• 제목/요약/키워드: isotherm modeling

검색결과 34건 처리시간 0.026초

Ibuprofen Racemate의 HPLC 분리실험과 FEMLAB 전산모사 연구 (Experimental and FEMLAB Simulation Study of Ibuprofen Racemate Separation in HPLC)

  • 이은;장상목;김종민;김우식;김인호
    • KSBB Journal
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    • 제21권3호
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    • pp.224-229
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    • 2006
  • 전산모사 프로그램인 FEMLAB을 이용하여 chiral center를 가지고 있는 racemate인 ibuprofen의 R-form과 S-form의 분리 전산모사 결과와 Kromasil KR100-5CHI-TBB 칼럼을 사용하여 HPLC를 통한 실험데이터를 비교 분석하였다. Hexane/t-BME/acetic acid(45:55:1 v/v%)의 이동상의 조건에서 이론단수(number of theoretical plates), 이론단높이(HETP; Height Equivalent to a Theoretical Plate)을 구하여 축방향 확산계수($Deff_i$)를 계산하였다. PIM(Pulsed Input Method)을 사용하여 분석한 결과 ibuprofen의 농도가 증가할수록 Langmuir 등온흡착식을 따르는 비선형 거동을 보였고, 각 농도에서의 체류시간($t_R$)과 phase ratio를 이용하여 비경쟁적 Langmuir 등온흡착식의 매개변수를 추산하였고, 이 매개변수를 이용하여 경쟁적 Langmuir 등온흡착식을 결정하였다. 실험을 통해 얻은 데이터를 FEMLAB 적용하여 등온흡착식의 변화에 따른 용리띠의 변화와 두 성분이 컬럼을 이동하는 동안 두 성분간 분리 과정을 관찰하였다. Ibuprofen의 농도, 유속을 변화시키면서 실험결과와 전산모사결과를 비교한 결과 실험결과와 전산모사결과가 비슷한 경향성을 보였다. 이와 같이 FEMLAB 전산모사 프로그램의 실험적용 가능성을 확인하였고. 실험과 일치하는 전산모사데이터를 얻기 위해서 고정상내의 세공에서의 물질전달을 포함하는 물질수지식의 적용과 비선형 흡착평형식에 대한 좀 더 정확한 식이 요구된다.

서태평양에 위치한 해저산들의 3-D flexure 모델링 : 무한지판 모델 (Three-dimensional Flexure Modeling by Seamount Loading in the Western Pacific: Infinite Plate Model)

  • 이태국;문재운;지상범;박정기;이기화
    • Ocean and Polar Research
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    • 제27권1호
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    • pp.35-44
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    • 2005
  • The bathymetric and gravity data were obtained in 2001 and 2003 during a survey of seamounts in the northwest of the Marshall Islands, western Pacific. The study areas are located in the Pigafetta Basin which is the oldest part of the Pacific plate and in the Ogasawara Fracture Zone which formed from the spreading ridge between the Izanagi and Pacific plates in the Jurassic. The densities of seamounts and the elastic thickness values of the lithosphere are calculated by using three-dimensional flexure modeling considering the constant sediment layer in the infinite plate model. Very low elastic thickness values (5km), relatively young seamounts, and old lithosphere in the east study area suggest the possibility of the rejuvenation of lithosphere by widespread volcanisms, whereas the elastic thickness values (15km), relatively old seamounts, and young lithosphere of the west study area are suitable for a simple cooling plate model of $300-600^{\circ}C$ isotherm. The gravity residuals of OSM6-1 and OSM6-2 suggest the possibility of different load density or elastic thickness. Relatively older OSM6-2 formed on the younger lithosphere with relatively thin elastic thickness, while younger OSM6-1 on the older lithosphere with relatively thick elastic thickness.

