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Full-Text Articles in Chemical Engineering
Electrochemical Investigations Of Cobalt-Doped Limn2O4 As Cathode Material For Lithium-Ion Batteries, P. Arora, Branko Popov, Ralph E. White
Electrochemical Investigations Of Cobalt-Doped Limn2O4 As Cathode Material For Lithium-Ion Batteries, P. Arora, Branko Popov, Ralph E. White
Faculty Publications
A wide range (y = 0.05–0.33) of Co-doped LiCoyMn2–yO4 spinels were synthesized and electrochemically characterized. These Co-doped spinels showed improved specific capacity and capacity retention over pure spinels. Electrochemical impedance spectroscopy and the linear polarization resistance technique were used to determine the transport and electrochemical kinetic parameters of Co-doped spinels. The presence of Co in the spinel inhibits the passivation process occurring on the surface of the cathode. Also, Co increases the exchange current density and facilitates the charge-transfer reaction of the active material. The lower self-discharge observed for Co-doped spinels was attributed …
Theoretical Analysis Of Metal Hydride Electrodes: Studies On Equilibrium Potential And Exchange Current Density, Bala S. Haran, Branko N. Popov, Ralph E. White
Theoretical Analysis Of Metal Hydride Electrodes: Studies On Equilibrium Potential And Exchange Current Density, Bala S. Haran, Branko N. Popov, Ralph E. White
Faculty Publications
A theoretical model for the metal hydride electrode has been developed assuming that hydrogen diffusion in the alloy and charge-transfer at the surface control the discharge process. Theoretical equations for the dependence of equilibrium potential and exchange current density on the surface hydrogen concentration have been derived. These parameters have been used to correlate experimental data with the theoretical electrode discharge model. Analysis of both the experimental and theoretical discharge curves reveals a potential plateau determined by the magnitude of the interactions between the hydrogen in the alloy and the unhydrided metal. Neglecting these hydrogen-metal site interactions results in simulations …
A Nonisothermal Nickel‐Hydrogen Cell Model, Pauline De Vidts, Javier Delgado, B. Wu, D. M. See, K. Kosanovich, Ralph E. White
A Nonisothermal Nickel‐Hydrogen Cell Model, Pauline De Vidts, Javier Delgado, B. Wu, D. M. See, K. Kosanovich, Ralph E. White
Faculty Publications
No abstract provided.
Governing Equations For Transport In Porous Electrodes, Pauline De Vidts, Ralph E. White
Governing Equations For Transport In Porous Electrodes, Pauline De Vidts, Ralph E. White
Faculty Publications
No abstract provided.
A Multiphase Mathematical Model Of A Nickel/Hydrogen Cell, Pauline De Vidts
A Multiphase Mathematical Model Of A Nickel/Hydrogen Cell, Pauline De Vidts
Faculty Publications
No abstract provided.
A Parallel-Plate Electrochemical Reactor Model For The Destruction Of Nitrate And Nitrite In Alkaline Waste Solutions, D. H. Coleman, Ralph E. White, D. T. Hobbs
A Parallel-Plate Electrochemical Reactor Model For The Destruction Of Nitrate And Nitrite In Alkaline Waste Solutions, D. H. Coleman, Ralph E. White, D. T. Hobbs
Faculty Publications
A parallel-plate electrochemical reactor model with multiple reactions at both electrodes and anolyte and catholyte recirculation tanks was modeled for the electrochemical destruction of nitrate and nitrite species in an alkaline solution. The model can be used to predict electrochemical reaction current efficiencies and outlet concentrations of species from the reactor, given inlet feed conditions and cell operating conditions. Also, predictions are made for off-gas composition and liquid-phase composition in the recirculation tanks. The results of case studies at different applied potentials are shown here. At lower applied potentials, the model predictions show that the destruction process is more energy …
Mathematical Modeling Of A Nickel-Cadmium Cell: Proton Diffusion In The Nickel Electrode, Pauline De Vidts, Ralph E. White
Mathematical Modeling Of A Nickel-Cadmium Cell: Proton Diffusion In The Nickel Electrode, Pauline De Vidts, Ralph E. White
Faculty Publications
In this paper we present a mathematical model of a sealed nickel-cadmium cell that includes proton diffusion and ohmic drop through the active material in the nickel electrode. The model is used to calculate sensitivity coefficients for various parameters in the model. These calculations show that the discharge voltage of the cell is affected mostly by the kinetics of the nickel reaction. Toward the end of discharge, proton diffusion also becomes important, because the proton diffusion process affects the active material utilization significantly. During charge, the cell voltage is mainly affected by the kinetics of the nickel reaction until the …
