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    Artificial Neural Network Based Prediction of Heat of Adsorption of Alkanes on Various Zeolites

    , M.Sc. Thesis Sharif University of Technology Zhiyani, Mehrzad (Author) ; Gobal, Ferydon (Supervisor)
    Abstract
    Generally, predicting the adsorption and Catalytic characteristics of the solids base on the primary principles is impossible; this is only possible for small molecules and single crystal surfaces. On the other hand, phenomenological approaches, which are based on experimental data, are efficient approaches in many cases. The best predictions and designs are done by those who have an extensive information “resources” about the “Reactive Substances- Catalytic-conditions” and are able to “analyze” the data based on the “chemical physical Models”. A Neural network is an extremely simplified model of the human brain that predicts a complex characteristic(s) from a series of primary... 

    A Survey With Simulation on DVB-Based Passive Radar

    , M.Sc. Thesis Sharif University of Technology Radmard, Mojtaba (Author) ; Bastani, Mohammad Hassan (Supervisor) ; Behnia, Ferydon (Supervisor)
    Abstract
    One of non-cooperative illuminators recently considered for passive radar application is the DVB-T signal. Its thumbtack ambiguity function beside the constancy over time makes it very desirable. But there are some ambiguities in its ambiguity function that can not be neglected. In this paper, after studying the reasons of the ambiguities we propose some processings to remove them. It is shown that for removing the ambiguities, it’s sufficient to filter out continual pilots and equalize scattered pilots. The results show that an ambiguity function relatively without ambiguities will be obtained. A method for compensating the target’s range migration-that results in processing gain decrease... 

    An artificial neural network simulator of the performance of Sb-containing PbO2 electrodes

    , Article 6th International Conference on Lead-Acid Batteries, LABAT 2005, 13 June 2005 through 16 June 2005 ; 2005 , Pages 61-64 Gobal, F ; Sharif University of Technology
    Institute of Electrochemistry and Energy Systems  2005

    Preparation and electrochemical performances of nanoporous/cracked cobalt oxide layer for supercapacitors

    , Article Applied Physics A: Materials Science and Processing ; Vol. 117, issue. 4 , 2014 , pp. 2087-2094 ; ISSN: 09478396 Gobal, F ; Faraji, M ; Sharif University of Technology
    2014
    Abstract
    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... 

    Electrochemical synthesis of reduced graphene oxide/TiO2 nanotubes/Ti for high-performance supercapacitors

    , Article Ionics ; Volume 21, Issue 2 , 2014 , Pages 525-531 ; ISSN: 09477047 Gobal, F ; Faraji, M ; Sharif University of Technology
    2014
    Abstract
    RGO/TiO2NTs/Ti electrodes with high surface area and good capacitive characteristics were prepared by simple electrochemical reduction of graphene oxide (GO) onto the previously formed TiO2 nanotubes. Microstructure studies show that reduced graphene oxide (RGO) having high surface area has been deposited onto the TiO2NT arrays. The electrochemical capacitive behaviors of the obtained electrodes were investigated by cyclic voltammetry (CV), galvanostatic charge–discharge studies, and electrochemical impedance spectroscopy (EIS) in 1 M H2SO4 solution. The electrochemical data demonstrated that the electrodes displayed specific capacitance of 410 F g−1 at the current density of 50 A g−1 and... 

    Electrodeposited Rh and Rh-Cu Alloys as Ethanol-Tolerant Electrocatalysts for Oxygen Reduction in Alkaline Media

    , Article Electrocatalysis ; Volume 2, Issue 1 , December , 2011 , Pages 42-51 ; 18682529 (ISSN) Gobal, F ; Arab, R ; Sharif University of Technology
    2011
    Abstract
    In this study, rhodium-copper alloys of different compositions are electrodeposited on graphite electrode from aqueous solutions. The bulk compositions of these alloys are determined using energy dispersive X-ray analysis and surface morphologies are investigated by scanning electron microscopy. The catalytic performance of these alloys in oxygen reduction reaction (ORR) in alkaline media is investigated by linear sweep voltammetry on rotating disk electrode assembly. The number of electrons transferred per O 2 molecule (n) obtained at different potentials is four indicating full reduction of oxygen to hydroxide ion. It is shown that Rh-Cu alloys are better electrocatalysts than Rh with... 

