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Application of the UNIQUAC Equation to Calculation of Multicomponent Phase Equilibria. 1. Vapor-Liquid Equilibria

https://doi.org/10.1021/i260068a028
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Prediction and experimental determination of vapour‐liquid equilibria for benzene + Cyclohexane + 1‐Butanol mixtures at 101.325 kPa
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Simultaneous correlation of excess gibbs energy and enthalpy of mixing by the UNIQUAC Equation
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Study of a continuous separation process for 2‐furyl oxirane
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QSPR Approach to Predict Nonadditive Properties of Mixtures. Application to Bubble Point Temperatures of Binary Mixtures of Liquids
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(Vapour + liquid) equilibria in (methanol + ethyl tert -butyl ether) and (methanol + ethyl tert -butyl ether+ toluene) at = 328.15 K
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Prediction of Liquid-Liquid Equilibrium Data for a Quaternary System Containing an Electrolyte Resulting from the Dissociation of the Acetic Acid
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Application of NRTL and uniquac models to liquid-liquid systems with halogen salts (Part I)
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Prediction of ternary liquid-liquid equilibria using the NRTL and the UNIQUAC models
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Solid–Liquid Equilibrium of Acrylic Acid, Water, and Acetic Acid Ternary System for Separation Process Design
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Molecular thermodynamics of liquids containing supercritical compounds
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Temperature dependence of the UNIQUAC parameters
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Correlation of quaternary liquid-liquid equilibrium data by means of a modification of the uniquac model
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Correlation of ternary liquid-liquid equilibrium data and prediction of quaternary liquid-liquid equilibrium data by means of the uniquac model
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Simultaneous correlation of excess gibbs energy and excess enthalpy data using the extended uniquac model
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Correlation of heats of mixing data by the NRTL and UNIQUAC models.
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Calculation of excess heat capacities for liquid mixtures
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Representation of phase equilibria using a modified form of the extended uniquac model
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Computation of multicomponent phase equilibria—Part II. Liquid-liquid and solid-liquid equilibria
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Quaternary liquid-liquid equilibrium: water-acetic acid-1-butanol-n-butyl acetate at 25°C
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Vapour-liquid equilibria. II. The ternary system methanol-chloroform-acetone at 313.15 and 323.15 K
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Thermodynamic properties of ethanol + water II. Potentials and limits of GE models
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Excess thermodynamics functions of 1-propanol + methyl propanoate and 1-propanol + methyl butanoate systems
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Evaluation of the methods of correlation and interpolation of quaternary liquid—liquid equilibrium data. Application to the system water—ethanol—chloroform—toluene at 25°C
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Quaternary liquid—liquid equilibrium. Cyclohexane—ethanol—benzene—acetonitrile
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Vapour—liquid equilibrium of the system benzene + cyclohexane + 1-propanol at 760 mm Hg
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Correlation of ammonia-water equilibrium data with various modified Peng-Robinson equations of state
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Computer calculation of the optimal parameters of a model for the simultaneous representation of experimental binary and ternary vapor-liquid and liquid-liquid equilibrium data
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Phase behavior of aqueous two-polymer systems
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Measurement and correlation of liquid liquid equilibria of binary and ternary systems containing methanol and hydrocarbons
