Sharif Digital Repository

A metallophthalocyanine complex with zirconium(IV) ion in the center (as an oxo-zirconium, Zr=O, group) was used in poly vinyl chloride (PVC) membranes for the selective detection of 5-sulfosalicylic acid (SSA). The resulting electrodes demonstrate Nernstian responses over a wide range of sulfosalicylic acid concentration (10-6 to 10-1 mol dm-3) with a slope of about -29 mV per decade. The influence of lipophilic ion-exchanger sites on the response properties of the electrodes was investigated. The optimal potentiometric response was observed for the electrode in the presence of about 150 mol% of cationic additive (relative to ionophore) in the phase membrane. The electrodes have a fast... 

The mean spherical approximation (MSA) has been applied to accurately correlate the activity coefficients of individual ions in aqueòus solutions of single 1:1 electrolytes. In order to account for changes in the hydration of the ions, the size parameters of the ions are considered to be composition dependent. The values of the size parameters show that the hydration of the ions decreases as the electrolyte concentration increases. Results obtained from the full MSA and from a simplified version of MSA (SMSA), were compared. The use of the simplified version had a small effect on the final results and dramatically reduced the computation of the effort  

Under experimental conditions in which the self-association of the adenine phosphates (AP), that is, of adenosine 5′-monophosphate (AMP2-) and adenosine 5′-diphosphate (ADP3-), is negligible, potentiometric pH titrations were carried out to determine the stabilities of the M(H;AP) and M(AP) complexes where M2+=Mg2+, Ca2+, Sr2+, Ba2+, Mn2+, Co2+, Ni2+, Cu2+, Zn2+, or Cd2+ (25°C; I = 0.1m, NaNO3). It is concluded that in the M(H;AMP)+ species M2+ is bound at the adenine moiety and in the M(H;ADP) complexes at the diphosphate unit; however, the proton resides in both types of monoprotonated complexes at the phosphate residue. The stabilities of nearly all the M(AMP) and M(ADP)- complexes are... 

Electrochemical cells with two ion-selective electrodes, a cation ion-selective electrode against an anion ion-selective electrode, were used to measure the activity coefficient of amino acids in aqueous electrolyte solutions. Activity coefficient data were measured for (H2O + NaBr + glycine) and (H2O + NaBr + L-valine) at T = 298.15 K. The maximum concentrations of sodium bromide, glycine, and L-valine were (1.0, 2.4, and 0.4) mol · kg-1, respectively. The results show that the presence of an electrolyte and the nature of both the cation and the anion of the electrolyte have significant effects on the activity coefficients of amino acid in aqueous electrolyte solutions  

The activity coefficient data were reported for (water + potassium chloride + DL-valine) at T = 298.15 K and (water + sodium chloride + L-valine) at T = 308.15 K. The measurements were performed in an electrochemical cell using ion-selective electrodes. The maximum concentrations of the electrolytes and the amino acids studied were 1.0 molality and 0.4 molality, respectively. The results of the activity coefficients of DL-valine are compared with the activity coefficients of DL-valine in (water + sodium chloride + DL-valine) system obtained from the previous study. The results show that the presence of an electrolyte and the nature of its cation have a significant effect on the activity... 

Salicylate selective electrodes based on oxo(phthalocyanato)-vanadium(IV) [VO(Pc), vanadyl phthalocyanine] and oxo(phthalocyanato)molybdenum(IV) [MoO(Pc), molybdenyl phthalocyanine] are described. The electrodes were prepared by incorporating the ionophores into plasticized poly(vinyl chloride) membranes, which were directly coated on the surface of graphite electrodes. The resulting electrodes demonstrate Nernstian responses over a wide linear range (10-7-10-1 M) salicylate. The electrodes have a fast response time, submicromolar detection limit, and could be used over the pH range of 6-9. The proposed sensors revealed selectivity for salicylate over a number of common inorganic and organic... 

In this paper the fabrication, testing and results of inverse profiling of optical slab waveguides in glass are reported. This is the first successful report of fabricating ion exchange optical waveguides in Iran. © Shiraz University  

Because of the recent frequent observations of major dust storms in southwestern cities in Iran such as Ahvaz, and the importance of the ionic composition of particulate matters regarding their health effects, source apportionment, etc., the present work was conducted aiming at characterizing the ionic composition of total suspended particles (TSP) and particles on the order of ∼10 μm or less (PM10) during dust storms in Ahvaz in April-September 2010. TSP and PM10 samples were collected and their ionic compositions were determined using an ion chromatography. Mean concentrations of TSP and PM10 were 1,481.5 and 1,072.9 μg/m 3, respectively. Particle concentrations during the Middle Eastern... 

We have compared the gas phase thermochemical properties of aspartame (artificial sweetener) and α- and β-glucose. These parameters include metal ion affinities with Li+-, Na+-, K+-, Mg+2-, Ca+2-, Fe+2-, Zn+2-ions, and chloride ion affinity by using DFT calculations. For example, for aspartame, the affinity values for the above described metal ions are, respectively, 86.5, 63.2, 44.2, 255.4, 178.4, 235.4, and 300.4, and for β-glucose are 65.2, 47.3 32.9, 212.9, 140.2, 190.1, and 250.0 kcal mol-1, respectively. The study shows differences between the intrinsic chemistry of aspartame and glucose. © 2008 Elsevier Ltd. All rights reserved  

The derivatives of glucose such as glucosamine (β-D-GlcN) and N-acetyl-D-β-glucosamine (GlcNAc) are significant in several biological systems. D-GlcN has been used widely to treat osteoarthritis in humans and animal models as well as GlcNAc has been proposed as a treatment for autoimmune diseases. The DFT/B3LYP/6–311++G (d,p) method as well as QTAIM and NBO analyses were used to the acidity values of D-GlcN and GlcNAc sugars and their complexes with alkali ions in the gas phase. The Li+, Na+ and K+ prefer bi-dentate chelate in these complexes. The computed results indicate that metal ion affinity (MIA) in GlcNAc is higher than that in D-GlcN. There are direct correlations between the MIA... 

