• Title/Summary/Keyword: Electrochemical Simulation

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Concept, Manufacture and Results of the Microtubular Solid Oxide Fuel Cell

  • Sammes, Nigel;Galloway, Kevin;Yamaguchi, Toshiaki;Serincan, Mustafa
    • Transactions on Electrical and Electronic Materials
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    • v.12 no.1
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    • pp.1-6
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    • 2011
  • This paper summarized concept, manufacture and results of the micro-tubular solid oxide fuel cells (SOFCs). The cells were fabricated by co-sintering of extruded micro-tubular anode support and electrolyte coating layer, and then additional cathode coating. The cells showed quick voltage rising within 1 minute, and the electrochemical performances were closely related to the balance of fuel utilization and performance loss. And a thermal-fluid simulation model was also reported in combination with the electrochemical evaluation results on the GDC-based micro-tubular SOFCs.

Voltammetric Studies of Guanine and Its Derivatives by (TEX)$Ru(bpy)^{2+/3+}$(/TEX) Mediator on Indium Tin Oxide Electrode

  • Kim, Jin Hyeong
    • Bulletin of the Korean Chemical Society
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    • v.21 no.7
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    • pp.709-711
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    • 2000
  • Oxidizing metal complex mediates the electrochemical oxidation of guanine nucleotides. This catalysis results in an enhancement in cyclic voltammograms that yield the rate constant for the oxidation of guanine by the metal complex via digital simulation. The rate constant of oxidation of guanine by Ru(bpy)3(3+) is 6.4 x 10(5)M(-1)s(-l). The rate constant and the enhanced current depend on the number of phosphate groups on the sugar of nucleotidc. Also the modified guanine bases show different oxidation rate constants following the trend guanine-5'- monophosphatc (GMP) > 8-bromo-guanine-5'-monophosphate (8-Br-GMP) > xanthosine -5'-monophosphate (XMP) > inosinc-5'-monophosphate (IMP). The guanine bases derivatized differently are all distinguishable from one another, providing a basis for studying electrochemistry of DNA and RNA and developing electrochemical biosensors.

Improving the Stability of Series-Connected Solid Oxide Fuel Cells by Modifying the Electrolyte Composition

  • Kim, Young Je;Lim, Hyung-Tae
    • Journal of Electrochemical Science and Technology
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    • v.12 no.1
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    • pp.159-165
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    • 2021
  • YSZ based anode supported solid oxide fuel cells (SOFCs) were prepared, and two cells with different electrolyte thicknesses were connected in series for the simulation of a cell-imbalanced fuel cell stack. Pure YSZ cells in a series connection exhibited a rapid degradation when a thick electrolyte cell was operated under a negative voltage. On the other hand, ceria added-YSZ cells in a series connection were stable under similar operating conditions, and the power density and impedance were about the same as those before tests. The improved stability was due to the reduction of internal partial pressure in the electrolyte by locally increasing the electronic conduction. Thus, we propose a new protection method, i.e., the local addition of ceria in the YSZ electrolyte, to extend the lifetime of a cell-imbalanced SOFC stack.

Design and Analysis of Spider Bionic Flow Field for Proton Exchange Membrane Fuel Cell

  • Jian Yao;Fayi Ya;Xuejian Pei
    • Journal of Electrochemical Science and Technology
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    • v.14 no.1
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    • pp.38-50
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    • 2023
  • Proton exchange membrane fuel cell (PEMFC) is a portable and clean power generation device. The structural arrangement of the flow field has a significant influence on the delivery efficiency of PEMFC. In this article, a new bionic flow channel is designed based on the inspiration of a spider shape. The branch channel width and branch corner are studied as the focus, and its simulation is carried out by the method of computational fluid dynamics (CFD). The results show that when channel width/rib width and corner of the branch are 1.5 and 130° , respectively, it is the best numerical combination and the cell comprehensive performance is excellent. The final model using this numerical combination is compared with the traditional flow channel model to verify the advancement of this scheme.

Analysis on the Formation of Li4SiO4 and Li2SiO3 through First Principle Calculations and Comparing with Experimental Data Related to Lithium Battery

  • Doh, Chil-Hoon;Veluchamy, Angathevar;Oh, Min-Wook;Han, Byung-Chan
    • Journal of Electrochemical Science and Technology
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    • v.2 no.3
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    • pp.146-151
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    • 2011
  • The formation of Li-Si-O phases, $Li_4SiO_4$ and $Li_2SiO_3$ from the starting materials SiO and $Li_2O$ are analyzed using Vienna Ab-initio Simulation (VASP) package and the total energies of Li-Si-O compounds are evaluated using Projector Augmented Wave (PAW) method and correlated the structural characteristics of the binary system SiO-$Li_2O$ with experimental data from electrochemical method. Despite $Li_2SiO_3$ becomes stable phase by virtue of lowest formation energy calculated through VASP, the experimental method shows presence of $Li_4SiO_4$ as the only product formed when SiO and $Li_2O$ reacts during slow heating to reach $550^{\circ}C$ and found no evidence for the formation of $Li_2SiO_3$. Also, higher density of $Li_4SiO_4$(2.42 g $ml^{-1}$) compared to the compositional mixture $1SiO_2-2Li_2O$ (2.226 g $ml^{-1}$) and better cycle capacity observed through experiment proves that $Li_4SiO_4$ as the most stable anode supported by better cycleabilityfor lithium ion battery remains as paradox from the point of view of VASP calculations.

