• Journal of the Korean Electrochemical Society
• /
• v.22 no.1
• /
• pp.43-52
• /
• 2019

As the application area of lithium secondary batteries becomes wider, performance characterization becomes difficult as well as diverse. To address this issue, battery manufacturers have to evaluate many batteries for a longer period, recruit many researchers and continuously introduce expensive equipment. Simulation techniques based on battery modeling are being introduced to solve such difficulties. Various lithium secondary battery modeling techniques have been reported so far and optimal techniques have been selected and utilized according to their purpose. In this review, the electrochemical modeling based on the Newman model is described in detail. Particularly, we will explain the physical meaning of each equation included in the model; the Butler-Volmer equation, which represents the rate of electrode reaction, the material and charge balance equations for each phase (solid and liquid), and the energy balance. Moreover, simple modeling processes and results based on COMSOL Multiphysics 5.3a will be provided and discussed.

• Journal of Power Electronics
• /
• v.13 no.3
• /
• pp.429-436
• /
• 2013

Online simulations are utilized to reduce time and cost in the development and performance optimization of plug-in hybrid electric vehicle (PHEV) and electric vehicles (EV) systems. One of the most important factors in an online simulation is the accuracy of the model. In particular, a model of a battery should accurately reflect the properties of an actual battery. However, precise dynamic modeling of high-capacity battery systems, which significantly affects the performance of a PHEV, is difficult because of its nonlinear electrochemical characteristics. In this study, a dynamic model of a high-capacity battery cell for a PHEV is developed through the extraction of the equivalent impedance parameters using electrochemical impedance spectroscopy (EIS). Based on the extracted parameters, a battery cell model is implemented using MATLAB/Simulink, and charging/discharging profiles are executed for comparative verification. Based on the obtained results, the model is optimized for a high-capacity battery cell for a PHEV. The simulation results show good agreement with the experimental results, thereby validating the developed model and verifying its accuracy.

• Transactions of the Korean hydrogen and new energy society
• /
• v.19 no.5
• /
• pp.460-466
• /
• 2008

In this study, a computer modeling work has been performed for the power generation system using polymer electrolyte fuel cell with Aspen Plus general purpose chemical process simulator. Stoichiometric reactor module was used for the modeling of reformer for the production of hydrogen. For the modeling of the electrochemical reaction, Gibbs reactor module built-in Aspen Plus was utilized. SRK equation of state model was selected for the proper simulation of the overall fuel cell system.

• Textile Coloration and Finishing
• /
• v.20 no.5
• /
• pp.41-46
• /
• 2008

Recently, computational calculation of molecular energy potentials and electrochemical reduction/oxidation behaviors are of very importance in view point of prediction of dye's properties such as energy levels and bandgaps of absorption. This can be influenced by their different constituents or substituents in chromogen molecules. Structural conformations and properties with computational modeling calculation are numerically simulated, which are fully or partly based on fundamental laws of physics. In addition, cyclic voltammetric measurement was used to obtain the experimental redox potential values, which were compared to the computed simulation values.

• Journal of the Korean Electrochemical Society
• /
• v.9 no.4
• /
• pp.151-157
• /
• 2006

A two-dimensional numerical model to study the performance of anode-supported flat-tube solid oxide fuel cell (SOFC) far the cross section of the cell in the flow direction of the fuel and air flows is developed. In this model a mass and charge balance, Maxwell-Stefan equation as well as the momentum equation by using, Darcy's law are applied in differential form. The finite element method using FEMLAB commercial software is used for meshing, discritization and solving the system of coupled differential equations. The current density distribution and fuel consumption as well as water production are analyzed. Experimental data is used to verify a predicted voltage-current density and power density versus current density to judge on the model accuracy.

• Journal of Electrochemical Science and Technology
• /
• v.13 no.2
• /
• pp.186-198
• /
• 2022

Heavy metals recovery from Printed Circuit Boards industrial wastewater is crucial because of its cost effectiveness and environmental friendliness. In this study, a copper recovery route combining the sequential processes of acid leaching and LIX 984N extracting with an electrowinning technique from Printed Circuit Boards production's sludge was performed. The used residual sludge was originated from Hanoi Urban Environment One Member Limited Company (URENCO). The extracted solution from the printed circuit boards waste sludge containing a high copper concentration of 19.2 g/L and a small amount of iron (0.575 ppm) was used as electrolyte for the subsequent electrolysis process. By using a simulation model for multi-step current electrolysis, the reasonable current densities for an electrolysis time interval of 30 minutes were determined, to optimize the specific consumption energy for the copper recovery. The mathematical simulation model was built to calculate the important parameters of this process.

