• Title/Summary/Keyword: NRTL equation

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The Measurement and Prediction of the Flash Points for the Water+2-Propanol System Using Open-Cup Apparatus (개방식 장치를 이용한 water+2-propanol계의 인화점 측정 및 예측)

  • Ha, Dong-Myeong;Lee, Sung-Jin
    • Fire Science and Engineering
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    • v.21 no.2 s.66
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    • pp.48-53
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    • 2007
  • The knowledge of the flash point of the mixtures is very important for prevention and protection of fire in the industrial field. The flash points for the water+2-propanol system were measured by using Tag open-cup apparatus(ASTM D1310-86). The experimental data were compared with the values calculated by the Raoult's law, the Van Laar equation and the NRTL(Non Random Two Liquids) equation. The calculated values based on the Van Laar and NRTL equations were found to be better than those based on the Raoult's law. It was concluded that Van Laar and NRTL equations were more effective than the Raoult' law at describing the activity coefficients for non-ideal solution such as the water+2-propanol system. And the predictive curve of the flash point prediction model based on the Van Law equation described the experimentally-derived data more effectively than was the case when the prediction model was based upon the NRTL equation.

The Measurement and Estimation of the Lower Flash Points for tert-Pentanol + Propionic Acid and p-Xylene + Propionic Acid Systems Using Open-Cup Apparatus (개방식 장치를 이용한 tert-Pentanol + Propionic Acid 및 p-Xylene + Propionic Acid 계의 하부인화점 측정 및 예측)

  • Ha, Dong-Myeong;Lee, Sung-Jin
    • Fire Science and Engineering
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    • v.23 no.5
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    • pp.161-166
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    • 2009
  • The lower flash points for the tert-pentanol + propionic acid and p-xylene + propionic acid systems were measured by Tag open-cup apparatus. The experimental data were compared with the values calculated by the Raoult's law, the van Laar equation and the NRTL equation. The calculated values based on the van Laar and NRTL equations were found to be better than those based on the Raoult's law. It was concluded that the van Laar and NRTL equations were more effective than the Raoult' law at describing the activity coefficients for non-ideal solution such as the tert-pentanol + propionic acid and p-xylene + propionic acid systems. The predictive curve of the flash point prediction model based on the NRTL equation described the experimentally-derived data more effectively than was the case when the prediction model was based upon the van Laar equation.

The Measurement and Estimation of Lower Flash Point for 2-Propanol+Acid Systems Using Cleveland Open Cup Apparatus (클리브랜드 개방식 장치를 이용한 2-propanol+acid류 계의 하부 인화점 측정 및 예측)

  • Ha, Dong-Myeong;Lee, Sung-Jin
    • Fire Science and Engineering
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    • v.21 no.4
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    • pp.32-37
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    • 2007
  • An accurate knowledge of the flash point is important in developing appropriate preventive and control measures in industrial fire protection. The lower flash points for the 2-propanol+acetic acid and 2-propanol+-n-propionic acid systems were measured by Cleveland open cup apparatus. The experimental data were compared with the values calculated by the Raoult's law, the Wilson equation and the NRTL(non random two liquids) equation. The calculated values based on the Wilson and NRTL equations were found to be better than those based on the Raoult's law. And the predictive curve of the flash point prediction model, based on NRTL equation described the experimentally-derived data were more effective than the case of the Wilson equation.

The Measurement and Estimation of Minimum Flash Point Behavior for Binary Mixtures Using Tag Open-Cup Tester (Tag 개방식 장치를 이용한 이성분계 혼합물의 최소인화점 현상의 측정 및 예측)

  • Ha, Dong-Myeong;Lee, Sung-Jin
    • Journal of the Korean Institute of Gas
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    • v.12 no.3
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    • pp.50-55
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    • 2008
  • The flash points for the systems, ethlybenzene+n-butanol and ethlybenzene+n-hexanol, were measured by using Tag open-cup tester (ASTM D1310-86). These binary mixtures exhibited MFPB (minimum flash point behavior), which leads to the minimum on the flash point vs composition curve. The experimental data were compared with the values calculated by the Raoult's law, the UNIQUAC equation and the NRTL equation. The calculated values based on the UNIQUAC and NRTL equations were found to be better than those based on the Raoult's law. It was concluded that the UNIQUAC and NRTL equations were more effective than the Raoult' law at describing the activity coefficients for nonideal solution such as the ethlybenzene+n-butanol and ethlybenzene+n-hexanol systems. And the predictive curve of the flash point prediction model based on the NRTL equation described the experimentally-derived data more effectively than was the case when the prediction model was based upon the UNIQUAC equation.

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The Correlation of Lower Flash Point data with Activity Coefficient Models

  • Ha, Dong-Myeong;Lee, Sungjin
    • International Journal of Safety
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    • v.10 no.1
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    • pp.5-9
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    • 2011
  • Two popular activity coefficient models, Wilson and NRTL equations have been used to correlate the published flash point data on the n-propanol + propionic acid and n-butanol + propionic acid systems through the optimization method. The results of these correlation were compared with the results calculated by Raoult's law. The optimization method were found to be better than those based on the Raoult's law. The optimization method based on the Wilson equation described the published data more effectively than was the case when the optimization method was based upon the NRTL equation.