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Isobaric vapourliquid equilibria for the ternary mixture: methyl ethyl ketonewatertoluene
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Vapor—liquid equilibria of the binary mixtures methyl chloride — methanol and dimethyl ether — methyl chloride and of the ternary mixture dimethyl ether — methyl chloride — methanol
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Vapor—liquid equilibrium calculations of multicomponent systems based on Taylor series approximation for quasichemical equilibria
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Vapour—liquid equilibria. IV. The ternary system carbon tetrachloride—methanol—chloroform at 293.15 K
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Binary vapor-liquid-liquid equilibrium of dimethyl ether - water and mutual solubilities of methyl chloride and water: Experimental results and data reduction
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Modification of the extended UNIQUAC model for ternary and quaternary liquid-liquid equilibrium calculations
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Vapour—liquid equilibrium in the ternary system N,N-dimethylformamide + methanol + water at 313.15 K
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Vapour—liquid equilibria. V. The ternary system carbon tetrachloride—methanol—chloroform at 303.15 K
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Modification of the extended uniquac model for correlating quaternary liquid—liquid equilibrium data
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Liquid—liquid equilibria for the systems water-alcohols-acetic acid
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Total vapour pressure measurements and excess Gibbs energies for the binary systems methanol + ethanol, ethanol + 2-propanol, benzene + cyclohexane, benzene + carbon tetrachloride and benzene + ethanol at 303.15 and 313.15 K
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On the isobaric vapour—liquid equilibrium of the cyclohexanol—phenylmethanol binary at 101.325 ± 0.067 kPa
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Liquid—liquid equilibria for the systems: water/1-pentanol/acetic acid and water/1-hexanol/acetic acid
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Simultaneous representation of excess enthalpy and vapor—liquid equilibrium data by the NRTL and UNIQUAC models
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Study of ternary liquid—liquid equilibria and of multiphase equilibria
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Application of the VdW-711 equation of state to polar mixtures: correlation of binary and prediction of multicomponent vapour—liquid equilibria
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Liquid-liquid equilibria for ternary systems of cyclohexane-water and C1 to C3 alcohols: data and predictions
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Vapour-liquid equilibria
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Recommendations for VLE data on binary 1-alkanol + n-alkane systems
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A new method for predicting liquid-liquid equilibria from headspace analysis determinations over homogeneous liquid mixtures using the UNIQUAC model
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On the calculations of azeotropes from the NRTL and UNIQUAC models
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A modification of the Wilson equation with only binary parameters for ternary liquid—liquid equilibria
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Liquid-liquid equilibria of some water + tetrahydrofurfuryl alcohol + solvent ternaries at 293.2 ± 0.1 K and 101.3 ± 0.8 kPa
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Influence of temperature on the liquid-to-liquid extraction of 4-hydroxy-4-methyl-2-pentanone from aqueous solutions with benzyl alcohol
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Prediction of liquid-liquid equilibria in ternary mixtures from binary data
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An equation of state mixing rule for correlating ternary liquid-liquid equilibria
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Optimization of UNIQUAC structural parameters for individual mixtures; application to new experimental liquid-liquid equilibrium data for aqueous solutions of methanol and ethanol with isoamyl acetate
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Vapour-liquid equilibria. VII: The ternary system hexanemethanolacetone at 313.15 K