    Electrodeposited polyaniline on Pd-loaded TiO2 nanotubes as active material for electrochemical supercapacitor

    , Article Journal of Electroanalytical Chemistry ; Volume 691 , 2013 , Pages 51-56 ; 15726657 (ISSN) Gobal, F ; Faraji, M ; Sharif University of Technology
    2013
    Abstract
    PANI/Pd/TiO2NTs electrodes with highly porous structures and good capacitive characteristics were prepared by electrodeposition of polyaniline on palladium nanoparticles loaded TiO2 nanotubes. The loading of small palladium nanoparticles was carried out by sonochemical reduction of Pd+2 onto TiO2NTs and affected the ordered growth of PANI, reducing the charge transfer resistance and increasing surface area of PANI. The specific capacitance and the stability of electrode showed improvements. The results illustrated that the specific capacitance of these electrodes was around 1060 F g-1 in 1.0 M H2SO4 electrolyte as measured at a constant current of 2.0 A g-1, whereas it was 210 F g-1 for the... 

    A comparative study of sequentially layer-deposited and co-deposited Co-Mn oxides as potential redox capacitors

    , Article Journal of Solid State Electrochemistry ; Volume 16, Issue 4 , April , 2012 , Pages 1561-1569 ; 14328488 (ISSN) Gobal, F ; Jafarzadeh, S ; Sharif University of Technology
    2012
    Abstract
    Layers of cobalt and manganese oxides were co-deposited or deposited on top of each other or next to each other by potentiostatic method onto stainless steel substrate. Deposition potentials of 1 and -1 V for the anodic and cathodic depositions were employed. Specific capacitance values in the range of 38.5-78 F g -1 were found with cobalt oxide on top of manganese oxide having the lowest and manganese oxide on top of cobalt oxide having the highest capacitances. The usefulness of the electrodes was characterized by cyclic voltammetry, charge-discharge cycling, and electrochemical impedance spectroscopy in 2 M NaOH electrolyte for redox supercapacitor applications. The latter presented the... 

    Improved pseudo-capacitive performance of nano-porous manganese oxide on an electrochemically derived nickel framework

    , Article Analytical Letters ; Volume 46, Issue 15 , October , 2013 , Pages 2372-2387 ; 00032719 (ISSN) Gobal, F ; Jafarzadeh, S ; Sharif University of Technology
    2013
    Abstract
    The pseudocapacitance and morphology of electrodeposited transition metal oxides depend significantly on the morphology of the substrate. The nanoporous nickel substrate, derived from selective electro-dissolution of antimony from an electro-deposited Ni-Sb alloy, effectively promotes the electrochemical utilization of manganese oxide deposited on this structure. The large electronic and ionic conduction within the nanostructured deposit improve the energy storage performance of Mn oxide as compared to that on flat Ni substrate. In this work, the MnO2 specific capacitances of around 612 F g-1 were obtained, which was five times higher than Mn oxide deposited on a flat Ni-ribbon. A highly... 

    Fabrication of nanoporous nickel oxide by de-zincification of Zn-Ni/(TiO2-nanotubes) for use in electrochemical supercapacitors

    , Article Electrochimica Acta ; Volume 100 , 2013 , Pages 133-139 ; 00134686 (ISSN) Gobal, F ; Faraji, M ; Sharif University of Technology
    2013
    Abstract
    NiO-ZnO/TiO2NTs electrodes were synthesized by the electrodeposition of Zn-Ni onto TiO2 nanotubes, dealloying in a concentrated alkaline solution and finally calcination of the resulting Zn(OH)2-Ni(OH)2/TiO2NTs at 300 C. Morphology of the electrodeposited nanostructures was studied using scanning electron microscopy (SEM) while their electrochemical characterizations were carried out using cyclic voltammetry (CV), electrochemical impedance spectroscopy (EIS) and galvanostatic charge/discharge procedures. The SEM analysis revealed the nanoporous/cracked structures of the NiO-ZnO/TiO2NTs obtained at the electroplating time of 20 min. The EIS studies showed that nanoporous/cracked structures of... 

    RuO2/MWCNT/ stainless steel mesh as a novel positive electrode in vanadium redox flow batteries

    , Article RSC Advances ; Volume 5, Issue 84 , Aug , 2015 , Pages 68378-68384 ; 20462069 (ISSN) Gobal, F ; Faraji, M ; Sharif University of Technology
    Royal Society of Chemistry  2015
    Abstract
    The present work describes the preparation and electrochemical characterization of RuO2/MWCNT/Stainless Steel Mesh (SSM) electrode as compared with a MWCNT/SSM electrode in the positive half-cell of a Vanadium Redox Flow Battery (VRFB). The electrochemical characterization of prepared electrode was carried out using cyclic voltammetry (CV), electrochemical impedance spectroscopy (EIS) and galvanostatic charge/discharge procedures. The electrochemical activity of MWCNT/SSM modified with RuO2 as positive electrode in a VRFB was notably improved. The RuO2-included electrodes demonstrated high peak current ratio, small peak potential difference and high electron... 