반응표면분석법을 이용한 석탄회로 합성한 제올라이트 X에서의 Sr 이온 제거특성 (Adsorption Characteristics of Sr Ions by Coal Fly Ash-Based-Zeolite X using Response Surface Modeling Approach)

  • 이창한;감상규;이민규
    • 한국환경과학회지
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    • 제26권6호
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    • pp.719-728
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    • 2017
  • In order to investigate the adsorption characteristics for Sr ion using the Na-X zeolite synthesized from coal fly ash, batch tests and response surface analyses were carried out. The adsorption kinetic data for Sr ions, using Na-X zeolite, fitted well with the pseudo-second-order model. The uptake of Sr ions followed the Langmuir isotherm model, with a maximum adsorption capacity of 196.46 mg/g. Thermodynamic studies were conducted at different reaction temperatures, with the results indicating that Sr ion adsorption by Na-X zeolite was an endothermic (${\Delta}H^o$>0) and spontaneous (${\Delta}G^o$<0) process. Using the response surface methodology of the Box-Behnken method, initial Sr ion concentration ($X_1$), initial temperature ($X_2$), and initial pH ($X_3$) were selected as the independent variables, while the adsorption of Sr ions by Na-X zeolite was selected as the dependent variable. The experimental data fitted well with a second-order polynomial equation by multiple regression analysis. The value of the determination coefficient ($R^2=0.9937$) and the adjusted determination coefficient (adjusted $R^2=0.9823$) was close to 1, indicating high significance of the model. Statistical results showed the order of Sr removal based on experimental factors to be initial pH > initial concentration > temperature.

Transport of Urea in Waterlogged Soil Column: Experimental Evidence and Modeling Approach Using WAVE Model

  • Yoo, Sun-Ho;Park, Jung-Geun;Lee, Sang-Mo;Han, Gwang-Hyun;Han, Kyung-Hwa
    • Journal of Applied Biological Chemistry
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    • 제43권1호
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    • pp.25-30
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    • 2000
  • The main form of nitrogen fertilizer applied to lowland rice is urea, but little is known about its transport in waterlogged soil. This study was conducted to investigate the transport of urea in waterlogged soil column using WAVE (simulation of the substances Water and Agrochemicals in the soil, crop and Vadose Environment) model which includes the parameters for urea adsorption and hydrolysis, The adsorption distribution coefficient and hydrolysis rate of urea were measured by batch experiments. A transport experiment was carried out with the soil column which was pre-incubated for 45 days under flooded condition. The urea hydrolysis rate (k) was $0.073h^{-1}$. Only 5% of the applied urea remained in soil column at 4 days after urea application. The distribution coefficient ($K_d$) of urea calculated from adsorption isotherm was $0.21Lkg^{-1}$, so it was assumed that urea that urea was a weak-adsorbing material. The maximum concentration of urea was appeared at the convective water front because transport of mobile and weak-adsorbing chemicals, such as urea, is dependent on water convective flow. The urea moved down to 11 cm depth only for 2 days after application, so there is a possibility that unhydrolyzed urea could move out of the root zone and not be available for crops. A simulated urea concentration distribution in waterlogged soil column using WAVE model was slightly different from the measured concentration distribution. This difference resulted from the same hydrolysis rate applied to all soil depths and overestimated hydrodynamic dispersion coefficient. In spite of these limitations, the transport of urea in waterlogged soil column could be predict with WAVE model using urea hydrolysis rate (k) and distribution coefficient ($K_d$) which could be measured easily from a batch experiment.

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Synthesis and characterization of sugarcane bagasse/zinc aluminium and apple peel/zinc aluminium biocomposites: Application for removal of reactive and acid dyes

  • Safa, Yusra;Tariq, Saadia Rashid;Bhatti, Haq Nawaz;Sultan, Misbah;Bibi, Ismat;Nouren, Shazia
    • Membrane and Water Treatment
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    • 제9권5호
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    • pp.301-307
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    • 2018
  • In this research work, synthesis of sugarcane bagasse/zinc aluminium biocomposite and apple peel/zinc aluminium biocomposite and their application for removal of Reactive Red-241 and Acid Orange-7, respectively, was studied using various parameters. At pH 2 the sorption was the highest for both dyes. The trend showed that the dye sorption declined by decreasing the biocomposite dose and enhanced by increasing the dye concentration and temperature. Equilibrium was achieved at 60 minutes for Reactive Red-241 onto sugarcane bagasse/zinc aluminium biocomposite and 90 minutes for Acid Orange-7 onto apple peel/zinc aluminium biocomposite.The research data was good fitted to pseudo-2nd-order kinetic model and Langmuir isotherm. FT-IR analysis was used to confirm the biosorption of the selected dyes at the surface of biosorbent through various binding sites. Surface morphology modification of both biocomposites before and after biosorption was inspected through SEM. Crystallinity of biocomposite was examined through XRD analysis. It was implied that sugarcane bagasse/ zinc aluminium biocomposite and apple peel/ zinc aluminium biocomposite are good adsorbents for dyes elimination from aqueous solutions.