• Journal of the Korean Electrochemical Society
• /
• v.7 no.2
• /
• pp.69-79
• /
• 2004

To correctly simulate performance characteristics of fuel cells with a modeling method, various physical and chemical phenomena must be considered in fuel cells. In this study, performance characteristics of planar solid oxide fuel cells were simulated by a commercial CFD code, CFD-ACE+. Through simultaneous considerations for mass transfer, heat transfer and charge movement according to electrochemical reactions in the 3-dimensional planar SOFC unit stack, we could successfully predict performance characteristics of solid oxide fuel cells under operation for structural and progress variables. In other words, we solved mass fraction distribution of reactants and products for diffusion and movement, and investigated qualitative and quantitative analysis for performance characteristics in the SOFC unit stack through internal temperature distribution and polarization curve for electrical characteristics. Through this study, we could effectively predict performance characteristics with variables in the unit stack of planar SOFCs and present systematic approach for SOFCs under operation by computer simulation.

• Computers and Concrete
• /
• v.8 no.2
• /
• pp.177-192
• /
• 2011

This research paper aims at computer based modeling of carbonation induced corrosion under extreme conditions and its experimental verification by incorporating enhanced electrochemical and mass balance equations based on thermo-hygro physics with strong coupling of mass transport and equilibrium in micro-pore structure of carbonated concrete for which the previous research data is limited. In this paper the carbonation induced electrochemical corrosion model is developed and coupled with carbon dioxide transport computational model by the use of a concrete durability computer based model DuCOM developed by our research group at concrete laboratory in the University of Tokyo and its reliability is checked in the light of experiment results of carbonation induced corrosion mass loss obtained in this research. The comparison of model analysis and experiment results shows a fair agreement. The carbonation induced corrosion model computation reasonably predicts the quantitative behavior of corrosion rate for normal air dry relative humidity conditions. The computational model developed also shows fair qualitative corrosion rate simulation and analysis for various pH levels and coupled environmental actions of chloride and carbonation. Detailed verification of the model for the quantitative carbonation induced corrosion rate computation under varying relative conditions, different pH levels and combined effects of carbonation and chloride attack remain as scope for future research.

• Journal of the Korean institute of surface engineering
• /
• v.30 no.4
• /
• pp.239-247
• /
• 1997

The electrochemical machining of carbon steel was carried in various electrolytes which contain NACl and $NaCIO_3$. Though electrolyte containg NaCl yields fast machining rate, dimensional control is rather difficult. In the case of electrolyte with $NaCIO_3$, dimensional control of anode shape can be obtained through modification of cathode design. Mathematical modeling is also performed for these systems and agreements are good compared with experimental date. The constant gap experiment butween two electrode yielded faster machining rate than constant cathode moving rate experiment.

• Journal of Electrochemical Science and Technology
• /
• v.10 no.4
• /
• pp.408-415
• /
• 2019

Electroplating is a widely used surface treatment method in the manufacturing process of electronic parts and uniformity of the electrodeposition thickness is very crucial for these applications. Since many variables including fluid flow influence the uniformity of the film, it is difficult to conduct efficient research only by experiments. So many studies using simulation have been carried out. However, the most popular simulation technique, which calculates secondary current distribution, has a limitation on the considering the effects of fluid flow on the deposition behavior. And modified method, which is calculating a tertiary current distribution, is limited to a two-dimensional study of simple shapes because of the massive computational load. In the present study, we propose a new electroplating simulation method that can be applied to complex shapes considering the effect of flow. This new model calculates the electroplating process with three steps. First, the thickness of boundary layers on the surface of the cathode plane and velocity magnitudes at the positions are calculated from the simulation of fluid flow. Next, polarization curves of different velocities are obtained by calculations or experiments. Finally, both results are incorporated into the electroplating simulation program as boundary conditions at the cathode plane. The results of the model showed good agreements with the experimental results, and the effects of fluid flow of electrolytes on the uniformity of deposition thickness was quantitatively predicted.