• Proceedings of the Korean Society of Propulsion Engineers Conference
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• 2008.03a
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• pp.448-451
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• 2008

Three methods of nozzle flow analysis, frozen-equilibrium, shifting-equilibrium and non-equilibrium approaches, were used to rocket nozzle flow, those were coupled with the methods of computational fluid dynamics code. For a design of high temperature rocket nozzle, chemical equilibrium analysis which shares the same numerical characteristics with frozen flow analysis can be an efficient design tool for predicting maximum thermodynamic performance of the nozzle. Frozen fluid analysis presents the minimum performance of the nozzle because of no consideration for the energy recovery. On the other hand, the case of chemical-equilibrium analysis is able to forecast the maximum performance of the nozzle due to consideration for the energy recovery that is produced for the fast reaction velocity compared with velocity of moving fluid. In this study, using the chemical equilibrium flow analysis code that is combined the modified frozen-equilibrium and the chemical-equilibrium. In order to understand the thermochemical characteristic components and the accompanying energy recovery, shifting-equilibrium flow analysis was carried out for the 30 $ton_f$-class KARI liquid rocket engine nozzle together with frozen flow. The performance evaluation based on the 30 $ton_f$-class KARI LRE nozzle flow analyses will provide an understanding of the thermochemical process in the nozzle and performances of nozzle.

• Journal of the Korean Chemical Society
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• v.33 no.5
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• pp.496-503
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• 1989

The chemical behavior of trivalent lanthanide (Pr(III) and Yb(III)) and 2, 2, 6, 6-tetramethyl-3, 5-heptanedione(dipivaloylmethane) complexes was investigated by the use of direct current, differential pulse polarography and cyclic voltammetry. In this study, it was founded that the reduction of trivalent lanthanide complexes was observed by one electron transfer process at Epc = -0. 13 V and -0.80 V of Pr(III), and -0.02 V of Yb(III) vs. Ag-AgCl electrode. Also, it was founded that the treatment of DP and CV to the case of a first-order chemical equilibrium reaction preceding a reversible and irreversible one electron transfer reaction, (a >0. 5) the socalled ErCr electrode process. The equilibrium constant (lnK) obtained, of various solvents, these constant were founded to be increases with decreasing dielectric constant of the solvents. Plots of lnK for these reaction against ln(l/D) for the solvents was fairly straight lines, and the behavior of the heavier lanthanides was decreased equilibrium constant with increasing atomic number.

• Polymer(Korea)
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• v.29 no.3
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• pp.304-307
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• 2005

The acid-catalyzed hydrolysis reaction of poly(vinyl acetate) (PVAc) in water/acetic acid solution at $35^{circ}C$ was studied at two different solvent compositions. The mole fractions of vinyl acetate (Vac) and vinyl alcohol (VA) during the course of the reaction were determined by NMR, and the equilibrium constant $K_{eq}$ of the reaction was determined using the molar ratio of VAc to VA at the chemical equilibrium. $K_{eq}$ was 0.75 (${\pm}0.01$) when the VAc mole faction at the equilibrium was 0.78 (${\pm}0.01$) and it was 0.69 (${\pm}0.01$) when the VAc mole fraction was 0.57 (${\pm}$0.02). The reaction was found to be a pseudo 1-st order reaction with the rate coefficient at $3.4{\times}10^{-6}/sec$.

• Journal of Environmental Science International
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• v.21 no.5
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• pp.555-562
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• 2012

The experimental determination of equilibrium constants is required to estimate concentrations of reagents and/or products in environmental chemical reactions. For an example, the choice of copper (Cu) complexation reactions was motivated by their fast kinetics and the ease of measurement of Cu by an ion-sensitive electrode. Each individual titrant of sulfate ($SO{_4}^{2-}$) and oxalate ($C_2O{_4}^{2-}$) was expected to have its own unique characteristics, depending on the bonding in Culigands connected to the aqueous species. The complexation reaction of Cu with $SO{_4}^{2-}$ somewhat fast reached equilibrium status compared with $C_2O{_4}^{2-}$. The experimental equilibrium constants ($K_{eq}$) of copper sulfate ($CuSO_4$) and copper oxalate ($CuC_2O_4$) were determined $10^{2.2}$ and $10^{3{\sim}4.3}$, respectively.

• Particle and aerosol research
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• v.11 no.3
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• pp.77-85
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• 2015

A Belousov-Zhabotinsky reaction in a liquid-liquid system under microwave radiation was observed under non-stirring conditions. To control this non-equilibrium reaction, nano-particle, which is active under microwave irradiation, was added to the solution. Color changes of the solution during the oscillatory reaction were found to be influenced by the irradiation power although the droplet temperature was equal to the temperature of surrounding oil. During the irradiation, the period of oscillation became shorter because the reaction rate was faster. It could also be observed that there is possibility to eliminate oscillatory behaviors of the reaction using higher power of microwave. The possibility of controlling non-linear reaction using microwave was shown since microwave can easily travel through oil phase and reach water phase.