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Liquid-liquid equilibria prediction using the area method
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Vapour-liquid equilibria. VIII. The ternary system cyclohexane-methanol-acetone at 313.15 K
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VLE for water + ethanol + 1-octanol mixtures. Experimental measurements and correlations
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Computation and thermodynamic interpretation of high-pressure vapour—liquid equilibrium—a review
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Process Simulation
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Mass transfer characteristics of rotating spiral gas-liquid contacting
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Adsorption of aqueous organic mixtures on a chiral stationary phase with bound antibiotic eremomycin
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Extraction of biofuels and biofeedstocks from aqueous solutions using ionic liquids
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Mass transport study of PVA membranes for the pervaporation separation of water/ethanol mixtures
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Isothermal and isobaric vapor–liquid equilibria for the binary system trimethylbenzoquinone + n-hexanol
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Application of quasi-chemical models to liquid–liquid equilibrium calculations for ternary systems containing water, propionic acid and organic solvents
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Salt effect on vapor–liquid equilibria for binary systems of propanol/CaCl2 and butanol/CaCl2
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Isobaric vapour–liquid equilibria of binary 1-propoxy-2-propanol mixtures with water and alcohols at reduced pressure
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Liquid–liquid phase equilibria of the ternary system of water/1,4-dioxane/dihydromyrcene
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Phase equilibria for reactive distillation of diethyl succinate. Part II: Systems diethyl succinate+ethyl acetate+water and diethyl succinate+acetic acid+water
inferred← citeshttps://doi.org/10.1016/j.fluid.2009.11.014openalex-snapshot
Phase equilibria for reactive distillation of diethyl succinate
inferred← citeshttps://doi.org/10.1016/j.fluid.2011.10.025openalex-snapshot
Isobaric vapor–liquid–liquid equilibrium for isopropenyl acetate+water+acetic acid at 101kPa
inferred← citeshttps://doi.org/10.1016/j.fluid.2012.11.004openalex-snapshot
Vapor–liquid equilibrium of the ethanol+3-methyl-1-butanol system at 50.66, 101.33 and 151.99kPa
inferred← citeshttps://doi.org/10.1016/j.fluid.2012.11.018openalex-snapshot
The choice of solvent and liquid–liquid equilibrium for ternary water+2-methylaziridine+chloroform system: Experimental data and modeling
inferred← citeshttps://doi.org/10.1016/j.fluid.2013.10.016openalex-snapshot
Accurately modeling benzene and alkylbenzenes using a group contribution based SAFT approach
inferred← citeshttps://doi.org/10.1016/j.fluid.2014.04.014openalex-snapshot
An algorithm for the regression of the UNIQUAC interaction parameters in liquid–liquid equilibrium for single- and multi-temperature experimental data
inferred← citeshttps://doi.org/10.1016/j.fluid.2016.08.025openalex-snapshot
Vapor – Liquid equilibria study of the ternary systems containing sucrose in aqueous solutions of ionic liquids, 1-butyl-3-methyl imidazolium bromide and 1-hexyl-3-methyl imidazolium bromide at 298.15 K and atmospheric pressure
inferred← citeshttps://doi.org/10.1016/j.fluid.2016.12.024openalex-snapshot
Thermodynamic studies on the phase equilibria of ternary {ionic liquid, 1-hexyl-3-methyl imidazolium chloride + D-fructose or sucrose + water} systems at 298.15 K
inferred← citeshttps://doi.org/10.1016/j.fluid.2017.06.004openalex-snapshot
Determining the critical points and coexistence curve of multi-species equilibria using Gaussian Process Regression
inferred← citeshttps://doi.org/10.1016/j.fluid.2019.01.023openalex-snapshot
Correlation of phase equilibria by new activity coefficient model
inferred← citeshttps://doi.org/10.1016/j.fluid.2019.04.004openalex-snapshot
Prediction of the melting behavior of edible fats using UNIFAC and UNIQUAC models
inferred← citeshttps://doi.org/10.1016/j.fluid.2019.112398openalex-snapshot
Implementation of the UNIQUAC model in the OpenCalphad software
inferred← citeshttps://doi.org/10.1016/j.fluid.2020.112483openalex-snapshot
Identification of UNIQUAC binary interaction parameters in liquid-liquid equilibrium
inferred← citeshttps://doi.org/10.1016/j.fluid.2020.112765openalex-snapshot