Electrosorption Removal of the Zinc Ions from Aqueous Solution on an Artificial Electrode based in the Banana Wastes

  • Benakouche, Houda;Bounoughaz, Moussa
    • Journal of Electrochemical Science and Technology
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    • 제8권1호
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    • pp.77-86
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    • 2017
  • The valorization of domestic wastes becomes a very important research axis that can reduce the energy consumption and protect our environment. The objective of this study is to remove zinc ions from wastewater by using banana peels after their activation as sensor in the working electrode for an environmental application. Banana peels were dried, crushed and treated with sulfuric acid then mixed with polyaniline to improve their electrical conductivity. Cyclic voltammetry and chronoamperometry were used for electrochemistry tests. The obtained voltammogramms at well optimized conditions of applied potential of -1.3 V/SCE and initial zinc concentration of 0.2M during 2 hours of electrolysis, showed the reduction peak of the zinc at a potential of -1.14 V/SCE, which confirmed the activity of this electrode. The modeling of experimental data revealed that the adsorption was fitted by the Langmuir isotherm with a maximal adsorption capacity of 3.4188 mg/g. Changes in the structure of the powder after the electrosorption was noticed by SEM and EDX. Finally, the dosage of the electrolytic solution showed a diminution of the zinc concentration with yield of 99.99%.

Utilization of Waste Aluminium Foil as a Sacrificial Electrode for the Treatment of Wastewater

  • Perumalsamy, Rajagopal;Kumaran, Chithra;Rajamanickam, Vaishali
    • Journal of Electrochemical Science and Technology
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    • 제12권1호
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    • pp.92-100
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    • 2021
  • In this study, the use of waste food grade aluminium foil and mild steel as a sacrificial electrode in an electrocoagulation system was developed to remove reactive red 111 from wastewater. The effect of different parameters like pH, current density, electrode material, and different electrode configurations was investigated. Optimum operating conditions for maximum COD removal were determined as, 6 mA/㎠ current density and 30 min at 5 pH for aluminium foil and 7 pH for mild steel. Maximum COD reduction obtained at optimum conditions using monopolar 4 electrodes, monopolar 2 electrodes and bipolar electrode configuration were 96.5%, 89.3%, and 90.2% for Mild steel as a sacrificial electrode and 92.1%, 84.2%, and 88.6% for aluminium foil as a sacrificial electrode. The consumption of electrode and energy for both the electrodes of different configurations were calculated and compared. Using batch experimental data, a continuous-flow reactor was developed. Sludge analysis using Fourier Transform Infra-Red Spectroscopy (FTIR) analysis was done. Different adsorption kinetic models and isotherms were developed and it was found that pseudo second-order model and Langmuir isotherm fit best with the experimental data obtained.

Hydrothermal synthesis, structure and sorption performance to cesium and strontium ions of nanostructured magnetic zeolite composites

  • Dran'kov, Artur;Shichalin, Oleg;Papynov, Evgeniy;Nomerovskii, Alexey;Mayorov, Vitaliy;Pechnikov, Vladimir;Ivanets, Andrei;Buravlev, Igor;Yarusova, Sofiya;Zavjalov, Alexey;Ognev, Aleksey;Balybina, Valeriya;Lembikov, Aleksey;Tananaev, Ivan;Shapkin, Nikolay
    • Nuclear Engineering and Technology
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    • 제54권6호
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    • pp.1991-2003
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    • 2022
  • The problem of water contamination by long-living cesium and strontium radionuclides is an urgent environmental issue. The development of facile and efficient technologies based on nanostructured adsorbents is a perspective for selective radionuclides removal. In this regard, current work aimed to obtain the nanostructured magnetic zeolite composites with high adsorption performance to cesium and strontium ions. The optimal conditions of hydrothermal synthesis were established based on XRD, SEM-EDX, N2 adsorption-desorption, VSM, and batch adsorption experiment data. The role of chemical composition, textural characteristics, and surface morphology was demonstrated. The monolayer ionexchange mechanism was proposed based on adsorption isotherm modeling. The highest Langmuir adsorption capacity of 229.6 and 105.1 mg/g towards cesium and strontium ions was reached for composite obtained at 90 ℃ hydrothermal treatment. It was shown that magnetic characteristics of zeolite composites allowing to separate spent adsorbents by a magnet from aqueous solutions.

