Sharif Digital Repository

The microscopic features of binary solvent systems formed by molecular solvents (methanol, ethanol, 2-methylpropan-2-ol, water, pyridine, acetonitrile, 1-propanol, 2-propanol, dimethylformamide) and the ionic liquid ([bmim]BF4) as cosolvent were used to select mixed solvents with particular characteristics. Molecular-microscopic solvent parameters corresponding to these binary mixtures were utilised to study the kinetics of the nucleophilic substitution reaction between 2-chloro-3,5-dinitropyridine and aniline to investigate and compare the effects of the solvents on a model chemical reaction. For these mixtures, the solvation behaviour is dominated by both the dipolarity/ polarisability and... 

Structural and molecular-microscopic properties of the solvatochromic probes 4-nitroaniline, 4-nitroanisole, and Reichardt’s dye were investigated in binary mixtures of ethylammonium propionate with methanol, ethanol, 1-propanol and 2-propanol. Solvatochromic parameters (α, hydrogen-bond donor acidity; β, hydrogen-bond acceptor basicity; π*, dipolarity/polarizability; ENT , normalized polarity parameter) in different binary mixtures of ionic liquid with molecular solvents were determined with UV–Vis spectroscopy. The ENT parameters show nearly ideal trends in all solvent mixtures, but the other parameters show different behavior in the mixtures. The π* parameters show a negative deviation... 

Structural and molecular-microscopic properties of the solvatochromic probes 4-nitroaniline, 4-nitroanisole, and Reichardt's dye were investigated in binary mixtures of ethylammonium propionate with methanol, ethanol, 1-propanol and 2-propanol. Solvatochromic parameters (α, hydrogen-bond donor acidity; β, hydrogen-bond acceptor basicity; π*, dipolarity/ polarizability; ET N, normalized polarity parameter) in different binary mixtures of ionic liquid with molecular solvents were determined with UV-Vis spectroscopy. The ET N parameters show nearly ideal trends in all solvent mixtures, but the other parameters show different behavior in the mixtures. The πparameters show a negative deviation... 

In the current article the effect of the Casimir force on the static behavior and pull-in characteristics of nano/micromirrors under capillary force is investigated. At the first, the dimensionless equation governing the static behavior of nano/micromirrors is obtained. The dependency of the critical tilting angle on the physical and geometrical parameters of the nano/micromirror and its supporting torsional beams is investigated. It is found that the Casimir effect can considerably reduce the pull-in instability limits of the nano/micromirror. It is also found that rotation angle of the mirror under capillary force highly depends on the Casimir force applied to the mirror. Finally the... 

Experiments were conducted to investigate the effect of adding fines on the tribo-charging of coarse glass beads. Four types of fines, i.e., copper, stainless steel, uncoated and silver-coated fine glass beads, mixed with 240–830 μm glass beads were conveyed by air through a stainless-steel spiral pipe acting as a tribo-charger. Regardless of the type or electrical conductivity of the fine particles tested, adding small amounts of fines (up to 10 wt%) to coarse glass beads resulted in a sharp increase in the mass and surface charge densities of the particles. In general, the profiles of the mass and surface charge densities of the fine–coarse particle mixtures as a function of the mixture... 

A model based on the perturbation theory of fluids was proposed to correlate the experimental data for surface tension of pure hydrocarbons in a wide range of temperature. The results obtained for the pure hydrocarbons were directly used to predict the surface tension for binary hydrocarbon mixtures at various temperatures. In the proposed model, a modified form of the square well potential energy between the molecules of the reference fluid was taken into account while the Lennard-Jones dispersion energy was considered to be dominant amongst the molecules as the perturbed term to the reference part of the model. In general, the proposed model has three adjustable parameters which are chain... 

Recently, a new potential model has been proposed for the intermolecular interactions of model pure fluids and it was shown that the derived Equation Of State (EOS), based on this potential, can properly predict the thermodynamic properties of these.fluids. In addition to simplicity and, to some extent, the realistic form, this potential has a parameter (α) which controls the range of the attraction tail. In the first part of this study, the proposed potential and derived EOS are extended to binary mixtures of model fluids. In a similar manner to that of the pure fluids, the results obtained are consistent with the data available from simulation studies. In the second part, after... 

A general investigation of the thermal conductivity of natural gas as a function of temperature, pressure and composition was carried out to develop a generalized correlation. The model obtained was based on 731 data points of 42 binary mixtures in wide ranges of pressures (0.1-300MPa), temperatures (220-425K) and specific gravities (0.626-1.434). Correction terms for non-hydrocarbons of carbon dioxide and nitrogen were up to 87.8 and 82.8 of mole percent, respectively. The arithmetic average of the model's absolute error was found to be 5.69%, which is acceptable in engineering calculations  

In this study, an experimental investigation was conducted from a thermal performance standpoint on closed-loop pulsating heat pipes (CLPHPs) with four different fluids and their water-based binary mixtures as working fluids with volume mixing ratios of 3:1, 1:1, and 1:3. Ethanol and acetone as two types of fluids that are soluble in water and, to unprecedentedly compare the behavior of insoluble mixtures with the soluble ones as the working fluids, toluene and hexane as two types that are insoluble in water were used. Additionally, to predict the thermal performance of the pure, soluble binary, and insoluble binary fluids simultaneously for the first time, a correlation was derived. © 2018... 