    A preliminary study of the electro-catalytic reduction of oxygen on Cu-Pd alloys in alkaline solution

    , Article Journal of Electroanalytical Chemistry ; Volume 647, Issue 1 , 2010 , Pages 66-73 ; 15726657 (ISSN) Gobal, F ; Arab, R ; Sharif University of Technology
    2010
    Abstract
    Copper-palladium alloys of different compositions are electrodeposited on nickel from aqueous solutions. These alloys are characterized by scanning electron microscopy (SEM) and energy dispersive X-ray analysis (EDX). The catalytic activity of these alloys toward oxygen reduction reaction (ORR) in alkaline solution is investigated using rotating disk electrode (RDE). The number of electrons transferred per O2 molecule (n) obtained at different potentials is close to 2 at low overpotential indicating HO2- formation and gradually increases to 4 at higher overpotentials indicating full reduction to OH-. It is shown that Cu-Pd alloys are better electrocatalysts than Pd with Pd-Cu-1 having 24.5%... 

    A UBI-QEP based study of the energetics of formic acid decomposition on Cu85Pd15(110) surface

    , Article Indian Journal of Chemistry - Section A Inorganic, Physical, Theoretical and Analytical Chemistry ; Volume 40, Issue 12 , 2001 , Pages 1258-1261 ; 03764710 (ISSN) Gobal, F ; Azizian, S ; Sharif University of Technology
    2001
    Abstract
    The method of unity bond index-quadratic exponential potential has been employed to calculate the heats of adsorption of formic acid and its fragments and the activation energy of the catalytic dehydrogenation of formic acid on Cu85Pd15(110) surface. The active site being a 3-fold site composed of one Pd and two Cu atoms. The calculations based on assuming hydrogen bonding interactions between the adsorbed formic acid and formate species best account for the experimental findings. It is concluded that the rate determining step is the decomposition of formate occurring with an activation energy of 125 kJmol-1, while desorption of the products, CO2 and H2 require activation energies of 20 and... 

    On the dehydrogenation of 1- and 2-propanols on Cu(111) surface: A UBI-QEP based approach

    , Article Indian Journal of Chemistry - Section A Inorganic, Physical, Theoretical and Analytical Chemistry ; Volume 43, Issue 10 , 2004 , Pages 2049-2054 ; 03764710 (ISSN) Gobal, F ; Eftekhari, A ; Sharif University of Technology
    2004
    Abstract
    The method of unity bond index-quadratic exponential potential (UBI-QEP) has been employed to investigate the energetics of routes to adsorption and decomposition of 1- and 2-propanols on Cu(111) plane. Both the clean and pre-adsorbed oxygen containing surfaces have been considered. A mechanism based on the formation of surface alkoxide groups which become more favored in the presence of adsorbed oxygen and further elimination of β-hydrogen to yield exclusively the corresponding aldehyde/ketone is confirmed on the basis of the energy criteria. The latter process is somewhat hindered in the presence of surface oxygen. The early adsorption of water and the lack of H/D scrambling as reported... 

    An Energetics Study of Formation of Some Organic Compounds in Fischer-Tropsch Synthesis by the Method of Unity Bond Index-Quadratic Exponential Potential (UBI-QEP)

    , M.Sc. Thesis Sharif University of Technology Javadi, Nabi (Author) ; Gobal, Fereydoon (Supervisor)
    Abstract
    The purpose of this project is the prediction of the activation barriers and enthalpy for elementary steps in the process of Fischer-Tropsch over the surfaces of Fe, Cu and Fe/Cu alloys catalyst by using of UBI-QEP method aiming at finding prediction of the activity and selectivity on the basis of energy criteria.
    UBI-QEP methods is based on conservation of bond index of adsorbed molecules and follow the quadratic exponential potential for energy, calculate the enthalpy and activation barriers of reaction pathways in a heterogeneous catalytic process and select the most desirable path to take.
    The elementary steps such as dissociation of CO, hydrogenation of carbidic carbon, C-C... 

