Sharif Digital Repository

This investigation is devoted to the influences of non-uniform wall characteristics on the surface adsorption-desorption rates in an electrokinetic microarray. Utilizing already explored electroosmotic and electrophoretic velocities, the species transport equations are solved by a finite-volume-based numerical approach. Uniform, sinusoidal, and pulse-like distributions of the zeta potential are considered in the analysis. The developed model is validated by comparing the results with those of two analytical solutions that are derived for limiting conditions. The results reveal that, in some cases, the surface charge heterogeneity can reduce the saturation time by more than 60%. The efficacy... 

This investigation is devoted to the influences of non-uniform wall characteristics on the surface adsorption-desorption rates in an electrokinetic microarray. Utilizing already explored electroosmotic and electrophoretic velocities, the species transport equations are solved by a finite-volume-based numerical approach. Uniform, sinusoidal, and pulse-like distributions of the zeta potential are considered in the analysis. The developed model is validated by comparing the results with those of two analytical solutions that are derived for limiting conditions. The results reveal that, in some cases, the surface charge heterogeneity can reduce the saturation time by more than 60%. The efficacy... 

We outline a comprehensive numerical procedure for modeling of species transport and surface reaction kinetics in electrokinetically actuated microfluidic devices of rectangular cross section. Our results confirm the findings of previous simplified approaches that a concentration wave is created for sufficiently long microreactors. An analytical solution, developed for the wave propagation speed, shows that, when normalizing with the fluid mean velocity, it becomes a function of three parameters comprising the channel aspect ratio, the relative adsorption capacity, and the kinetic equilibrium constant. Our studies also reveal that the reactor geometry idealized as a slit, instead of a... 

Abstract Sintering response and phase formation during sintering of WC-Co/316L stainless steel composites produced by assembling of powder injection molding (PIM) parts were studied. It is shown that during cosintering a significant mismatch strain (> 4 pct) is developed in the temperature range of 1080° C to 1350° C. This mismatch strain induces biaxial stresses at the interface, leading to interface delamination. Experimental results revealed that sintering at a heating rate of 20 K/min could be used to decrease the  

Platinum extraction from spent reforming catalysts in iodine solutions under atmospheric pressure and at temperatures up to 95°C was previously investigated in our group. In this system, platinum is oxidized from the spent catalyst with tri-iodide. In some of the experiments, it was observed that platinum extraction peaked and then decreased. This indicates that a precipitation reaction slowly occurs that removes the dissolved Pt ions from the solution. Power-law rate equation for the Pt extraction to PtI6 2- and the precipitation of the dissolved platinum to PtI 4(s) was implemented to model the experimental Pt extraction data. The activation energies for the platinum dissolution reaction... 

Infinite series solutions are obtained for electrical potential, electroosmotic velocity, ionic conductance, and surface physicochemical properties of long pH-regulated rectangular nanochannels of low surface potential utilizing the double finite Fourier transform method. Closed form expressions are also obtained for channels of large height to width ratio for which the depthwise variations vanish. Neglecting the Stern layer impact, the effects of EDL (Electric Double Layer) overlap, multiple ionic species, and association/dissociation reactions on the surface are all taken into account. Moreover, finite-element-based numerical simulations are conducted to account for the end effects as well... 

The hydrogen abstraction reaction of the OH radical with CH 2FCH22F (HFC-152) is studied theoretically over the 150-3000 K temperature range. In this study, the two most recently developed hybrid density functional theories, namely, BBlK and MPWBlK, are applied, and their efficiency in reaction dynamics calculation is discussed. The BBlK/6-31+G(d,p) method gives the best result for the potential energy surface (PES) calculations, including barrier heights, reaction path information (the first and second derivatives of PES), geometry of transition state structures, and even weak hydrogen bond orientations. The rate constants were obtained by the dual-level direct dynamics with the... 

Consideration is given to shear-rate-dependent rheology effects on mass transport in a heterogeneous microreactor of rectangular cross section, utilizing both numerical and analytical approaches. The carrier liquid obeys the power-law viscosity model and is actuated primarily by an electrokinetic pumping mechanism. It is discovered that, considering the shear-thinning biofluids to be Newtonian fluids gives rise to an overestimation of the saturation time. The degree of overestimation is higher in the presence of large Damkohler numbers and electric double layer thicknesses. It is also increased by the application of a favorable pressure gradient, whereas the opposite is true when an opposed... 

Catalytic partial oxidation of methane in short residence time rhodium coated monolithic reactors offers an attractive route for syngas production. The plug flow and boundary layer flow approximations are considered as computationally efficient substitutes for the full Navier-Stokes model of the reactor while including detailed heterogeneous and homogeneous chemistry. The one dimensional plug flow model has trivial computational demands but only a limited range of application. The boundary layer model provides an excellent, computationally manageable substitute for the full Navier-Stokes model over a wide range of operating conditions. Using the 38-step elementary surface reaction mechanism... 