In this study, an experimental investigation was conducted from a thermal performance standpoint on closed-loop pulsating heat pipes (CLPHPs) with four different fluids and their water-based binary mixtures as working fluids with volume mixing ratios of 3:1, 1:1, and 1:3. Ethanol and acetone as two types of fluids that are soluble in water and, to unprecedentedly compare the behavior of insoluble mixtures with the soluble ones as the working fluids, toluene and hexane as two types that are insoluble in water were used. Additionally, to predict the thermal performance of the pure, soluble binary, and insoluble binary fluids simultaneously for the first time, a correlation was derived. © 2018,... 

A modified carbon paste electrode is prepared by incorporating multi-walled carbon nanotube (MWCNT) and cobalt salophen (CoSal). A mixture of fine graphite powder with 10 wt% of MWCNT is applied for the preparation of carbon paste (by dispersing in Nujol) and finally modified with CoSal. The electrocatalytic oxidation of tryptophan (Trp) is investigated on the surface of the MWCNT/CoSal-modified electrode using cyclic voltammetry (CV) and differential pulse voltammetry (DPV). Using the modified electrode, the kinetics of the electro-oxidation of Trp is considerably enhanced, by lowering the anodic overpotential through a catalytic fashion. The mechanism of electrochemical behavior of Trp at... 

The microscopic features of binary solvent systems formed by molecular solvents (methanol, ethanol, 2-methylpropan-2-ol, water, pyridine, acetonitrile, 1-propanol, 2-propanol, dimethylformamide) and the ionic liquid ([bmim]BF 4) as cosolvent were used to select mixed solvents with particular characteristics. Molecular-microscopic solvent parameters corresponding to these binary mixtures were utilised to study the kinetics of the nucleophilic substitution reaction between 2-chloro-3,5-dinitropyridine and aniline to investigate and compare the effects of the solvents on a model chemical reaction. For these mixtures, the solvation behaviour is dominated by both the dipolarity/ polarisability... 

Relative novelty and wide functionality of ionic liquids (ILs) have led to a surge in the studies devoted to experimental determination of their physicochemical properties. Systematic collection and analysis of the available data and development of predictive models to address the extreme diversity of IL systems are of great value in this regard. In the present work, the significance of speed of sound in ILs and their mixtures was outlined and related theoretical concepts were surveyed. A comprehensive database was utilized for the construction of predictive models based on least square support vector machine. By constructing four different models, the influence of temperature, molecular... 

A novel, simple and rapid spectrophotometric method for the determination of nitrophenol (NP) isomer mixtures based on the catalytic activity of gold nanoparticles is described. Gold nanoparticle (∼13 nm) solution was used to catalyze the reduction of NP isomers to aminophenols with an excess amount of NaBH4. The second-order data were obtained by spectrophotometrically monitoring the reduction process of NP isomers. So, multivariate curve resolution optimized by alternative least squares (MCR-ALS) was used to analyze such data. MCR-ALS, an appropriate second-order method, can exploit the so-called 'second order advantage' (the ability to determine in the presence of uncalibrated... 

Vapor liquid equilibrium (VLE) data has significant role in designing processes which include vapor and liquid in equilibrium. Since it is impractical to measure equilibrium data at any desired temperature and pressure, particularly near critical region, thermodynamic models based on equation of state (EOS) are usually used for VLE estimating. In recent years due to the development of numerical tools like artificial intelligence methods, VLE prediction has been find new alternatives. In the present study a novel method called Least-Squares Support Vector Machine (LSSVM) used for predicting bubble/dew point pressures of binary mixtures containing carbon dioxide (CO 2) + cyclic compounds as... 

This paper deals with the problem of static instability of Micro/Nano mirrors under the combined effect of capillary force and Casimir force. At the First the governing equations of the statical behavior of Micro/Nano mirrors under the combined effect of capillary force and casimir force is obtained. The dependency of the critical tilting angle on the physical and geometrical parameters of the nano/micromirror and its supporting torsional beams is investigated. It is found that existence of casimir force can considerably reduce the stability limits of nano/micromirror. It is also found that rotation angle of the mirror due to capillary force highly depends on the casimir force applied to the... 

Solvatochromic UV-vis shifts of three probes 4-nitroaniline, 4-nitroanisol, and Reichardt's dye in binary mixtures of polyethylene glycol p-(1,1,3,3-tetramethylbutyl)-phenyl ether (Triton X-100 or TX-100) with methanol, ethanol, 1-propanol, and water have been investigated at 298 K. Structural and intermolecular interactions of solvatochromic probes were determined in these systems. Solvatochromic parameters, including normalized polarity (ETN), dipolarity-polarizability (π∗), hydrogen-bond donor (α), and hydrogen-bond acceptor (β) abilities, were measured at a wide range of mole fraction (0 ≤ X ≤ 1) with 0.1 increment. Interestingly, a similar behavior of ETN and α is observed in... 

Volumetric and equilibrium calculations for the natural gas and oil defined by a large number of components are not feasible in applications like compositional reservoir simulation. Therefore, the fluid mixture is grouped to reduce computational load and to make faster calculations. However, for several reasons, it is required to have the detailed fluid composition rather than the lumped one. In this work, an improved delumping method is presented to retrieve the phase composition of the detailed mixture based on the grouped mixture thermodynamic calculations. The method is based on previously proposed delumping techniques for non-cubic equation of state (Assareh et al. in Fluid Phase...