• 공업화학
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• 제9권1호
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• pp.107-114
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• 1998

40, 50, 60, 70, $80^{\circ}C$에서 20wt%와 30wt%의 AMP 수용액에 대한 $CO_2$의 용해도를 실험을 통해서 구하였다. Kent-Eisenberg 모델을 변형하여 주어진 온도범위에서 30wt% AMP 수용액에 대한 실험값의 회귀분석을 통해 평형상수값과 상관관계식을 구하였으며, 계산된 평형상수값과 모델을 통해서 20wt% AMP 수용액에 대한 $CO_2$의 용해도를 예측한 결과는 실험값과 잘 일치함을 보였다. 본 연구에서 구한 평형상수의 상관관계식을 이용하여 문헌에 제시된 조건에서의 용해도를 예측한 값과 대단히 엄밀한 모델로 알려진 Deshmukh-Mather의 모델에 의한 예측값을 비교했을 때, 두 값은 거의 일치하였다. 그러므로, 제시한 상관관계식과 변형된 Kent-Eisenberg모델은 AMP수용액에 대한 $CO_2$의 흡수평형을 정확하게 나타낸다고 볼 수 있다. 액상의 각 물질의 농도를 평형모델을 이용하여 계산하였으며, AMP의 우수한 흡수능은 steric hindrance 효과에 의한 불안정한 carbamate의 형성에서 기인함을 확인하였다. AMP에 대한 $CO_2$의 용해도 자료로부터, Gibbs-Helmholtz 식을 이용하여 ${\Delta}Hs$의 값을 구하였다.

• 한국환경과학회지
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• 제7권6호
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• pp.773-782
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• 1998

The adsorption experiment of phenol(Ph) from aqueous solution on granular activated carbon was studied in order to design the fixed-bed adsorption column. The experimental data were analyzed by unsteady-state, one-dimensional heterogeneous model. Finite element method(FEM) was applied to analyze the sensitivity of parameter and to predict the fixed-bed adsorption column performance on operation variable changes. The prediction model showed similar effect to mass transfer and intraparticle diffusion coefficient changes suggesting that both parameter present mass transfer rate limits for GAC-phenol system. The Freundlich constants had a greater effect than kinetic parameters for the performance of fixed-bed adsorption column. FEM solution facilitated prediction of concentration history in solution and within adsorbent particle.

• 대한화장품학회지
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• 제12권1호
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• pp.17-33
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• 1986

The interfacial Properties of ferrosoferric oxide suspended in aqueous KNO3 solution are investigated by studying the zeta potentials and surface charge densities at $25^{\circ}C$. The zeta potentials are obtained by measuring the electrophoretic mobility and the surface charge densities by potentiometric titrations in the aqueous KNO3 solutions of different concentrations from 10-3 to 10-1M. The data are interpreted by the surface dissociation and complexation model of Davis, et als. and the modified model.

• Advances in environmental research
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• 제5권4호
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• pp.225-235
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• 2016

Synthesized hydroxyapatite (Hyd) and Fe-hydroxyapatite (Fe-Hyd) composite were used for the removal of Methylene Blue (MB) from aqueous solutions in this study. The effect of adsorbent amount, pH and initial MB concentration were carried out to investigate in the aqueous solution. The kinetic study shows that the MB adsorption process with Hyd or Fe-Hyd follow pseudo-second order kinetic model. Experimental results are well fitted to the Langmuir isotherm model. The maximum adsorption capacities of Hyd and Fe-Hyd were obtained as 2.90 mg/g and 5.64 mg/g for MB according to Langmuir Isotherm models, respectively. Fe-Hyd composite increased the adsorption capacity of Hyd by 1.95 times that Hyd. It is concluded that Fe-Hyd composite is promising and economical adsorbent for MB removal in the aqueous solution.

• Bulletin of the Korean Chemical Society
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• 제33권8호
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• pp.2669-2674
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• 2012

Crown ether is one of well-known host molecules and able to selectively sequester metal cation. We employed M06-2X density functional theory with IEFPCM and SMD continuum solvation models to study selectivity of dibenzo-18-crown-6-ether (DB18C6) for alkaline earth dications, $Ba^{2+}$, $Sr^{2+}$, $Ca^{2+}$, and $Mg^{2+}$ in the gas phase and in aqueous solution. $Mg^{2+}$ showed predominantly strong binding affinity in the gas phase because of strong polarization of CO bonds by cation. In aqueous solution, binding free energy differences became smaller among these dications. However, $Mg^{2+}$ had the best binding, being incompatible with experimental observations in aqueous solution. The enthalpies of the dication exchange reaction between DB18C6 and water cluster molecules were computed as another estimation of selectivity in aqueous solution. These results also demonstrated that $Mg^{2+}$ bound to DB18C6 better than $Ba^{2+}$. We speculated that the species determining selectivity in water could be 2:1 complexes of two DB18C6s and one dication.

• Environmental Engineering Research
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• 제14권1호
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• pp.26-31
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• 2009

Sorption of $Ni^{2+}$ in aqueous solution was studied using montmorillonite. The experimental and equilibrium data fitted well to the Langmuir isotherm model. From the kinetics data for nickel sorption onto montmorillonite, the diffusion of $Ni^{2+}$ inside the clay particles was the dorminant step controlling the sorption rate and as such more important for $Ni^{2+}$ sorption than the external mass transfer. $Ni^{2+}$ was sorbed due to strong interactions with the active sites of the sorbent and the sorption process tends to follow the pseudo second-order kinetics. Thermodynamic parameters (${\Delta}G^{\circ},\;{\Delta}H^{\circ},\;{\Delta}S^{\circ}$) indicated a non spontaneous and endothermic adsorption process while the positive low value of the entropy change suggests low randomness of the solid/solution interface during the uptake of $Ni^{2+}$ by montmorilionite. Heavy metals such as $Ni^{2+}$ in aqueous bodies can effectively be sorbed by montmorillonite.

