• 제목/요약/키워드: Thermodynamic Equilibrium

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Simulink를 이용한 고분자 전해질 연료전지 시스템 시뮬레이션 (Polymer Electrolyte Fuel Cell Simulation Using Simulink)

  • 황남선;이호준;주병수
    • 한국신재생에너지학회:학술대회논문집
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    • 한국신재생에너지학회 2007년도 춘계학술대회
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    • pp.109-112
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    • 2007
  • In this paper, a mathematical modeling was developed to simulate 1kW class air cooled Polymer Electrolyte Membrane Fuel Cell(PEMFC) system. The proposed modeling was conducted under SIMULINK based environment. The model ing was developed based on the thermodynamic and chemical equilibrium. The objective is to design and implement the entire fuel cell system model ing including the system controller modeling. The fuel cell process and the control system modeling should have to be connected with each other simultaneously, therefore the two types of modeling influences each other when the system simulator run. The fuel cell modeling libraries are simulated using the SIMULINK under the thermodynamic and chemical equilibrium base. The PID controller application was designed and developed to test the process modeling and verify it. This the prototype development of the fuel cell system to design and test more complicate fuel cell systems, like the residential power generation system. The simulation results was compared to the real PEMFC system performance. We have achieved the reasonable accordance with the Lab test and the simulation results.

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고합금 공구강의 최적 오스테나이트 처리 온도 결정 (Determination of Optimal Austenitizing Temperature in High-Alloyed Tool Steels)

  • 박동성;전중환;이민하;이석재
    • 열처리공학회지
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    • 제30권4호
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    • pp.156-163
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    • 2017
  • In the present study, we investigated the optimal austenitizing temperature of high-alloyed tool steels from an industrial point of view. Austenitizing temperatures for manufacturing 25 commercial tool steels were surveyed with their alloy compositions. The relationship between the austenitizing temperatures and the critical equilibrium temperatures by thermodynamic-based calculation was analyzed and a correlation was found. Based on the austenitizing temperatures of 25 commercial tool steels and the thermodynamic calculation results, we proposed a simple equation to predict an optimal austenitizing temperature to achieve superior mechanical properties of high-alloyed tool steels. The applicability of the proposed equation was experimentally validated with a new developed tool steel.

Kinetics and Thermodynamic Properties Related to the Adsorption of Copper and Zinc onto Zeolite Synthesized from Coal Fly Ash

  • Lee, Chang-Han;Ambrosia, Matthew Stanley
    • 한국환경과학회지
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    • 제22권10호
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    • pp.1327-1335
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    • 2013
  • Na-A zeolite (Z-Cl) was synthesized from coal fly ash, which is a byproduct of coal combustion for the generation of electricity. The adsorption of $Cu^{2+}$ and $Zn^{2+}ions$ onto Z-C1 was investigated via batch tests over a range of temperatures (303.15 to 323.15 K). The resultant experimental equilibrium data were compared to theoretical values calculated using model equations. With these results, the kinetics and equilibrium parameters of adsorption were calculated using Lagergren and Langmuir-Freundlich models. The adsorption kinetics revealed that the pseudo second-order kinetic mechanism is predominant. The maximum adsorption capacity ($q_{max}$) values were 139.0-197.9 mg $Zn^{2+}$/g and 75.0-105.1 mg $Cu^{2+}/g$. Calculation of the thermodynamic properties revealed that the absorption reactions for both $Cu^{2+}$ and $Zn^{2+}$ were spontaneous and endothermic. Collectively, these results suggest that the synthesized zeolite, Z-C1, can potentially be used as an adsorbent for metal ion recovery during the treatment of industrial wastewater at high temperatures.

활성탄에 의한 말라카이트 그린 흡착 특성에 관한 기초연구 (Fundamental Studies for the Adsorption Features of Malachite Green on Granular Activated Carbon)

  • 백미화;최영진;김영지;김동수
    • 한국물환경학회지
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    • 제25권3호
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    • pp.459-463
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    • 2009
  • The adsorption features of malachite green onto activated carbon have been investigated for its treatment from aqueous solution. The influential factors were examined the initial concentration of malachite green, reaction temperature, and pH. Under experimental conditions, adsorption equilibrium of malachite green was attained within 2 hr after the adsorption started. The adsorption reaction of malachite green followed the pseudo-second order rate model, and the adsorption rate constants(k2) decreased with increasing initial concentrations of malachite green. Adsorption behavior of malachite green on activated carbon was found to follow the Freundlich model well in the initial adsorbate concentration range. With increase in temperature, the adsorbed amount of malachite green at equilibrium increased, which indicate that the adsorption reaction was endothermic reaction. Thermodynamic parameters for malachite green adsorption reaction were estimated at varying temperatures, and in the pH range of 2-10, adsorption of malachite green increased.