Effect of deep eutectic solvents based on choline chloride on the thermodynamic and transport properties of D-fructose in aqueous solution
inferred← citeshttps://doi.org/10.1016/j.fluid.2022.113599openalex-snapshot
Evolutionary optimization strategies for Liquid-liquid interaction parameters
inferred← citeshttps://doi.org/10.1016/j.fluid.2023.113766openalex-snapshot
Predicting the ionicity of ionic liquids in binary mixtures based on solubility data: II
inferred← citeshttps://doi.org/10.1016/j.fluid.2023.113930openalex-snapshot
Binodal and spinodal curves of ternary systems containing lignin using the NRTL and UNIQUAC models
inferred← citeshttps://doi.org/10.1016/j.fluid.2024.114199openalex-snapshot
Experimental determination and theoretical modeling of isobaric vapor–liquid equilibria, liquid mass density, surface tension and dynamic viscosity for the methyl butyrate and tert-butanol binary mixture
inferred← citeshttps://doi.org/10.1016/j.fluid.2025.114406openalex-snapshot
High pressure equilibrium data of CO2/cyclohexene oxide and CO2/limonene oxide systems in the context of polycarbonate synthesis using CO2 as a co-monomer
inferred← citeshttps://doi.org/10.1016/j.fluid.2025.114533openalex-snapshot
Pressure and temperature dependent UNIQUAC model for methanol - water mixtures
inferred← citeshttps://doi.org/10.1016/j.foodres.2022.111740openalex-snapshot
Solid-liquid equilibrium of free form of oil contaminants (3-MCPD and glycidol) in lipidic systems
inferred← citeshttps://doi.org/10.1016/j.foodres.2023.113440openalex-snapshot
Solid-liquid equilibria of triacylglycerols and vitamin E mixtures
inferred← citeshttps://doi.org/10.1016/j.icarus.2017.10.048openalex-snapshot
Role of the global water ocean on the evolution of Titan’s primitive atmosphere
inferred← citeshttps://doi.org/10.1016/j.ijggc.2013.06.002openalex-snapshot
AMP–CO2–water thermodynamics, a combination of UNIQUAC model, computational chemistry and experimental data
inferred← citeshttps://doi.org/10.1016/j.ijhydene.2008.12.035openalex-snapshot
HIx system thermodynamic model for hydrogen production by the Sulfur–Iodine cycle
inferred← citeshttps://doi.org/10.1016/j.ijhydene.2009.06.022openalex-snapshot
Bunsen section thermodynamic model for hydrogen production by the sulfur–iodine cycle
inferred← citeshttps://doi.org/10.1016/j.ijhydene.2020.10.188openalex-snapshot
A parametric study of dehydrogenation of various Liquid Organic Hydrogen Carrier (LOHC) materials and its application to methanation process
inferred← citeshttps://doi.org/10.1016/j.ijhydene.2026.154839openalex-snapshot
Maximizing the degree of dehydrogenation of perhydro-dibenzyl toluene via in-line distillation for continuous hydrogen release in commercial systems
inferred← citeshttps://doi.org/10.1016/j.jct.2004.07.023openalex-snapshot
Bubble points measurement for (triethyl orthoformate + diethyl malonate)
inferred← citeshttps://doi.org/10.1016/j.jct.2004.08.012openalex-snapshot
Isothermal and isobaric (vapour + liquid) equilibria of (α-pinene +n-butanol +n-octane)
inferred← citeshttps://doi.org/10.1016/j.jct.2005.10.001openalex-snapshot
(Vapour + liquid) equilibria for (2-ethoxypropene + acetone) and (2-ethoxypropene + butanone)
inferred← citeshttps://doi.org/10.1016/j.jct.2007.03.010openalex-snapshot
Molar excess enthalpy (HmE) for various {alkanolamine (1) + water (2)} systems at T= (298.15, 313.15, and 323.15) K
inferred← citeshttps://doi.org/10.1016/j.jct.2007.12.002openalex-snapshot
(Vapour + liquid + liquid) equilibria and excess molar enthalpies of binary and ternary mixtures of isopropanol, water, and propylene
inferred← citeshttps://doi.org/10.1016/j.jct.2008.09.009openalex-snapshot
Mixing properties of tris(2-hydroxyethyl)methylamonium methylsulfate, water, and methanol at 298.15 K. Data treatment using several correlation equations
inferred← citeshttps://doi.org/10.1016/j.jct.2011.05.033openalex-snapshot
Volumetric properties and enthalpies of solution of alcohols C H2+1OH (k= 1, 2, 6) in 1-methyl-3-alkylimidazolium bis(trifluoromethylsulfonyl)imide {[C1C Im][NTf2] n= 2, 4, 6, 8, 10} ionic liquids
inferred← citeshttps://doi.org/10.1016/j.jct.2014.08.016openalex-snapshot
Investigation of 1-(2-carboxyethyl)-3-methylimidazolium chloride[HOOCEMIM][Cl] ionic liquid effect on water activity and solubility of l-serine at T= 298.15 K
inferred← citeshttps://doi.org/10.1016/j.jct.2015.04.003openalex-snapshot
Isobaric (vapour + liquid) equilibria of binary systems containing butyl acetate for the separation of methoxy aromatic compounds (anisole and guaiacol) from biomass fast pyrolysis oil
inferred← citeshttps://doi.org/10.1016/j.jct.2015.08.027openalex-snapshot
