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Full-Text Articles in Engineering
Single-Particle Model For A Lithium-Ion Cell: Thermal Behavior, Meng Guo, Godfrey Sikha, Ralph E. White
Single-Particle Model For A Lithium-Ion Cell: Thermal Behavior, Meng Guo, Godfrey Sikha, Ralph E. White
Faculty Publications
The single-particle model presented by Santhanagopalan et al. [ J. Power Sources , 156 , 620 (2006)] is extended to include an energy balance. The temperature dependence of the solid phase diffusion coefficient of the lithium in the intercalation particles, the electrochemical reaction rate constants, and the open circuit potentials (OCPs) of the positive and negative electrodes are included in the model. The solution phase polarization is approximated using a nonlinear resistance, which is a function of current and temperature. The model is used to predict the temperature and voltage profiles in a lithium-ion cell during galvanostatic operations. The single-particle …
Maximizing The Life Of A Lithium-Ion Cell By Optimization Of Charging Rates, Saeed Khaleghi Rahimian, Sean Rayman, Ralph E. White
Maximizing The Life Of A Lithium-Ion Cell By Optimization Of Charging Rates, Saeed Khaleghi Rahimian, Sean Rayman, Ralph E. White
Faculty Publications
Using a dynamic optimization method, the optimum charge currents as a function of cycle number during cycling for the lithium-ion cell are obtained. A single particle physics-based model, which includes capacity fade, was applied to simulate the cell performance under low earth-orbit (LEO) cycling conditions. Useful cell life is defined as the number of cycles before the end of discharge voltage drops below 3.0 V or the cell discharge capacity becomes less than 20% of the original discharge capacity. The simulated useful cell life can be increased by ∼29.28% by varying the charge current.
Theoretical Analysis Of Stresses In A Lithium Ion Cell, Sindhuja Renganathan, Godfrey Sikha, Shriram Santhanagopalan, Ralph E. White
Theoretical Analysis Of Stresses In A Lithium Ion Cell, Sindhuja Renganathan, Godfrey Sikha, Shriram Santhanagopalan, Ralph E. White
Faculty Publications
A mathematical model to simulate the generation of mechanical stress during the discharge process in a dual porous insertion electrode cell sandwich comprised of lithium cobalt oxide and carbon is presented. The model attributes stress buildup within intercalation electrodes to two different aspects: changes in the lattice volume due to intercalation and phase transformation during the charge/discharge process. The model is used to predict the influence of cell design parameters such as thickness, porosity, and particle size of the electrodes on the magnitude of stress generation. The model developed in this study can be used to understand the mechanical degradation …
An Efficient Electrochemical–Thermal Model For A Lithium-Ion Cell By Using The Proper Orthogonal Decomposition Method, Long Cai, Ralph E. White
An Efficient Electrochemical–Thermal Model For A Lithium-Ion Cell By Using The Proper Orthogonal Decomposition Method, Long Cai, Ralph E. White
Faculty Publications
The proper orthogonal decomposition method was applied to develop an efficient, reduced order electrochemical–thermal model for a lithium-ion cell. This model was validated for discharge simulations over a wide range of C rates and various cooling conditions of the cell. The reduced order model agrees well with the COMSOL model, a commercial finite element method solver, and requires times less computation time than the COMSOL model. The model predictions indicate that the discharge time or percent of capacity removed from the cell at an end of discharge voltage of 3.0 V depends on the rate of the discharge and heat …
Reduction Of Model Order Based On Proper Orthogonal Decomposition For Lithium-Ion Battery Simulations, Long Cai, Ralph E. White
Reduction Of Model Order Based On Proper Orthogonal Decomposition For Lithium-Ion Battery Simulations, Long Cai, Ralph E. White
Faculty Publications
A reduced-order model (ROM) is developed using proper orthogonal decomposition (POD) for a physics-based lithium-ion battery model. The methodology to obtain the proper orthogonal modes and to analyze their optimality is included. The POD-based ROM for a lithium-ion battery is used to simulate a charge/discharge process and the behavior of a battery pack. Compared to the physics-based model, the computational time to solve the ROM is significantly less, and the two models show excellent agreement.