• 한국환경과학회지
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• 제26권5호
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• pp.609-619
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• 2017

The removal characteristics of 2,4-dinitrophenol (2,4-DNP) from an aqueous solution by commercial Wood-based Activated Carbon (WAC) have been studied. The effects of various experimental parameters were investigated using a batch adsorption technique. The adsorption capacity of 2,4-DNP by WAC increased with a decrease in the dosage and particle size of WAC, temperature and the initial pH of the solution, and increased with an increase in the initial concentration of the solution. The adsorption equilibrium data were best described by the Redlich-Peterson isotherm model. The maximum adsorption capacities of 2,4-DNP by WAC were 573.07 mg/g at 293 K, 500.00 mg/g at 313 K, and 476.19 mg/g at 333 K, decreasing with increasing temperature. The kinetic data were well fitted to the pseudo-second-order model, and the results of the intra-particle diffusion model suggested that the adsorption process was mainly controlled by particle diffusion. The thermodynamic analysis indicated that the adsorption of 2,4-DNP by WAC was an endothermic and spontaneous process.

• Nuclear Engineering and Technology
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• 제52권11호
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• pp.2543-2551
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• 2020

Calculations of chemical equilibrium for multicomponent aqueous systems of the HyBRID dissolution of magnetite were performed by using the HSC Chemistry. They were done by using a Pitzer-based aqueous solution model with the recipe of raw materials in experiments conducted at KAERI. The change in the amounts of species and ions and the pH values of the solution at equilibrium was observed as functions of temperature and raw amount of CuSO₄. Precipitation of Cu₂O occurred at a large amount of CuSO₄ added to the solution, while no precipitation of Cu(OH)₂ was found at any amounts of CuSO₄. The E-pH diagrams for Cu were constructed at various Cu concentrations to provide the effect of the Cu concentration on the pH values at boundaries where the coexistence of Cu⁺ ion and Cu₂O solid occurred. To prevent Cu⁺ ions from being precipitated to Cu₂O, the raw amount of CuSO₄ should be adjusted so that the pH value of the solution from the equilibrium calculation is less than that from the E-pH diagram. We provided guidelines for the raw amount of CuSO₄ and the pH value of the solution, which prevent the formation of Cu₂O precipitates in the HyBRID dissolution experiments for magnetite.

• 자원환경지질
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• 제55권4호
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• pp.367-376
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• 2022

본 연구에서는 바이오폴리머의 일종인 베타글루칸을 구연산과 교차결합하여 수용액 내에서 불용성인 흡착제(crosslinked β-glucan, CBG)롤 제조하였으며, FTIR과 SEM-EDX를 이용하여 CBG의 특성평가와 납과 구리 흡착특성을 파악하기 위한 pH에 따른 흡착량 변화, 흡착속도, 등온흡착 실험을 진행하였다. 특성평가 결과, 베타글루칸과 구연산의 교차결합 메커니즘을 파악하였으며, CBG 표면에서의 납과 구리 흡착을 확인하였다. 수용액 pH에 의한 흡착량 변화 실험에서는 pH 6에서 가장 높은 납과 구리 흡착량을 보였으며, pH 3이하에서는 급격한 감소를 보였다. 또한 흡착속도 실험 결과 CBG에 의한 납과 구리 흡착은 유사 2차 반응속도식과 내부확산식을 따르는 것을 확인하였고, 등온흡착 실험에서는 Langmuir식을 따라 납과 구리 최대흡착량이 각각 59.70, 23.44 mg/g임을 확인하였다. 본 연구에서는 구연산을 이용하여 베타글루칸을 수용액 내 흡착제로 이용하는 방법을 제시하고자 하였으며, 연구결과에 따라 CBG는향후 친환경적인 중금속 흡착제로서의 적용이 가능할 것으로 판단된다.

• 방사성폐기물학회지
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• 제19권2호
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• pp.187-196
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• 2021

Chemical equilibrium calculations for multicomponent aqueous systems involving the reductive dissolution of magnetite (Fe₃O₄) with oxalic acid (H₂C₂O₄) were performed using the HSC Chemistry® version 9. They were conducted with an aqueous solution model based on the Pitzer's approach of one molality aqueous solution. The change in the amounts and activity coefficients of species and ions involved in the reactions as well as the solution pH at equilibrium was calculated while changing the amounts of raw materials (Fe₃O₄ and H₂C₂O₄) and the system temperature from 25℃ to 125℃. In particular, the conditions under which Fe₃O₄ is completely dissolved at high temperatures were determined by varying the raw amount of H₂C₂O₄ and the temperature for a given raw amount of Fe₃O₄ fed into the aqueous solution. When the raw amount of H₂C₂O₄ added was small for a given raw amount of Fe₃O₄, no undissolved Fe₃O₄ was present in the solution and the pH of the solution increased significantly. The formation of ferrous oxalate complex (FeC₂O₄) was observed. The equilibrium amount of FeC₂O₄ decreased as the raw amount of H₂C₂O₄ increased.