Ionic liquid 1-hexyl-3-methylimidazolium hexafluorophosphate, an efficient solvent for extraction of acetone from aqueous solutions
inferred← citeshttps://doi.org/10.1016/j.jct.2015.11.011openalex-snapshot
Experimental measurement and prediction of (liquid + liquid + liquid) equilibrium for the system (n-hexadecane + water + triacetin)
inferred← citeshttps://doi.org/10.1016/j.jct.2016.10.015openalex-snapshot
Effect of ionic liquids, 1-butyl-3-methyl imidazolium bromide and 1-hexyl-3-methyl imidazolium bromide on the vapour – Liquid equilibria of the aqueous d-fructose solutions at 298.15 K and atmospheric pressure using isopiestic method
inferred← citeshttps://doi.org/10.1016/j.jct.2019.06.010openalex-snapshot
Liquid-liquid equilibrium for (water + 5-hydroxymethylfurfural + 1-pentanol/1-hexanol/1-heptanol) systems at 298.15 K
inferred← citeshttps://doi.org/10.1016/j.jct.2021.106444openalex-snapshot
Vapour-liquid equilibria of systems containing deep eutectic solvent based on choline chloride and glycerol
inferred← citeshttps://doi.org/10.1016/j.jct.2021.106559openalex-snapshot
Salting- in effect of deep eutectic solvents on the aqueous solutions of D-glucose by using isopiestic method
inferred← citeshttps://doi.org/10.1016/j.jct.2021.106608openalex-snapshot
Experimental study and modeling of vapor–liquid equilibria and excess molar volumes in the di-(2-ethylhexyl)phosphoric acid – toluene (cyclohexane, hexane, heptane) systems
inferred← citeshttps://doi.org/10.1016/j.jece.2024.112188openalex-snapshot
Phase behavior and intermolecular interaction analysis of the ternary system of water + 2-methylpyridine + octanols from 303.2 K to 323.2 K
inferred← citeshttps://doi.org/10.1016/j.jlp.2018.01.005openalex-snapshot
Flash point of flammable binary mixtures: Synergistic behavior
inferred← citeshttps://doi.org/10.1016/j.jpba.2022.114681openalex-snapshot
UniqPy: A tool for estimation of short-chain fatty acids composition by gas-chromatography/mass-spectrometry with headspace extraction
inferred← citeshttps://doi.org/10.1016/j.jtice.2025.106054openalex-snapshot
Leveraging spatial charge descriptor in deep learning models: Toward highly accurate prediction of vapor-liquid equilibrium
inferred← citeshttps://doi.org/10.1016/j.memsci.2006.11.055openalex-snapshot
Pervaporation separation of ethylene glycol/water mixtures through surface crosslinked PVA membranes: Coupling effect and separation performance analysis
inferred← citeshttps://doi.org/10.1016/j.memsci.2012.05.041openalex-snapshot
UNIQUAC and UNIQUAC-HB models for the sorption behavior of ethanol/water mixtures in a cross-linked polydimethylsiloxane membrane
inferred← citeshttps://doi.org/10.1016/j.memsci.2017.01.018openalex-snapshot
Recovery of dilute aqueous butanol by membrane vapor extraction with dodecane or mesitylene
inferred← citeshttps://doi.org/10.1016/j.molliq.2012.04.008openalex-snapshot
Computation of liquid–liquid equilibrium of organic-ionic liquid systems using NRTL, UNIQUAC and NRTL-NRF models
inferred← citeshttps://doi.org/10.1016/j.molliq.2014.01.028openalex-snapshot
A new hydrogen bonding local composition based model in obtaining phase behavior of aqueous solutions of sugars
inferred← citeshttps://doi.org/10.1016/j.molliq.2017.09.084openalex-snapshot
Solubility and solution thermodynamics of Raspberry Ketone in pure organic solvents and binary solvent mixtures from T = (293.15 to 333.15) K
inferred← citeshttps://doi.org/10.1016/j.molliq.2018.02.038openalex-snapshot
Investigation of the solute-solute and solute-solvent interactions in ternary {saccharide + ionic liquid + water} systems
inferred← citeshttps://doi.org/10.1016/j.molliq.2018.09.114openalex-snapshot
Solubility measurement and correlation for 1-naphthoic acid in nine pure and binary mixed solvents from T = (293.15 to 333.15) K
inferred← citeshttps://doi.org/10.1016/j.molliq.2019.111546openalex-snapshot
The study of solid-liquid equilibrium for dimethyl terephthalate (DMT) in several solvents from T = (298.15 to 330.15) K
inferred← citeshttps://doi.org/10.1016/j.molliq.2022.118798openalex-snapshot
Solubility measurement, modeling, and solvent effect of m-hydroxyacetophenone in ten pure and binary mixed solvents from T = (289.15–325.15) K
inferred← citeshttps://doi.org/10.1016/j.molliq.2024.124876openalex-snapshot
Thermodynamic and quantum chemical investigation of MIBK as a liquid phase extraction solvent for separating pyridine compounds from water
inferred← citeshttps://doi.org/10.1016/j.rineng.2023.101232openalex-snapshot
Solution of the maximum distillate on a batch distillation column by a Pseudo-Newton method
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