Analytical Expression For The Impedance Response For A Lithium-Ion Cell, Godfrey Sikha, Ralph E. White
Analytical Expression For The Impedance Response For A Lithium-Ion Cell, Godfrey Sikha, Ralph E. White
Faculty Publications
An analytical expression to predict the impedance response of a dual insertion electrode cell (insertion electrodes separated by an ionically conducting membrane) is presented. The expression accounts for the reaction kinetics and double-layer adsorption processes at the electrode-electrolyte interface, transport of electroactive species in the electrolyte phase, and insertion of species in the solid phase of the insertion electrodes. The accuracy of the analytical expression is validated by comparing the impedance response predicted by the expression to the corresponding numerical solution. The analytical expression is used to predict the impedance response of a lithium-ion cell consisting of a porous LiCoO …
Thermal Model For A Li-Ion Cell, Karthikeyan Kumaresan, Godfrey Sikha, Ralph E. White
Thermal Model For A Li-Ion Cell, Karthikeyan Kumaresan, Godfrey Sikha, Ralph E. White
Faculty Publications
A thermal model for a lithium-ion cell is presented and used to predict discharge performance at different operating temperatures. The results from the simulations are compared to experimental data obtained from lithium-ion pouch cells. The model includes a set of parameters (and their concentration and temperature dependencies) that has been obtained for a lithium-ion cell composed of a mesocarbon microbead anode, LiCoO2 cathode in 1 M LiPF6 salt, in a mixture of ethylene carbonate, propylene carbonate, ethyl-methyl carbonate, and diethyl carbonate electrolyte. The parameter set was obtained by comparing the model predictions to the experimental discharge profiles obtained …
Parameter Estimation And Life Modeling Of Lithium-Ion Cells, Shriram Santhanagopalan, Qi Zhang, Karthikeyan Kumaresan, Ralph E. White
Parameter Estimation And Life Modeling Of Lithium-Ion Cells, Shriram Santhanagopalan, Qi Zhang, Karthikeyan Kumaresan, Ralph E. White
Faculty Publications
Lithium-ion pouch cells were cycled at five different temperatures (5, 15, 25, 35, and 45°C ), and rate capability studies were performed after every hundred cycles. The data were used with a simple physics-based model to estimate parameters that capture the capacity fade in the cell, with cycling. The weight of active material within each electrode was estimated as a function of time, using rate capability data at the C/33 rate. The C-rate for these cells is 1.656 A. The capacity fade due to the loss of active material and that due to the loss of cyclable lithium …
Analytical Expression For The Impedance Response Of An Insertion Electrode Cell, Godfrey Sikha, Ralph E. White
Analytical Expression For The Impedance Response Of An Insertion Electrode Cell, Godfrey Sikha, Ralph E. White
Faculty Publications
An analytical expression for the impedance response of an insertion cathode/separator/foil anode cell sandwich is presented. The analytical expression includes the impedance contributions from interfacial kinetics, double-layer adsorption, and solution-phase and solid-phase diffusion processes. The validity of the analytical solution is ascertained by comparison with the numerical solution obtained for a LiCoO2 /polypropylene/lithium metal cell. The flexibility of the analytical solution is utilized to analyze various limiting conditions. An expression to estimate solid-phase diffusion coefficient of insertion species in a porous electrode influenced by the solution-phase diffusion process is also derived
Parameter Estimation And Model Discrimination For A Lithium-Ion Cell, Shriram Santhanagopalan, Qingzhi Guo, Ralph E. White
Parameter Estimation And Model Discrimination For A Lithium-Ion Cell, Shriram Santhanagopalan, Qingzhi Guo, Ralph E. White
Faculty Publications
Two different models were used to obtain transport and kinetic parameters using nonlinear regression from experimental charge/discharge curves of a lithium-ion cell measured at 35°C under four rates, C/5, C/2, 1C, and 2C, where the C rate is 1.656A . The Levenberg-Marquardt method was used to estimate parameters in the models such as the diffusion of lithium ions in the positive electrode. A confidence interval for each parameter was also presented. The parameter values lie within their confidence intervals. The use of statistical weights to correct for the scatter in experimental data as well as to treat one set of …
A Mathematical Model For A Lithium-Ion Battery/Electrochemical Capacitor Hybrid System, Godfrey Sikha, Ralph E. White, Branko N. Popov
A Mathematical Model For A Lithium-Ion Battery/Electrochemical Capacitor Hybrid System, Godfrey Sikha, Ralph E. White, Branko N. Popov
Faculty Publications
A one-dimensional model for predicting the performance of a battery/electrochemical capacitor-hybrid system has been developed. Simulation results are presented for a LiCoO2|LiPF6 ethylene carbonate/dimethyl carbonate|carbon battery system and a Maxwell PC 10F carbon double-layer electrochemical capacitor. The current shared between the battery and the electrochemical capacitor at very short times depends on the ohmic resistances of the battery and the capacitor. As the discharge proceeds, the operating conditions such as frequency, duty ratio, and peak pulse discharge current control the current shared among parallel circuits. These parameters also determine the extent of the run time increase of …