종이내 수분확산 (제3보) -종이 표면의 수증기-흡습성에 관한 이론적 고찰- (Molecular Diffusion of Water in Paper(III) -Theoretical analysis on vapor sorption properties of fiber surface -)

  • 윤성훈;전양;박종문
    • 펄프종이기술
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    • 제31권1호
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    • pp.61-71
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    • 1999
  • The study aimed at the theoretical analysis of vapor sorption properties of, pp.rmaking fibers. Water vapor affinity and sorption thermodynamic properties of fiber constituents were evaluated based on Henry's law and Hildebrand's solubility theory. Theoretical equilibrium moisture content(ThEMC) on fiber surface was estimated using functional group contribution. Crystallinity of cellulose in fiber significantly controlled the water vapor solubility. Comparisons of the measured equilibrium moisture content data and the estimated ThEMC data coincidently suggested the fact that crystallinity of cellulose in fibers was around 60% to 70%. Carbohydrates constituents including amorphous cellulose and hemicellulose in fibers showed higher vapor solubility than lignin molecules. High correlation existed between ThEMC and vapor solubility as well as between ThEMC and solubility parameter. In the thermodynamic analysis on water-vapor sorption process in fibers, the sorption enthalpy increased as RH increased, whereas sorption entropy and free energy decreased with increasing RH.

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$NH_3-AlCl_3-H_2$ 기상반응계의 열역학적 평형조성 및 고순도 AIN 합성 (Thermodynamic Equilibrium Compositions for a $NH_3-AlCl_3-H_2$ Vapor-Phase Reacting System and Synthesis of High-Purity AlN)

  • 현상훈;김준학
    • 한국세라믹학회지
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    • 제23권1호
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    • pp.33-43
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    • 1986
  • The synthesis of high-purity AlN by a vapor-phase reaction was investigated using the $NH_3-AlCl_3-H_2$ reacting system. The theoretical yields of AlN were determined from th thermodynamic equilibrium composi-tions. It was shown that the yields above 90% could by obtained even in the range of relatively low temper-ature of 600-1200K. The reaction temperature and the initial amounts/ratios of the reacting gases showed significant effects on the yields but the total pressure did not. The experimental results showed that a high-purity AlN having a needle shape was the only product as a solid phase and its amount produced increased with the reaction temperature. While the degree of agglmera-tion of the synthesized AlN increased with the reaction temperature the size of each particle consisting of the agglomerates was independent of the temperature but grew from 0.09 to 0.115${\mu}{\textrm}{m}$ with the flow rate of NH3. These experimental results were compared with the theoretical aspects for the synthesis of a high-purity AlN.

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Hydrogen Production Using Membrane Reactors

  • Giuseppe Barbieri;Paola Bernardo;Enrico Drioli;Lee, Dong-Wook;Sea, Bong-Kuk;Lee, Kew-Ho
    • Korean Membrane Journal
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    • 제5권1호
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    • pp.68-74
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    • 2003
  • Methane steam reforming (MSR) reaction for hydrogen production was studied in a membrane reactor (MR) using two tubular membranes, one Pd-based and one of porous alumina. A higher methane conversion than the thermodynamic equilibrium for a traditional reactor (TR) was achieved using MRs. The experimental temperature range was 350-500$^{\circ}C$; no sweep-gas was employed during reaction tests to avoid its back-permeation through the membrane and the steam/methane molar feed ratio (m) varied in the range 3.5-5.9. The best results (the difference between the MR conversion and the thermodynamic equilibrium was of about 7%) were achieved with the alumina membrane, working with the highest steam/methane ratio and at 450$^{\circ}C$. Silica membranes prepared at KRICT laboratories were characterized with permeation tests on single gases (N$_2$, H$_2$ and CH$_4$). These membranes are suited for H$_2$ separation at high temperature.