• International Journal of Aeronautical and Space Sciences
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• v.17 no.4
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• pp.455-466
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• 2016

Chemical-kinetic parameters of the equilibrium constants to evaluate the reverse rate coefficients in the shock layer of a blunt body and the expanding flows are derived for the temperature range from 300 K to 20,000 K. The expanded equilibrium constants for the chemical reactions of the dissociation, ionization, associative ionization, and neutral and charge exchange reactions of the atmospheric species and carbon materials are proposed in the present work. In evaluating the equilibrium constants, the inter-nuclear potential energies of the molecular species are calculated by the analytical potential function of the Hulburt-Hirschfelder model, and the parameters of the analytical model are determined from the semi-classically calculated RKR potentials. The electronic states and energies of the atoms are calculated by the electronic energy grouping model, and the rovibrational states and energies of each electronic states of the molecules are evaluated by the WKB method. The expanded equilibrium constants for 31 types of the reactions are provided for the best curve-fit functions, and the recombination reaction rate coefficients evaluated from the present equilibrium constants are compared with existing measured values.

• 한국전산유체공학회:학술대회논문집
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• 2004.03a
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• pp.146-153
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• 2004

The Numerical study has been carried out to investigate the effects of chemical reaction and thermal radiation on the rocket plume flow-field at various altitudes. The theoretical formulation is based on the Navier-Stokes equations for compressible flows along with the infinitely fast chemistry and thermal radiation. The governing equations were solved by a finite volume fully-implicit TVD(Total Variation Diminishing) code which uses Roe's approximate Riemann solver and MUSCL(Monotone Upstream-centered Schemes for Conservation Laws) scheme. LU-SGS (Lower Upper Symmetric Gauss Seidel) method is used for the implicit solution strategy. An equilibrium chemistry module for hydrocarbon mixture with detailed thermo-chemical properties and a thermal radiation module for optically thin media were incorporated with the fluid dynamics code. In this study, kerosene-fueled rocket was assumed operating at O/F ratio of 2.34 with a nozzle expansion ratio of 6.14. Flight conditions considered were Mach number zero at ground level, Mach number 1.16 at altitude 5.06km and Mach number 2.9 at altitude 17.34km. Numerical results gave the understandings on the detailed plume structures at different altitude conditions. The diffusive effect of the thermal radiation on temperature field and the effect of chemical recombination during the expansion process could be also understood. By comparing the results from frozen flow and infinitely fast chemistry assumptions, the excess temperature of the exhaust gas resulting from the chemical recombination seems to be significant and cannot be neglected in the view point of performance, thermal protection and flow physics.

• Journal of the Korean Chemical Society
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• v.13 no.4
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• pp.249-261
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• 1969

Studies of photochemical reactions of the pure oxygen atmosphere are made using reaction rate constants and atmospheric data available in the latest literature. The daytime and nighttime variations in atomic oxygen and ozone are computed, based on three different conditions: 1) photochemical equilibrium, 2) direct integrations of the rate equations with modifications and approximation to the equations, and 3) by numerical integrations. The departure from the photochemical equilibrium concentrations during day and nighttime are discussed by comparing the results obtaind from the three conditions.

• Journal of the Korean Chemical Society
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• v.17 no.6
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• pp.450-454
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• 1973

The afterpolymerization and depolymerization of poly-${\varepsilon}$-caproamide in solid state have been studied under two different reaction conditions, nitrogen flow and sealed state. The degree of polymerization ($\bar{P}$) of nylon 6 increased with the increase in reaction time and temperature, and then reacted finally an equilibrium. In the presence of oxygen, $\bar{P}$ decreased by increasing the reaction time due to the oxidation reaction. Under certain reaction condition, the change of $\bar{P}$ for different initial degree of polymerization ($\bar{P}_0$) tendered toward unity in equilibrium.

• Bulletin of the Korean Chemical Society
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• v.8 no.3
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• pp.168-170
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• 1987

The reaction between 1-benzyl-3-carbamoyl-1,4-dihydropyridine (BNAH) 1 and various 1-arylpyridinium salts 2, and the reaction between 1-(4-methylphenyl)-1,4-dihydropyridine 4b and 1-aryl-3-carbamoylpyridinium (1-arylnicotinamide) salts 5 were carried out. The extents of reaction in equilibrium were estimated by nmr integration data. The equilibrium constants for the reactions, K, and the standard Gibbs free energy changes for the reduction of the pyridinium salts to the corresponding 1,4-dihydropyridines ${\Delta}G^{\circ}'$ were evaluated. The Hammett plot of log K for the reaction between 1 and 2, and ${\Delta}G^{\circ}'$ against ${\sigma}_p$ of the substituents in 1-aryl moiety shows linear correlation with the reaction constant ${\rho}$ of 9.4 (for log K vs ${\sigma}_p$) and -54.5 KJ/mole (for ${\Delta}G^{\circ}'$ vs ${\sigma}_p$). It was found that 1-aryl-1,4-dihydropyridines have much higher reducing power than the corresponding 1-aryl-1,4-dihydronicotinamides, and the power is affected greatly by the electron-withdrawing ability of the substituents in aryl group. The reactions were utilized for preparation of 1,4-dihydropyridines bearing highly electron-withdrawing groups such as 4-nitrophenyl and 2,4-dinitrophenyl, which could not be obtained by conventional dithionite reduction of the corresponding pyridinium salts due to the base-labile nature of the salts.