Sharif Digital Repository

Dinuclear cis-dioxomolybdenum(VI) complex [{MoO 2(Bz 2Benzenediyldtc)} 2] coordinated by a quadradentate dithiocarbamate (Bz 2Benzenediyldtc 2- = 1,4-benzenediylbis(benzyldithiocarbamate)(2-)) has been prepared and characterized by elemental analysis, 13C NMR, IR and UV-vis spectroscopy. The kinetics of the oxygen atom transfer between [{MoO 2(Bz 2Benzenediyldtc)} 2] and PPh 3 was studied spectrophotometrically in CH 2Cl 2 medium at 520 nm and four different temperatures, 288, 293, 298 and 303 K, respectively. The reaction follows second order kinetics with the rate constant k = 0.163(2) M -1 S -1 and its increasingly strong absorption at 520 nm clearly indicate the formation of a μ-oxo... 

A reduction in catalyst's activity with time-on-stream and the formation of side products are two of the problems associated with catalytic propane dehydrogenation (PDH). Previous studies have indicated that the presence of small amounts of oxygenated additives such as water can reduce coke formation and enhance catalyst activity. The aim of the present work was to develop an appropriate kinetic model for PDH over a commercial Pt-Sn/γ-Al 2O3 catalyst in the presence of small amounts of water. Experimental data were obtained from a previous study where catalytic PDH was carried out in a bench scale reactor system at atmospheric pressure in the temperature range of 575-620°C in the presence of... 

This research aimed at finding the factors with more impact on the bioleaching of a spent hydrocracking catalyst by thermophilic acidophilic archaea called Acidianus brierleyi and determining the optimal condition in order to reach the maximum metals recovery. Initially, four more significant factors affecting the bioleaching efficiency including pH, pulp density, inoculation and elemental sulfur concentration, were screened and identified among ten key factors using Plackett-Burman factorial design. Next, a central composite design was applied to obtain the optimum conditions for achieving the maximum efficiency of the bioleaching process. pH 1.6, pulp density 0.6% (w/v), inoculation 4%... 

The chitosan/poly vinyl alcohol membrane was modified by addition of some amine group to the membrane structure utilizing polyethyleneimine (PEI) in order to increase ionic metals adsorbent properties of the membrane. The removal percentage of the modified membranes was compared with the pristine membrane and activated carbon as common adsorbents. The membranes were characterized by FTIR, SEM, swelling degree and porosity measurement. The removal percentage of the membrane containing 0.5 wt.% PEI was more than 60% higher than the activated carbon and more than 40% higher than the pristine membrane. The modified membrane showed excellent adsorption capacity of 112.13, 86.08, and 75.5 mg/g for... 

In this research nano γ-Al 2O 3 catalyst was synthesized through precipitation process then characterized and utilized for methanol dehydration reaction in a slurry batch reactor in route to the indirect synthesis of the dimethyl ether (DME). In this venue, effects of the key parameters on methanol conversion and catalyst stability were investigated. Moreover, the internal and external mass transfer resistances were eliminated; hence the intrinsic kinetics controlled the reaction. Therefore, the optimum conditions for temperature, methanol concentration, catalyst mass and stirrer speed were determined to be 300°C, 1.18mol/l, 1.5g and 1100rpm, respectively. Next, different reaction rate... 

The synthesis of cheap and environmental friendly adsorbent from residual sugarcane bagasse was done for the removal of naphthalene from aqueous solution. The activated carbon dot was obtained by KOH chemical activation of carbon dots. The characteristics of carbon dots and activated carbon dots were determined using field emission scanning electron microscopy, Fourier transform infrared spectroscopy, Raman spectroscopy, and thermogravimetric analysis. A series of experiments were conducted in a batch system to assess the effect of the system variables, i.e., initial pH, initial naphthalene concentration, adsorbent dosage, and contact time. The kinetic data showed better fit to the... 