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A Comparative Study on the Prediction of Vapor-Liquid Equilibria for the Ethanol-Benzene Mixture between Equation of State Model and Liquid Activity Coefficient Model (비이상적 상거동을 보이는 이성분계 혼합물의 기액 상평형 추산을 위한 상태방정식과 액체 활동도계수 모델 사이의 비교연구)

  • Cho, Jung-Ho;Lee, Ji-Hwan
    • Journal of the Korea Academia-Industrial cooperation Society
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    • v.11 no.5
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    • pp.1747-1753
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    • 2010
  • In this study, a comparative study was performed to predict the vapor-liquid equilibria with maximum azeotropic pressure for ethanol-benzene binary system between an equation of state model and a liquid activity coefficient model. Peng-Robinson equation of state model with a Panatiotopoulos mixing rules (PRP) was used and NRTL liquid activity coefficient model proposed by Renon was selected. The PRP model, even though it has only two binary adjustable parameters, was not inferior to the NRTL model to predict vapor-liquid equilibria for low pressure region of ethanol-benzene system and showed a better prediction capability for high pressure region of ethanol-benzene system than the NRTL model with three binary interaction parameters.

The Effect of Nonrandom Distribution of Molecules on the Equation of State for Gases (분자의 논랜덤 분포가 기체의 상태방정식에 미치는 영향)

  • Jung, Hae-Young
    • Journal of the Korean Chemical Society
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    • v.57 no.5
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    • pp.540-546
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    • 2013
  • Using the free volume of van der Waals equation, Carnahan-Starling equation for hard spheres, Wilson equation for nonrandom mixing of solution, NRTL equation and our equation, several new equations of states for pure gases are derived. Using these equations, compressibility factors for pure gases are calculated and compared with Nelson-Obert generalized compressibility factor charts. The equation of states using the concept of molecular nonrandom distribution gave better results than those of molecular random distribution. This shows that the molecular nonrandom distribution makes considerable effect on the equation of states.

Evaluation and Comparison of the Solubility Models for Solute in Monosolvents

  • Min-jie Zhi;Wan-feng Chen;Yang-bo Xi
    • Korean Chemical Engineering Research
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    • v.62 no.1
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    • pp.53-69
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    • 2024
  • The solubility of Cloxacillin sodium in ethanol, 1-propanol, isopropanol, and acetone solutions was measured at different temperatures. The melting property was also tested by using a differential scanning calorimeter (DSC). Then, the solubility data were fitted using Apelblat equation and λh equation, respectively. The Wilson model and NRTL model were not utilized to correlate the test data, since Cloxacillin sodium will decompose directly after melting. For comparison purposes, the four empirical models, i.e., Apelblat equation, λh equation, Wilson model and NRTL Model, were evaluated by using 1155 solubility curves of 103 solutes tested under different monosolvents and temperatures. The comparison results indicate that the Apelblat equation is superior to the others. Furthermore, a new method (named the calculation method) for determining the Apelblat equation using only three data points was proposed to solve the problem that there may not be enough solute in the determination of solubility. The log-logistic distribution function was used to further capture the trend of the correlation and to make better quantitative comparison between predicted data and the experimental ones for the Apelblat equation determined by different methods (fitting method or calculation method). It is found that the proposed calculation method not only greatly reduces the number of test data points, but also has satisfactory prediction accuracy.

Optimization Study for Pressure Swing Distillation Process for the Mixture of Isobutyl-Acetate and Isobutyl-Alcohol System (Isobutyl-Acetate와 Isobutyl-Alcohol 이성분계의 압력변환증류 공정 최적화 연구)

  • Cho, Sung Jin;Shin, Jae Sun;Choi, Suk Hoon;Lee, Euy Soo;Park, Sang Jin
    • Korean Chemical Engineering Research
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    • v.52 no.3
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    • pp.307-313
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    • 2014
  • In this study, an optimization process design has been performed to separate 99.9 mol% of Isobutyl Acetate from binary azeotropic mixture of Isobutyl Acetate and Isobutyl Alcohol system using a Pressure Swing Distillation (PSD). PSD is used to separate binary azeotropic mixtures using the difference between the relative volatilities and azeotropic compositions by changing the system pressure. Non-Random Two Liquid (NRTL) model for liquid phase and the Peng-Robinson equation for vapor phase are used. An optimization study for the reflux ratio and feed stage locations which minimize the total reboiler heat duties are studied. Since PSD process consists of two columns, i.e. high pressure and low pressure, the effect of column sequence on the optimum conditions is reported.

The Measurement of Lower Flash Point for tert-Pentanol+n-Decane System Using Tag Open-Cup Tester (Tag 개방식 장치를 이용한 tert-Pentanol+n-Decane 계의 하부인화점 측정)

  • Ha, Dong-Myeong;Lee, Sungjin
    • Journal of the Korean Institute of Gas
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    • v.16 no.5
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    • pp.41-46
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    • 2012
  • The flash point the lowest temperature at which the concentration of vapor of the substance in the air reaches the lower flammability limit(LFL), and is one of the most important physical properties used to determine the potential for fire and explosion hazards of industrial materials. The most published flash point data was for pure components and the flash points of the binary solutions that have flammable components, appear to be scarce in the literature. In the present study, the flash points of tert-pentanol+n-decane system were measured by Tag open-cup tester. The measured data were compared with the values calculated by the Raoult's law and the optimization methods based on the Wilson and NRTL equations. The calculated values by optimization methods were found to be better than those based on the Raoult's law.