    Theoretical Analysis of the Electrochemistry and Power Generation in Thermally Activated Batteries

    , M.Sc. Thesis Sharif University of Technology Sharafi, Mona (Author) ; Gobal, Fereydoun (Supervisor)
    Abstract
    Study the potential and internal resistance of the electrochemical cells in different states of charge are important for practical and usage. Measurement of these parameters in an electrochemical cell is inseparably bound to the electrochemical resistance, temperature and also geometric states of different parts of the cell. In This project we focus on power and resistance of one kind of batteries called thermally activated batteries. These batteries are active after receiving heat and they are inactive at room temperature. Two of the most important models of these batteries that are discussed in this project are LiSi/ LiCl- KCl / FeS2 battery ( with liquid - molten salt electrolyte ) and... 

    The Poisoning Effect of Sulfur-Containing Compounds on the Elelctro-Oxidation of Methanol and Ethanol on Ni and Cu Electrodes

    , M.Sc. Thesis Sharif University of Technology Valadbeigi, Younes (Author) ; Gobal, Fereydon (Supervisor)
    Abstract
    In this study a systematic effort was made to investigate the poisoning effect of sulfur-containing materials on the electro- oxidation of methanol and ethanol on Ni and Cu electrodes in alkaline solutions by the methods of cyclic voltammetry, chronoamperometry and electrochemical impedance spectroscopy. Activation energy of methanol electro-oxidation in the absence of Na2S was obtained 30.7 kJ/mol by cyclic voltammetric at different temperatures, and its values increased by increase in Na2S concentrations to 97kJ/mol. Na2S adsorption isotherms corresponded with Langmuire isotherm, equilibrium constants of adsorption – desorption and adsorption enthalpy (ΔHads= -62kJ/mol) were calculated for... 

    Electrochemical Preparation and Study of Transitional Metal Mixed Oxides as Supercapacitor Electrodes

    , Ph.D. Dissertation Sharif University of Technology Jafarzadeh, Sanaz (Author) ; Gobal, Fereydoon (Supervisor)
    Abstract
    In this thesis, the improving effects of deposited metal oxides onto or next to each other and the advantages of every metal oxide were considered. In the next step, the substrate improvement was studied and the porous metal oxides with ideal supercapacitive properties with porosity increase of substrate were obtained.CoFeO2 supercapacitor was prepared by chronoamperometric ethod.CoFeO2waselectrodeposited at room temperature and presents wide potential window and good capacitive properties in comparison with other metal oxides.Layers of cobalt and manganese oxides were co-deposited or deposited on top of each other or next to each other by chronometric method onto stainless steel substrate.... 

    Experimental Study of Oxygen Reduction Reaction (ORR) on Cu-alloys, Electrocatalysts in Alkaline Solution and Theoretical Investigation of Oxygen Adsorption on Cu-alloys Nano-clusters

    , Ph.D. Dissertation Sharif University of Technology Arab, Ramezan (Author) ; Gobal, Fereydoon (Supervisor)
    Abstract
    In this study, electrochemical oxygen reduction reaction (ORR) was studied on Cu, Pd, Rh, Pd-Cu and Rh-Cu alloys in alkaline solution. Pd-Cu and Rh-Cu alloys were prepared by electrochemical methods. On copper electrode it is found that direct oxygen reduction is accompanied by the electrochemical reductions of copper oxides. Also, mechanism and kinetics of reaction change as the amount of copper oxides increase on the surface. For electrodeposited alloys, it is indicated that the reactivity of Pd-Cu and Rh-Cu alloys toward oxygen reduction is higher than pure Pd and pure Rh. The maximum reactivity among Pd-Cu alloys is related to the sample with 24.5% copper content while the maximum... 

    Density Functional Study of Adsorption of Small Molecules on Nano-Clusters

    , Ph.D. Dissertation Sharif University of Technology Nahali, Masoud (Author) ; Gobal, Fereydoon (Supervisor)
    Abstract
    This work investigates adsorption and possible dissociation of a number of small molecules on small clusters and carbonic surface. Theoretical study of carbon monoxide adsorption on SixGe4_x(x=0–4) nano-clusters has been carried out using MPW1B95 density functional. The geometry, adsorption energy, charge distribution, and vibrational frequency of CO adsorption on all possible structures were investigated. The maximum vibrational frequency changes occur in the bridge structures while the most stable structures occur when CO adsorbs on one silicon atom in a flat surface. Adsorption energies of CO on one Si atom are by far more negative than the corresponding value for on Ge atom. Theoretical...