Cobalt-based catalysts were prepared on different alumina supports, and their behaviour for different Fischer-Tropsch synthesis (FTS) conditions assessed. Although Co/γ-Al2O3 is a well-known FTS catalyst, its durability ought to be improved to make the industrial process economically feasible. Here calcination repetitions effects on the catalyst lifetime were examined utilising reactor tests and characterisation techniques including XRD, TPR, ICP and N2 porosimetry. Results revealed that fewer calcination repetitions improved catalyst activity and selectivity. Based upon the XRD results, these findings appeared to be due to the improved size of cobalt crystals on the pore surfaces. These... 

Electro-deposition process is one of the main steps in the LIGA procedure to fabricate microstructures. In this paper, one-dimensional modeling of Nickel electro-deposition process is implemented on Rayan and developed for simulation of time-dependence diffusion and migration of charge species with reduction reactions on the cathode surface. This model is proposed by considering governing equations on electro-kinetic phenomena consist of Nernst-Plank equation and Poisson's equation of electric potential. Transport of ions toward the cathode is considered based on the effect of convection, reaction rate, diffusion and migration. The numerical results cover two series of data consisting of... 

Semi-analytical solutions are obtained for the electrical potential, electroosmotic velocity, ionic conductance, and surface physicochemical properties associated with long pH-regulated nanochannels of arbitrary but constant cross-sectional area. The effects of electric double layer overlap, multiple ionic species, and surface association/dissociation reactions are all taken into account, assuming low surface potentials. The method of analysis includes series solutions which the pertinent coefficients are obtained by applying the wall boundary conditions using either of the least-squares or point matching techniques. Although the procedure is general enough to be applied to almost any... 

In this study, a thermal method was used to synthesize spinel NiCo2O4 and carbon nanotubes (CNTs)@NiCo2O4 with an average size 50 nm and 20 nm, respectively. Addition of CNTs into NiCo2O4 noticeably increases the active surface area compared to pure spinel NiCo2O4. SEM analyses showed that the morphologies are spherical in both pure and composite samples. Uniform CNTs@NiCo2O4 nanoparticles exhibit high specific capacitance of 210 F g−1 at 2 A g−1 and a good retention capacity of 92.70% after 2500 cycles, which shows a considerable improvement compared to NiCo2O4. Additionally, an exceptional rate capability of about 73.2% was obtained at 50 A g−1. Such remarkable electrochemical performance... 

Electrochemical sensing performance of two-dimensional hexagonal boron nitride (2D h-BN) has traditionally been suppressed by their intrinsic electrical insulation and deficient electron transportation mechanism. However, the excellent electrocatalytic activity, high specific surface area, N- and B-active edges, structural defects, adjustable band gap through interaction with other nanomaterials, and chemical functionalization, makes 2D h-BN ideal for many sensing applications. Therefore, finding a pathway to modulate the electronic properties of 2D h-BN while the intrinsic characteristics are well preserved, will evolve a new generation of highly sensitive and selective electrochemical... 

The XW/rGO compounds (XW = Co or Ni modified WO3) have has been utilized as catalysts in the oxidative desulfurization (ODS) process of a liquid model fuel containing dibenzothiophene (DBT). Various characterization methods were carried out to complete evaluations of the prepared catalysts. Moreover, using the GC–MS method, it became clear that the final product of the process was dibenzothiophene sulfone (DBTO2). Furthermore, results showed that under the optimized conditions (oxidant to substrate molar ratio = 6, 75 °C and catalyst to substrate molar ratio = 0.08), the DBT content of a model fuel was declined by 100% only within a reaction duration time of 45 min using the CoW (20)/rGO... 

Nanoporous/cracked structures of cobalt oxide (Co3O4) electrodes were successfully fabricated by electroplating of zinc–cobalt onto previously formed TiO2 nanotubes by anodizing of titanium, leaching of zinc in a concentrated alkaline solution and followed by drying and annealing at 400 °C. The structure and morphology of the obtained Co3O4 electrodes were characterized by X-ray diffraction, EDX analysis and scanning electron microscopy. The results showed that the obtained Co3O4 electrodes were composed of the nanoporous/cracked structures with an average pore size of about 100 nm. The electrochemical capacitive behaviors of the nanoporous Co3O4 electrodes were investigated by cyclic... 

The BaCe0.9Y0.1O3-δ (BCY) perovskite membrane was successfully synthesized by liquid citrate method. The phase structure of the powder was characterized by X-ray diffraction (XRD). Scanning electron microscopy (SEM) was used to characterize microstructures of the membrane sintered under various conditions. Sintering temperatures and dwell time during sintering influence the final microstructure of the ceramic. Results showed that increasing sintering temperature resulted in a dense membrane with clear grains. An increase of dwell time was favorable to produce membranes with larger grains in the sintered ceramics. A density of 5.87 g/cm3 was reached for the membrane after sintering at 1200 °C...