Impedance Analysis For Oxygen Reduction In A Lithium Carbonate Melt: Effects Of Partial Pressure Of Carbon Dioxide And Temperature, Bhasker B. Dave, Ralph E. White, Supramaniam Srinivasan, A. John Appleby
Impedance Analysis For Oxygen Reduction In A Lithium Carbonate Melt: Effects Of Partial Pressure Of Carbon Dioxide And Temperature, Bhasker B. Dave, Ralph E. White, Supramaniam Srinivasan, A. John Appleby
Faculty Publications
Effects of partial pressure of carbon dioxide and temperature on oxygen reduction kinetics on a gold electrode in a lithium carbonate melt were examined using electrochemical impedance spectroscopic (EIS) and linear sweep voltammetric techniques. The impedance spectra were analyzed by a complex nonlinear least squares method, using the Randles-Ershler equivalent circuit model, to determine the electrode-kinetic and the mass-transfer parameters such as the charge-transfer resistance and the Warburg coefficient. The cyclic voltammetric measurements indicated that the oxygen reduction process in lithium carbonate melt is "reversible" up to 200 mV/s. The product DC0 determined by cyclic voltammetry agreed well …
Parameter Sensitivity And Optimization Predictions Of A Hydrogen/Oxygen Alkaline Fuel Cell Model, Michael C. Kimble, Ralph E. White
Parameter Sensitivity And Optimization Predictions Of A Hydrogen/Oxygen Alkaline Fuel Cell Model, Michael C. Kimble, Ralph E. White
Faculty Publications
A mathematical model is used to predict parameter sensitivities and optimal design parameters for a hydrogen/oxygen alkaline fuel cell. A sensitivity analysis of the various transport and electrode kinetic parameters indicates which parameters have the most influence on the predicted current density and over which range of potentials these parameters affect the fuel-cell performance the most. This information can be used to decide which parameters should be optimized or determined more accurately through further modeling or experimental studies. The effect of various design parameters on the limiting current density are investigated to determine if optimal values exist for the parameters. …
Mathematical Modeling Of A Primary Zinc/Air Battery, Z. Mao, Ralph E. White
Mathematical Modeling Of A Primary Zinc/Air Battery, Z. Mao, Ralph E. White
Faculty Publications
The mathematical model developed by Sunu and Bennion has been extended to include the separator, precipitation of both solid ZnO and K2Zn(OH)4, and the air electrode, and has been used to investigate the behavior of a primary Zn-Air battery with respect to battery design features. Predictions obtained from the model indicate that anode material utilizationis predominantly limited by depletion of the concentration of hydroxide ions. The effect of electrode thickness on anode material utilization is insignificant, whereas material loading per unit volume has a great effect on anode material utilization; a higher loading lowers both the …
A Mathematical Model Of A Cuo/Cu Vaporvolt Cell, Makoto Kawanami, Trung V. Nguyen, Ralph E. White
A Mathematical Model Of A Cuo/Cu Vaporvolt Cell, Makoto Kawanami, Trung V. Nguyen, Ralph E. White
Faculty Publications
A new battery named "Vaporvolt"b cell is in the early stage of its development. A mathematical model of a CuO/CuVaporvolt cell is presented that can be used to predict the potential and the transport behavior of the cell during discharge.A sensitivity analysis of the various transport and electrokinetic parameters indicates which parameters have the mostinfluence on the predicted energy and power density of the Vaporvolt cell. This information can be used to decide whichparameters should be optimized or determined more accurately through further modeling or experimental studies. Theoptimal thicknesses of electrodes and separator, the concentration of the electrolyte, and …
A Mathematical Model Of A Sealed Nickel-Cadmium Battery, Deyuan Fan, Ralph E. White
A Mathematical Model Of A Sealed Nickel-Cadmium Battery, Deyuan Fan, Ralph E. White
Faculty Publications
A mathematical model for the charge and discharge of a sealed nickel-cadmium (Ni-Cd) battery is presented. The model is used to study the effect of transport properties of the electrolyte and kinetic parameters of the electrode reactions on the cell performance during the charge and discharge period. The model can also be used to demonstrate the changes of cell performance during cycling. Some comparisons between model predictions and experimental results indicate that the model predictions appear to fit the experimental data well. Sensitivity analyses illustrate that the sealed nickel-cadmium battery operates under activation control. It is also shown theoretically that …