The oxidation behavior of three types of stainless steels, namely AISI 321, AISI 316, and AISI 409, was compared. In all stainless steels, oxide layers were formed and their masses and thicknesses increased with oxidation time. Among them, AISI 409 ferritic stainless steel demonstrated higher oxidation rate. According to the kinetical oxidation behavior of them at elevated temperatures, the oxidation mechanism was determined. Among them, the AISI 409 ferritic stainless steel showed the lowest and AISI 321 austenitic stainless steel demonstrated the highest oxidation resistance. Based on the experimental results, it was suggested that the kinetic of oxide growth in stainless steels was... 

Pyrolysis is a commonly used method for the recovery of used lubricating oil (ULO), which should be kinetically improved by a catalyst, due to its high level of energy consumption. In this research, the catalytic effects of carbon nanotube (CNT) and graphene nanoplatelets on the pyrolysis of ULO were studied through thermogravimetric analysis. First, the kinetic parameters of ULO pyrolysis including activation energy were calculated to be 170.12 and 167.01 kJ mol−1 by FWO and KAS methods, respectively. Then, the catalytic effects of CNT and graphene nanoplatelets on pyrolysis kinetics were studied. While CNT had a negligible effect on the pyrolysis process, graphene nanoplatelets... 

A simple bio-conjugation procedure to surround a single horseradish peroxidase (HRP) enzyme molecule with dendritic polyester macromolecules (polyester-32-hydroxyl-1-carboxyl bis-MPA dendron, generation 5) was proposed. The characterization of resultant nanoparticles entitled HRP dendrozyme, was performed by transmission electron microscopy, dynamic light scattering, gel permeation chromatography and Fourier transform infrared spectroscopy. The results showed that HRP nanoparticles were spherical in shape and have an average size of 14 ± 2. nm in diameter. Furthermore, bio-conformational characterization of HRP dendrozyme was performed by means of circular dichroism and fluorescence... 

Propane dehydrogenation was carried over a commercial Pt-Sn/γ-Al 2O3 catalyst at atmospheric pressure and reaction temperatures of 580, 600, and 620°C and WHSV of 11 h-1 in an experimental tubular quartz reactor. Propane conversions were measured for catalyst time on stream of up to nine days. The amounts of coke deposited on the catalyst were measured after one, three, six, and nine days on stream using a thermogravimetric differential thermal analyzer (TG-DTA) for each reaction temperature. The coke formation kinetics was successfully described by a coke formation model based on a monolayer-multilayer mechanism. In addition, catalyst deactivation was presented by a time-dependant... 

In this research, an algorithm based on the Q-state Potts model is presented for modeling the austenite to ferrite transformation. In the algorithm, it is possible to exactly track boundary migration of the phase formed during transformation. In the algorithm, effects of changes in chemical free energy, strain free energy and interfacial energies of austenite-austenite, ferrite-ferrite and austenite-ferrite during transformation are considered. From the algorithm, the kinetics of transformation and mean ferrite grain size for different cooling rates are calculated. It is found that there is a good agreement between the calculated and experimental results  

In micron-scale, powder consolidation process is driven by diffusion phenomenon, while in nano-scale the higher surface energy of particles leads to some anomalous behaviors within the process. In order to investigate the nano-sintering occurrence, an atomistic approach is employed via molecular dynamics simulations. Within this approach, the effect of particle size and temperature is examined. The study of particle structure emphasizes on a transition on the governing mechanism of process depending on the material energy levels. The results show that in a specific particle size at low temperatures, the main sintering mechanism is the plastic deformation, while at elevated temperatures it... 

Extraction of lipoxygenase-1 was investigated by using the aqueous two-phase system formed by sodium sulfate-poly(ethylene glycol)-buffer. The extraction was performed in a 47-mm inner diameter spray column, operating in a semibatch manner. The effects of dispersed-phase flow rate and phase compositions on fractional dispersed-phase hold up (εD) and volumetric masstransfer coefficient (KDa) were respectively studied. It was found that the hold-up and volumetric mass-transfer coefficient increased with an increase in dispersed-phase velocity and decreased with increasing phase composition. Correlations have been developed by nonlinear regression for estimation of fractional dispersed-phase... 