Numerical Simulation of Water Transport in a Gas Diffusion Layer with Microchannels in PEMFC (마이크로채널이 적용된 고분자 전해질 연료전지 가스확산층의 물 이송에 대한 전산해석 연구)

  • Woo, Ahyoung;Cha, Dowon;Kim, Bosung;Kim, Yongchan
    • Journal of the Korean Electrochemical Society
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    • v.16 no.1
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    • pp.39-45
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    • 2013
  • The water management is one of the key issues in low operating temperature proton exchange membrane fuel cells (PEMFCs). The gas diffusion layer (GDL) allows the reactant gases flow to the reaction sites of the catalyst layer (CL). At high current density, generated water forms droplets because the normal operating temperature is $60{\sim}80^{\circ}C$. If liquid water is not evacuated properly, the pores in the GDL will be blocked and the performance will be reduced severely. In this study, the microchannel GDL was proposed to solve the flooding problem. The liquid water transport through 3-D constructed conventional GDL and microchannel GDL was analyzed varying air velocity, water velocity, and contact angle. The simulation results showed that the liquid water was evacuated rapidly through the microchannel GDL because of the lower flow resistance. Therefore, the microchannel GDL was efficient to remove liquid water in the GDL and gas channels.

Thermal Treatment Effect on Thermoelectric Characteristics of Perovskite La0.5Ca0.5MnO3 (페로브스카이트 La0.5Ca0.5MnO3 재료의 열전 특성에 미치는 열처리 효과)

  • Yang, Su-Chul
    • Journal of the Korean Electrochemical Society
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    • v.20 no.3
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    • pp.55-59
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    • 2017
  • In this study, thermoelectric characteristics of perovskite $La_{0.5}Ca_{0.5}MnO_3$ (LCMO) nanomaterials were investigated by theoretical simulation and experimental analysis. Thermoelectric power factors calculated by DFT simulation were gradually enhanced as increase in annealing temperature. Maximum power factor was obtained with high magnitude of $S^2{\sigma}=566{\mu}W/m{\cdot}K^2$ at 1100 K through a dominant improvement of Seebeck coefficient compared with electrical conductivity. Experimentally, the LCMO nanomaterials were hydrothermally synthesized and then treated by post thermal annealing with temperature variation. X-ray diffraction and SEM analysis illustrated that LCMO exhibited orthorhombic perovskite structures with small grain size of 16~19 nm over 873 K. The results directly confirmed that improvement of crystallinity and decrease of mean grain size given by post thermal annealing lead to enhancements of electrical conductivity and Seebeck coefficient, respectively.

Simulation of direct methanol fuel cells employing computational fluid dynamics (직접 메탄올 연료전지의 전산모사에 관한 연구)

  • Kim Yeong Jin;Oh In Hwan;Hong Seong An;Kim Hyeok Nyeon;Lee Tae Hui;Ha Heung Yong
    • 한국전기화학회:학술대회논문집
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    • 2002.07a
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    • pp.189-192
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    • 2002
  • An analytical study on BMFCS was carried out by employing the computational fluid dynamics(CFD) method. In this study, the commercial CFD code Fluent(ver. 5.5) was used, and many assumptions were adopted to simplify the situation in the fuel cell. From the simulation, many valuable informations were obtained in terms of distributions of velocity, pressure, temperature, density and current density over the flow field. And thus, it was anticipated that the simulation results were very helpful in developing DMFCs by facilitate optimization of structures of electrodes and flow field of the separator.

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Numerical Analysis of Molten Carbonate Fuel Cell Stack Using Computational Fluid Dynamics (CFD를 이용한 용융탄산염 연료전지 스택의 수치모사)

  • Lee, Kab-Soo;Cho, Hyun-Ho
    • Journal of the Korean Electrochemical Society
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    • v.8 no.4
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    • pp.155-161
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    • 2005
  • In this paper, commercial CFD program FLUENT v5.3 is used for simulation of MCFC stack. Besides using conservation equations included in FLUENT by default, mass change, mole fraction change and heat added or removed due to electrochemical reactions and water gas shift reaction are considered by adding several equations using user defined function. The stacks calculated are 6 and 25 kW class coflow stack which are composed of 20 and 40 unit cells respectively. Simulation results showed that pressure drop took place in the direction of gas flow, and the pressure drop of cathode side is more larger than that of anode side. And the velocity of cathode gas decreased along with the gas flow direction, but the velocity of anode gas increased because of the mass and volume changes by the chemical reactions in each electrodes. Simulated temperature profile of the stack tended to increase along with the gas flow direction and it showed similar results with the experimental data. Water gas shift reaction was endothermic at the gas inlet side but it was exothermic at the outlet side of electrode respectively. Therefore water gas shift reaction played a role in increasing temperature difference between inlet and outlet side of stack. This results suggests that the simulation of large scale commercial stacks need to consider water gas shift reaction.

Modelling of the Fuel Cell and Design of an Adaptive Controller for Steady Power (연료전지의 모델링과 정출력 적응제어기 설계)

  • Hyun, Keun-Ho;Ka, Chul-Hyun
    • Proceedings of the KIEE Conference
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    • 2006.07d
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    • pp.1962-1964
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    • 2006
  • In this paper, the dynamic models of SOFC are suggested. It consists of electrochemical model, thermal model, voltage equation and several loss equations. Control problems on tracking steady voltage by air flow is discussed and an adaptive controller is designed to withstand to the variation of stack current. Simulation is done to prove the solution of control algorithms.

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