Burkholderia tropica as a Potential Microalgal Growth-Promoting Bacterium in the Biosorption of Mercury from Aqueous Solutions

  • Zarate, Ana;Florez, July;Angulo, Edgardo;Varela-Prieto, Lourdes;Infante, Cherlys;Barrios, Fredy;Barraza, Beatriz;Gallardo, D.I;Valdes, Jorge
    • Journal of Microbiology and Biotechnology
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    • 제27권6호
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    • pp.1138-1149
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    • 2017
  • The use of microalgal biomass is an interesting technology for the removal of heavy metals from aqueous solutions owing to its high metal-binding capacity, but the interactions with bacteria as a strategy for the removal of toxic metals have been poorly studied. The goal of the current research was to investigate the potential of Burkholderia tropica co-immobilized with Chlorella sp. in polyurethane discs for the biosorption of Hg(II) from aqueous solutions and to evaluate the influence of different Hg(II) concentrations (0.041, 1.0, and 10 mg/l) and their exposure to different contact times corresponding to intervals of 1, 2, 4, 8, 16, and 32 h. As expected, microalgal bacterial biomass adhered and grew to form a biofilm on the support. The biosorption data followed pseudo-second-order kinetics, and the adsorption equilibrium was well described by either Langmuir or Freundlich adsorption isotherm, reaching equilibrium from 1 h. In both bacterial and microalgal immobilization systems in the co-immobilization of Chlorella sp. and B. tropica to different concentrations of Hg(II), the kinetics of biosorption of Hg(II) was significantly higher before 60 min of contact time. The highest percentage of biosorption of Hg(II) achieved in the co-immobilization system was 95% at pH 6.4, at 3.6 g of biosorbent, $30{\pm}1^{\circ}C$, and a mercury concentration of 1 mg/l before 60 min of contact time. This study showed that co-immobilization with B. tropica has synergistic effects on biosorption of Hg(II) ions and merits consideration in the design of future strategies for the removal of toxic metals.

폐감귤박으로 만든 활성탄을 이용한 염료 Eosin Y 흡착에서 반응표면 모델링 (Response Surface Modeling for the Adsorption of Dye Eosin Y by Activated Carbon Prepared from Waste Citrus Peel)

  • 감상규;이민규
    • 공업화학
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    • 제29권3호
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    • pp.270-277
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    • 2018
  • 반응 표면법(RSM)과 Box-Behnken 설계(BBD) 통계 방법을 사용하여 폐감귤박으로 만든 활성탄(WCAC)에 의한 염료 Eosin Y의 흡착을 검토하였다. 실험은 Eosin Y의 농도(Conc. : 30~50 mg/L), 용액 온도(Temp. : 293~313 K) 및 흡착제 투여량(Dose : 0.05~0.150 g/L)의 3가지 입력 변수를 가진 BBD에 따라 수행하였다. 염료 Eosin Y 제거에 대해 얻어진 2차 다항식 모델의 회귀분석 결정계수($R^2$) 값이 0.9851이고 적합성 결여(Lack of fit)의 p 값은 0.342로 실험 데이터는 2차 다항식 모델에 잘 부합하였다. 염료 농도 50 mg/L, 온도 333 K 및 흡착제 투여량 0.1056 g에서 최적 염료 흡착량 59.3 mg/g이 얻어졌다. WCAC에 의한 Eosin Y의 흡착공정은 유사 2차 속도식에 의해 잘 기술되었으며, 등온 실험결과는 Langmuir 모델식을 따랐다.