Cubic Spline Regression For The Open-Circuit Potential Curves Of A Lithium-Ion Battery, Qingzhi Guo, Ralph E. White
Cubic Spline Regression For The Open-Circuit Potential Curves Of A Lithium-Ion Battery, Qingzhi Guo, Ralph E. White
Faculty Publications
A cubic spline regression model was used to fit the experimental open-circuit potential (OCP) curves of two intercalation electrodes of a lithium-ion battery. All the details of an OCP curve were accurately predicted by the resulting model. The number of regression intervals used to fit an OCP curve was determined in a way such that in each regression interval the OCP exhibits a profile predictable by a third-order polynomial. The locations of the data points used to separate regression intervals were optimized. Compared to a polynomial model with the same number of fitting parameters, the cubic spline regression model is …
Development Of First Principles Capacity Fade Model For Li-Ion Cells, P. Ramadass, Bala Haran, Parthasarathy M. Gomadam, Ralph E. White, Branko N. Popov
Development Of First Principles Capacity Fade Model For Li-Ion Cells, P. Ramadass, Bala Haran, Parthasarathy M. Gomadam, Ralph E. White, Branko N. Popov
Faculty Publications
A first principles-based model has been developed to simulate the capacity fade of Li-ion batteries. Incorporation of a continuous occurrence of the solvent reduction reaction during constant current and constant voltage (CC-CV) charging explains the capacity fade of the battery. The effect of parameters such as end of charge voltage and depth of discharge, the film resistance, the exchange current density, and the over voltage of the parasitic reaction on the capacity fade and battery performance were studied qualitatively. The parameters that were updated for every cycle as a result of the side reaction were state-of-charge of the electrode materials …
Effect Of Porosity On The Capacity Fade Of A Lithium-Ion Battery: Theory, Godfrey Sikha, Branko N. Popov, Ralph E. White
Effect Of Porosity On The Capacity Fade Of A Lithium-Ion Battery: Theory, Godfrey Sikha, Branko N. Popov, Ralph E. White
Faculty Publications
A mathematical model is presented to predict the performance of a lithium-ion battery. It includes the changes in the porosity of the material due to the reversible intercalation processes and the irreversible parasitic reaction. The model was also extended to predict the capacity fade in a lithium-ion battery based on the unwanted parasitic reaction that consumes Li+ along with the changes in the porosities of the electrodes with cycling due to the continuous parasitic side reaction. The model can be used to predict the drop in the voltage profile, change in the state of charge, and the effects of …
Cycle Life Modeling Of Lithium-Ion Batteries, Gang Ning, Branko N. Popov
Cycle Life Modeling Of Lithium-Ion Batteries, Gang Ning, Branko N. Popov
Faculty Publications
A first-principles-based charge-discharge model was developed to simulate the capacity fade of Li-ion batteries. The model is based on the loss of active lithium ions due to solvent reduction reaction and on the rise of the anode film resistance. The effect of parameters such as exchange current density, depth of discharge (DOD), end of charge voltage, film resistance, and the overvoltage of parasitic reaction were studied quantitatively. The model controls the required DOD by controlling the discharge time and estimates the end of discharge voltages as a function of cycle number.
Modeling Heat Conduction In Spiral Geometries, Parthasarathy M. Gomadam, Ralph E. White, John W. Weidner
Modeling Heat Conduction In Spiral Geometries, Parthasarathy M. Gomadam, Ralph E. White, John W. Weidner
Faculty Publications
A two-dimensional (2-D) energy balance (the 2D model) is reduced to a one-dimensioanl (1-D) energy balance (the 1D-radial-spiral model) by a coordinate transformation approach. The 1D-radial-spiral model, even though 1-D, captures both radial and spiral heat conductions over a wide range of design parameters. By comparing the temperature predictions of the 1D-radial-spiral model and the 2D model, parameter ranges were identified where spiral conduction was important and where the 1D-radial-spiral model held. The 1D-radial-spiral model provided a sixtyfold savings in computation time over the 2D model. When coupled to electrochemistry, the 2D model took approximately 20 h to simulate a …
Study Of Sn-Coated Graphite As Anode Material For Secondary Lithium-Ion Batteries, Basker Veeraraghavan, Anand Durairajan, Bala Haran, Branko N. Popov, Ronald Guidotti
Study Of Sn-Coated Graphite As Anode Material For Secondary Lithium-Ion Batteries, Basker Veeraraghavan, Anand Durairajan, Bala Haran, Branko N. Popov, Ronald Guidotti
Faculty Publications