Moisture Sorption and Thermodynamic Properties of Vacuum-Dried Capsosiphon fulvescens Powder

  • Zuo, Li;Rhim, Jong-Whan;Lee, Jun Ho
    • Preventive Nutrition and Food Science
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    • 제20권3호
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    • pp.215-220
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    • 2015
  • The moisture sorption isotherms of vacuum-dried edible green alga (Capsosiphon fulvescens) powders were determined at 25, 35, and $45^{\circ}C$ and water activity ($a_w$) in the range of 0.11~0.94. An inversion effect of temperature was found at high water activity (>0.75). Various mathematical models were fitted to the experimental data, and Brunauer, Emmett, and Teller model was found to be the most suitable model describing the relationship between equilibrium moisture content and water activity (<0.45). Henderson model could also provide excellent agreement between the experimental and predicted values despite of the intersection point. Net isosteric heat of adsorption decreased from 15.77 to 9.08 kJ/mol with an increase in equilibrium moisture content from 0.055 to $0.090kg\;H_2O/kg$ solids. The isokinetic temperature ($T_{\beta}$) was 434.79 K, at which all the adsorption reactions took place at the same rate. The enthalpy-entropy compensation suggested that the mechanism of the adsorption process was shown to be enthalpy-driven.

The Study on the Physicochemical Properties of Fluid under High Pressure (1). Effects of Pressure and Temperature on the Pentamethyl Benzene-Iodine Charge Transfer Complex in n-HexaneⅠ

  • Kim, Jeong-Rim;Kwun, Oh-Cheun
    • Bulletin of the Korean Chemical Society
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    • 제6권2호
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    • pp.74-79
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    • 1985
  • The stabilities of the charge transfer complexes of pentamethyl benzene with iodine in n-hexane have been investigated by UV-spectrophotometric measurements at 25, 40 and 60$^{\circ}C$ up to 1600 bars. The equilibrium constant of the complex formation was increased with pressure while being decreased with temperature raising. Changes of volume, enthalpy, free energy and entropy for the formation of the complexes were obtained from the equilibrium constants. The red-shift at higher pressure, the blue-shift at higher temperature, and the relation between pressure and oscillator strength have been discussed by means of thermodynamic functions. In comparison with the results in the previous studies, the absolute values of ${\Delta}$V at each temperature were increased with the number of methyl groups of polymethyl benzene. However, it can be seen that both ${\Delta}$H and ${\Delta}$S show extreme behaviors in durene near atmospheric pressure but they are negatively increased with the number of methyl groups near 1600 bar. This order of the thermodynamic parameters may be a measure of the relative basicities of polymethyl benzenes toward iodine under each pressure, and these phenomena are explained in terms of a positive inductive effect and a steric hindrance effect of the polymethyl benzene molecule.

Phosphate sorption to quintinite in aqueous solutions: Kinetic, thermodynamic and equilibrium analyses

  • Kim, Jae-Hyun;Park, Jeong-Ann;Kang, Jin-Kyu;Kim, Song-Bae;Lee, Chang-Gu;Lee, Sang-Hyup;Choi, Jae-Woo
    • Environmental Engineering Research
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    • 제20권1호
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    • pp.73-78
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    • 2015
  • The aim of this study was to examine the phosphate (P) removal by quintinite from aqueous solutions. Batch experiments were performed to examine the effects of reaction time, temperature, initial phosphate concentration, initial solution pH and stream water on the phosphate adsorption to quintinite. Kinetic, thermodynamic and equilibrium isotherm models were used to analyze the experimental data. Results showed that the maximum P adsorption capacity was 4.77 mgP/g under given conditions (initial P concentration = 2-20 mgP/L; adsorbent dose = 1.2 g/L; reaction time = 4 hr). Kinetic model analysis showed that the pseudo second-order model was the most suitable for describing the kinetic data. Thermodynamic analysis indicated that phosphate sorption to quintinite increased with increasing temperature from 15 to $45^{\circ}C$, indicating the spontaneous and endothermic nature of sorption process (${\Delta}H^0=487.08\;kJ/mol$; ${\Delta}S^0=1,696.12\;J/(K{\cdot}mol)$; ${\Delta}G^0=-1.67$ to -52.56 kJ/mol). Equilibrium isotherm analysis demonstrated that both Freundlich and Redlich-Peterson models were suitable for describing the equilibrium data. In the pH experiments, the phosphate adsorption to quintinite was not varied at pH 3.0-7.1 (1.50-1.55 mgP/g) but decreased considerably at a highly alkaline solution (0.70 mgP/g at pH 11.0). Results also indicated that under given conditions (initial P concentration=2 mgP/L; adsorbent dose=0.8 g/L; reaction time=4 hr), phosphate removal in the stream water (1.88 mgP/g) was lower than that in the synthetic solution (2.07 mgP/g), possibly due to the presence of anions such as (bi)carbonate and sulfate in the stream water.