning electron microscope, showed that the presence of... 

Cobalt supported on carbon nanotubes (CNTs)-covered alumina has been recently developed and successfully utilized as a catalyst in Fischer-Tropsch synthesis (FTS). Problems associated with shaping of Co/CNTs into extrudates or pellets as well as catalyst attrition rendered these materials unfavorable for industrial applications. In this investigation regular γ- and nano-structured (N-S) alumina as well as CNTs-covered regular γ- and N-S-alumina supports were impregnated by cobalt nitrate solution to make new cobalt-based catalysts which were also promoted by Ru. The catalysts were characterized and tested in a micro reactor to evaluate their applicability in FTS. γ-Al2O3 was prepared by... 

The synthesis of nano-sized CeO 2 powder was investigated via mechanochemical reactions between hydrate cerium chloride and sodium hydroxide as the starting materials. The process was followed by a subsequent calcination procedure. Characterization of as-synthesized powder was performed using X-ray diffraction, FTIR spectroscopy, Brunner-Emmett-Teller (BET) nitrogen gas absorption, scanning electron microscopy (SEM) and particle size analyzer (PSA). The precursors were milled for different milling times and then were subjected to different heat treatment procedure at variable temperatures from 100 to 700 °C. According to the results, milling time and calcination temperatures induce... 

In this paper, the sorption of uranium onto nanoporous silica adsorbent in the presence of nitrate, sulfate, chloride, fluoride and phosphate was studied. The effect of contact time between the nanoporous sorbent and aqueous solution, pH and initial concentration of uranium was also investigated. Uranium sorption onto nanoporous silica adsorbent is a very fast process as sorption rate increases with pH increment. Optimum pH for uranium sorption was 4-8. Experimental sorption isotherm is successfully described by Langmuir and Freundlich models. The results obtained by batch experiments showed that the presence of high concentration of nitrate, sulfate, chloride and phosphate anions alone had... 

Nanocrystalline TiO 2-Fe 2O 3 thin films and powders were prepared by a straightforward aqueous particulate sol-gel route at the low temperature of 300 °C. Titanium(IV) isopropoxide and iron(III) chloride were used as precursors, and hydroxypropyl cellulose was used as a polymeric fugitive agent in order to increase the specific surface area. X-ray diffraction (XRD) and Fourier transform infrared spectroscopy (FTIR) revealed that the powder crystallised at the low temperature of 300 °C, containing anatase-TiO 2 and hematite-Fe 2O 3 phases. Furthermore, it was found that Fe 2O 3 retarded the anatase-to-rutile transformation up to 500 °C. The activation energies for crystallite growth of TiO 2... 

While energy consumption is increasing worldwide due to population growth, the fossil fuels are unstable and exhaustible resources for establishing sustainable life. Using biodegradable compounds present in the wastewater produced in industrial process as a renewable source is an enchanting approach followed by scientists for maintaining a sustainable energy production to vanquish this problem for ulterior generations. In this research, bioelectricity generation with whey degradation was investigated in a two-chamber microbial fuel cell with humic acid as anodic electron mediator and a cathode compartment including combinational electron acceptor. Escherichia coli was able to use the...