The current study was carried out to investigate the kinetics of reactions for the pressure oxidative leaching of a molybdenite concentrate in less than one hour. The effects of oxygen pressure, stirring speed, pulp density, acid concentration and temperature on the leaching rate of the molybdenum were studied. It was found that about 85% of molybdenite was oxidized to molybdic oxide precipitate with remaining molybdenum dissolved in the leaching liquor. Analysis of experimental data showed that the reaction is chemically controlled with activation energy of 68.8 kJ/mol. Furthermore SEM images showed no significant boundary diffusion layer and it was noted that the molybdic oxide... 

The thorough knowledge of the asphaltene aggregation phenomena and pressure/temperature related kinetics is helpful for accurate prediction/control of the asphaltene issues in all facets of petroleum production/processing. However, characterizing the asphaltene aggregation phenomena in live oils at high pressure-high temperature conditions is not well discussed in the available literature. In this work, the asphaltene aggregation phenomena as well as the kinetics of aggregation at different levels of pressure and temperature are investigated in light and heavy live oils using high pressure microscope. The results are presented and discussed in terms of asphaltene onset pressure, aggregates... 

Thermal oxidation of commercial ilmenite concentrate from Kahnouj titanium mines, Iran, at 500-950 C was investigated for the first time. Fractional conversion was calculated from mass change of the samples during oxidation. Maximum FeO to Fe2O3 conversion of 98.63 % occurred at 900 C after 120 min. Curve fit trials together with SEM line scan results indicated constant-size shrinking core model as the closest kinetic mechanism of the oxidation process. Below 750 C, chemical reaction with activation energy of 80.65 kJ mol-1 and between 775 and 950 C, ash diffusion with activation energy of 53.50 kJ mol-1 were the prevailing mechanisms. X-ray diffraction patterns approved presence of... 

Al-Si3N4 couples were heat-treated at 850-1150°C for 250 hours. The thickness of the interacted area was measured by scanning electron microscopy (SEM) and scanning/transmission electron microscopy (TEM/STEM). The interaction rate increases exponentially with inverse temperature, with an activation energy of 194.23 kJ/mol and diffusion pre-coefficient of 5 × 10−9 m2/s, indicating that the interaction is diffusion-dependent. As the results showed, the interfacial area is comprised of Al alloy channels, Si precipitates, and AlN grains. Al-Si transfer through the solid solution (Si3-xAlxN4-y) at the interface of Al alloy and β-Si3N4 grains controls the kinetic of the interaction. When... 

The pyrolysis of low-volatile Tabas anthracite coal was investigated by thermogravimetric technique (TGA) in the temperature range from ambient to 1100 °C under non-isothermal heating conditions (1.5, 3, and 7 °C/min heating rates). Higher heating rates showed a small retarding effect on devolatilization toward higher temperatures. Iso-conversional method was used for the kinetic study of non-isothermal Thermogravimetric data. Activation energy calculated for coal conversion of 20–80% was about 319 kJ/mol which may be a result of stable ordered structure of this type of coal. Analysis of evolved gases by Fourier transform infrared spectrometry (FTIR) in 7 °C/min heating rate was conducted... 

Gaseous reduction of manganese ores has been studied as it is beneficial for both understanding the common ferromanganese production process and the development of new processes. Thermodynamics, kinetics, and the mechanisms of reduction by methane have been reviewed, supported by thermodynamic calculations from the commercial HSC Chemistry and FactSage software. While there were similarities in reduction process by CO and H2, methane was a more efficient reductant and yielded reduction levels beyond MnO, which was due to the large thermodynamic driving force for carbide formation by metastable methane. The practical aspects of gaseous reduction by methane, such as application of a... 

In this experimental study, a kinetic model has been developed for Fischer-Tropsch synthesis reactions by using sol-gel technique and Fe/Ni/Al 2O 3 as the catalyst (40% Fe/60% Ni/40 wt.%Al 2O 3) in a differential fixed-bed micro reactor assuming no internal or external diffusion. Operating conditions of the reactor were as follows: total pressure 1-12 atm; Temperature 220-260 °C; H 2/CO feed ratio 1.5-2; gas hourly space velocity 2100-7000 cm 3(STP)/h/ g cat and conversions of 6-37% of hydrogen and 7-21% of carbon monoxide. Mass transfer limitations were investigated by changing synthesis gas velocity in reactors which differ in size. Based on the hypothesis that water inhibits the intrinsic...