Tin-graphite composites have been developed as an alternate anode material for Li-ion batteries using an autocatalytic deposition technique. The specific discharge capacity, coulombic efficiency, rate capability behavior, and cycle life of Sn-C composites has been studied using a variety of electrochemical methods. The amount of tin loading and the heating temperature have a significant effect on the composite performance. The synthesis conditions and Sn loading on graphite have been optimized to obtain the maximum reversible capacity for the composite electrode. Heating the composite converts it from amorphous to crystalline form. Apart from higher capacity, Sn-graphite composites possesses higher coulombic efficiency, …
Studies On Capacity Fade Of Spinel-Based Li-Ion Batteries, Ramadass Premanand, Anand Durairajan, Bala Haran, Ralph E. White, Branko N. Popov
Studies On Capacity Fade Of Spinel-Based Li-Ion Batteries, Ramadass Premanand, Anand Durairajan, Bala Haran, Ralph E. White, Branko N. Popov
Faculty Publications
The performance of Cell-Batt® Li-ion cells using nonstoichiometric spinel as the positive electrode material has been studied at different charging rates. The capacity of the cell was optimized based on varying the charging current and the end potential. Subsequent to this, the capacity fade of these batteries was studied at different charge currents. During cycling, cells were opened at intermittent cycles and extensive material and electrochemical characterization was done on the active material at both electrodes. For all charge currents, the resistance of both the electrodes does not vary significantly with cycling. This result is in contrast with cells …
Modeling Of A Nickel-Hydrogen Cell: Phase Reactions In The Nickel Active Material, B. Wu, Ralph E. White
Modeling Of A Nickel-Hydrogen Cell: Phase Reactions In The Nickel Active Material, B. Wu, Ralph E. White
Faculty Publications
No abstract provided.
The Effect Of Particle Size On The Discharge Performance Of A Nickel-Metal Hydride Cell, Jussi M. Heikonen, Harry J. Ploehn, Ralph E. White
The Effect Of Particle Size On The Discharge Performance Of A Nickel-Metal Hydride Cell, Jussi M. Heikonen, Harry J. Ploehn, Ralph E. White
Faculty Publications
We investigate the effect of particle size on the discharge performance of a nickel-metal hydride cell with a mathematical model. Electrodes with uniform as well as with nonuniform particle sizes are studied. With uniform particle size, the dependence of the particle-to-particle resistance on the particle size is taken into account. The optimal particle size depends on the discharge rate. Moreover, we show that under certain conditions it is advantageous to use a nonuniform particle size. In general, the higher the discharge current density, the more the particle size affects the electrode performance.
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.
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 …
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 …
Mathematical Model Of A Lithium/Polypyrrole Cell, Taewhan Yeu, Ralph E. White
Mathematical Model Of A Lithium/Polypyrrole Cell, Taewhan Yeu, Ralph E. White
Faculty Publications
A mathematical model to simulate the charge/discharge behavior of a lithium/lithium perchlorate-propylene carbonate/polypyrrole(Li/LiClO4-PC/PPy) secondary battery cell is presented. The model can be used to gain a better understanding of the behavior of this cell and to provide guidance toward the design of new secondary batteries which utilize an electronically conductive polymer such as polypyrrole (PPy) as the cathode. The model includes the capability of handling charge and discharge behavior and is used to study the effect of various design parameters on the performance of the cell.
A Review Of Mathematical Modeling Of The Zinc/Bromine Flow Cell And Battery, T. I. Evans, Ralph E. White
A Review Of Mathematical Modeling Of The Zinc/Bromine Flow Cell And Battery, T. I. Evans, Ralph E. White
Faculty Publications
Mathematical models which have been developed to study various aspects of the zinc/bromine cell and stack of cells are reviewed. Development of these macroscopic models begins with a material balance, a transport equation which includes a migration term for charged species in an electric field, and an electrode kinetic expression. Various types of models are discussed: partial differential equation models that can be used to predict current and potential distributions, an algebraic model that includes shunt currents and associated energy losses and can be used to determine the optimum resistivity of an electrolyte, and ordinary differential equation models that can …
A Mathematical Model Of A Zn/Br2 Cell On Charge, M J. Mader, Ralph E. White
A Mathematical Model Of A Zn/Br2 Cell On Charge, M J. Mader, Ralph E. White
Faculty Publications
A mathematical model of a parallel plate electrochemical cell with a separator and a homogeneous bulk reaction is presented. The model is based on the Zn/Br2 redox couple and can be used as an aid for the design of an efficient rechargeable storage battery. It is shown that four independent variables exist for the system at a fixed temperature: the effective separator thickness, the residence time, the channel width, and the potential driving force. Performance criteria of interest for the Zn/Br2 battery are defined. Predictions of performance during the charging process are presented. It is shown that the …