Single-walled carbon nanotubes (SWCNTs) and multiwalled carbon nanotubes (MWCNTs) were synthesized in aqueous solutions containing FeCl2, FeCl3, FeSO4 and Fe2(SO4) 3. The effects of iron charge and the counter ions on the formation of carbon nanotubes (CNTs) were investigated. Thermogravimetric (TG) analysis indicated that carbon multilayer structures including CNTs and multishell graphite particles were formed in deionized (DI) water without the iron precursor. SWCNTs were also synthesized in the presence of the iron ions. It was also found that the mole ratio of [Fe2+]/[Fe3+] in the solution has a significant influence on the purity of CNTs and the process yield. The highest yield was... 

This paper concentrates on degradation of electric vehicle (EV) lithium-ion batteries in vehicle-to-grid (V2G) programs and proposes a practical wear cost model for EVs charge scheduling applications. As the first step, all the factors affecting the cycle life of lithium-ion batteries are identified and their impacts on degradation process are investigated. Subsequently, a general model for battery loss of cycle life is devised incorporating all the pertinent factors associated with charging and discharging activities in V2G applications. Modeling the battery wear cost as a series of equal-payments over the cycle life, a mechanism for calculating the cost incurred by EV users due to... 

In this research, a continuous microsolvent extraction-reaction was developed for the efficient separation of calcium ion. This study gives a preliminary possible practical application of microfluidic devices in chemical exchange reaction for enrichment of 48Ca stable isotope. For this purpose, in the first stage, the hydrodynamic behavior of two immiscible liquids in a simple Y-shaped microfluidic junction is experimentally investigated, and then ion-pair extraction-reaction of Ca2+ using picric acid as a counter-ion and dicyclohexano-18-crown-6 (DC18C6) as a lipophilic ionophore is studied in this microfluidic and conventional batch method. The impact of main process parameters, including... 

The prepared colloidal silica via ion exchange was modified by adding Mg+2 ions in the surface growth process of colloidal silica. The particle size of the modified colloidal silica was decreased by increasing the seed concentration, whereas that of colloidal silica was slightly increased as the seeds concentration exceed 15 wt%. But the trend of changes in surface area was completely reversed. Magnesium ions on surface of the modified colloidal silica were identified by the measurement of energy-dispersive X-ray spectrometry (EDS). After modifying with Mg+2 ions, the iso-electric point (IEP) of colloidal silica in pH ∼ 2 without modification, disappears over the whole pH range. © 2008... 

Deposition of barium sulfate (or BaSO4) has already been recognized as a devastating problem facing process industries and oilfield operations, mainly owing to its low solubility in aqueous solutions. Predicting and also preventing the overall damage caused by BaSO4 precipitation requires a profound knowledge of its solubility under different thermodynamic conditions. The main aim of this study is to develop a solubility prediction model based on a hybrid of least squares support vector nachines (LSSVM) and coupled simulated annealing (CSA) aiming to predict the solubility of barium sulfate over wide ranges of temperature, pressure and ionic compositions. Results indicate that predictions of... 

In this study, Lipase from Aspergillus Niger after extraction of medium culture was precipitated with different percentages of acetone and purified by ion exchange chromatography using SP-Sepharose HP and Q-Sepharose HP. The process of purification of the enzyme was studied by electrophoresis and the molecular weight was detected and determined by Zymography using overlying containing phenol red and Rhodamine B. The results showed that the vast majority of lipase from this strain has been precipitated by 70% saturation acetone, and leads to the 1.67 fold the purified enzyme, with special activities 32.8 U. mg-1 and efficiency of 38.5%. Using two-phase chromatography, enzyme specific activity... 

It is well established that the heavy oil components including asphaltenes and resins play vital roles on the interfacial tension (IFT) of acidic crude oil (ACO) and aqueous solutions. Therefore, this experimental work is designed to investigate the possible synergism between salt ions, resin, and asphaltene on the IFT of ACO/low and high salinity brines containing MgCl2/NaCl and CaCl2. The results demonstrate that a complex ion of MgCl2 - resin component created in the solution could occupy the sites at the interface at high MgCl2 concentration. However, the results show that on the contrary, the molecular arrangement of MgCl2 and asphaltene at low and high MgCl2 concentration could be... 

Colloidal nanoparticle could be used for recognition location of tumors and cancer tissue. A simulation of molecular dynamic for colloidal silver nanoparticles (Ag NPs) based on density functional theory (DFT) potential parametrization with different sizes in 1-ethyl-3-methylimidazolium hexafluorophosphate [EMim][PF6] ionic liquid was performed. Then, using Green Kubo formalism, diffusion coefficient for Ag NPs in IL and in the gas phase was calculated. We also calculated diffusion coefficients of anions and cations for pure IL and IL in the presence of different sizes of Ag NPs at different temperatures. The findings showed that the diffusion coefficient of anions and cations increases in...