Effect Of Ohmic, Mass-Transfer, And Kinetic Resistances On Linear-Sweep Voltammetry In A Cylindrical-Pore Electrode, John W. Weidner, Peter S. Fedkiw
Effect Of Ohmic, Mass-Transfer, And Kinetic Resistances On Linear-Sweep Voltammetry In A Cylindrical-Pore Electrode, John W. Weidner, Peter S. Fedkiw
Faculty Publications
Extracting quantitative kinetic information from linear-sweep voltammograms (LSV) on porous electrodes is more difficult than on planar electrodes since the electrode surface is not uniformly accessible to the bulk supply of reactant or the counterelectrode. We present here a means to account for the effect of ohmic, mass-transfer, and kinetic resistances on LSV by modeling a pore in a porous matrix as a cylindrical-pore electrode, and solving the mass and charge conservation equations in the context of this geometry for the simply redox reaction O + ne– <=> R where both O and R are soluble species. Both analytical …
A Mathematical Model Of A Lithium/Thionyl Chloride Primary Cell, T. I. Evans, T. V. Nguyen, Ralph E. White
A Mathematical Model Of A Lithium/Thionyl Chloride Primary Cell, T. I. Evans, T. V. Nguyen, Ralph E. White
Faculty Publications
A one-dimensional mathematical model for the lithium/thionyl chloride primary cell has been developed to investigate methods of improving its performance and safety. The model includes many of the components of a typical lithium/thionyl chloride cell such as the porous lithium chloride film which forms on the lithium anode surface. The governing equations are formulated from fundamental conservation laws using porous electrode theory and concentrated solution theory. The model is used to predict one-dimensional, time dependent profiles of concentration, porosity, current, and potentialas well as cell temperature and voltage. When a certain discharge rate is required, the model can be used …
Oxygen Reduction In A Proton Exchange Membrane Test Cell, S. J. Ridge, Ralph E. White, Y. Tsou, R. N. Beaver, G. A. Eisman
Oxygen Reduction In A Proton Exchange Membrane Test Cell, S. J. Ridge, Ralph E. White, Y. Tsou, R. N. Beaver, G. A. Eisman
Faculty Publications
Oxygen reduction in a gas-fed porous electrode attached to a proton exchange membrane is discussed. Experimental data and a mathematical model are presented for the test cell used. Various membrane and electrode assemblies were tested at different levels of platinum loading and Teflon® content. The model accounts for the diffusion and reaction of oxygen and the diffusion and reaction of hydrogen ions. Sulfuric acid was placed above the membrane in the test cell reservoir to provide a source of protons for the reduction of oxygen at the cathode. Based upon model predictions, it is shown that the transport of the …
An Algebraic Model For A Zinc/Bromine Flow Cell, G. D. Simpson, Ralph E. White
An Algebraic Model For A Zinc/Bromine Flow Cell, G. D. Simpson, Ralph E. White
Faculty Publications
An algebraic model for a parallel plate, zinc/bromine flow cell is presented and used to predict various performance quantities, which are compared to those predicted by using previously published differential equation models. The results presented compare well with previous work. The model is based on the concept of using well-mixed zones and linear concentration and potential profiles for the diffusion layers and the separator. The Butler-Volmer equation is used for the electrochemical reactions, and the homogeneous reaction between bromine and bromide is included.
Estimation Of Electrode Kinetic Parameters Of The Lithium/Thionyl Chloride Cell Using A Mathematical Model, T. I. Evans, Ralph E. White
Estimation Of Electrode Kinetic Parameters Of The Lithium/Thionyl Chloride Cell Using A Mathematical Model, T. I. Evans, Ralph E. White
Faculty Publications
A one-dimensional mathematical model for the lithium/thionyl chloride primary cell is used in conjunction with a parameter estimation technique, in order to estimate the electrode kinetic parameters of this electrochemical system. The electrode kinetic parameters include the anodic transfer coefficient and exchange current density of the lithium oxidation, a,1 and i0,1,ref; the cathodic transfer coefficient and the effective exchange current density of the thionyl chloride reduction, c,4 and a0i0,4,ref, and a morphology parameter, . The parameter estimation is performed on simulated data first in order to gain confidence in the method. Data reported in …