A method for prediction of UNIFAC group interaction parameters

Hugo Edson Gonzàlez; Jens Abildskov; Rafiqul Gani; Pascal Rousseaux; Brice Le Bert

doi:10.1002/aic.11171

A method for prediction of UNIFAC group interaction parameters

AIChE Journal ◽

10.1002/aic.11171 ◽

2007 ◽

Vol 53 (6) ◽

pp. 1620-1632 ◽

Cited By ~ 16

Author(s):

Hugo Edson Gonzàlez ◽

Jens Abildskov ◽

Rafiqul Gani ◽

Pascal Rousseaux ◽

Brice Le Bert

Keyword(s):

Group Interaction ◽

Interaction Parameters

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New Group Interaction Parameters of the UNIFAC (Dortmund) Model: Aromatic Dicarboxylic Acid Isomer and Methyl Benzoic Acid Isomer Binaries

Industrial & Engineering Chemistry Research ◽

10.1021/acs.iecr.0c03979 ◽

2020 ◽

Vol 59 (52) ◽

pp. 22619-22625

Author(s):

Weiping Luo ◽

Sile Shi ◽

Zhipeng Shen ◽

Aocong Guan ◽

Lintao Yang ◽

...

Keyword(s):

Benzoic Acid ◽

Dicarboxylic Acid ◽

Group Interaction ◽

Interaction Parameters ◽

Aromatic Dicarboxylic Acid

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New Group-Interaction Parameters of the UNIFAC Model: Aromatic Methoxyl Binaries

Industrial & Engineering Chemistry Research ◽

10.1021/ie000795i ◽

2001 ◽

Vol 40 (7) ◽

pp. 1740-1747 ◽

Cited By ~ 8

Author(s):

Shou-Ming Hwang ◽

Ming-Jer Lee ◽

Ho-mu Lin

Keyword(s):

Group Interaction ◽

Interaction Parameters ◽

Unifac Model

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DISQUAC and UNIFAC group interaction parameters for chloroalkanes

Fluid Phase Equilibria ◽

10.1016/s0378-3812(97)00018-6 ◽

1997 ◽

Vol 132 (1-2) ◽

pp. 15-20 ◽

Cited By ~ 1

Author(s):

Omar Dahmani ◽

Ivan Wichterle ◽

Ahmed Ait-Kaci

Keyword(s):

Group Interaction ◽

Interaction Parameters

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Vapor–liquid equilibria for systems of diethyl carbonate and ketones and determination of group interaction parameters for the UNIFAC and ASOG methods

Fluid Phase Equilibria ◽

10.1016/j.fluid.2005.06.024 ◽

2005 ◽

Vol 235 (1) ◽

pp. 83-91 ◽

Cited By ~ 10

Author(s):

A.B. Pereiro ◽

A. Rodríguez ◽

J. Canosa ◽

J. Tojo

Keyword(s):

Group Interaction ◽

Interaction Parameters ◽

Diethyl Carbonate ◽

Vapor Liquid Equilibria ◽

Vapor Liquid

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Extension of the VTPR Group Contribution Equation of State: Group Interaction Parameters for Additional 192 Group Combinations and Typical Results

Industrial & Engineering Chemistry Research ◽

10.1021/ie404118f ◽

2014 ◽

Vol 53 (8) ◽

pp. 3393-3405 ◽

Cited By ~ 19

Author(s):

Bastian Schmid ◽

Andre Schedemann ◽

Jürgen Gmehling

Keyword(s):

Equation Of State ◽

Group Interaction ◽

Group Contribution ◽

Interaction Parameters ◽

State Group

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Corrigendum to “Revision of UNIFAC group interaction parameters of group contribution models to improve prediction results of vapor–liquid equilibria for solvent–polymer systems” [Fluid Phase Equilibria 202 (2002) 367–383]

Fluid Phase Equilibria ◽

10.1016/s0378-3812(03)00099-2 ◽

2003 ◽

Vol 205 (2) ◽

pp. 353

Author(s):

Gede Wibawa ◽

Shigeki Takishima ◽

Yoshiyuki Sato ◽

Hirokatsu Masuoka

Keyword(s):

Phase Equilibria ◽

Group Interaction ◽

Fluid Phase ◽

Group Contribution ◽

Interaction Parameters ◽

Polymer Systems ◽

Fluid Phase Equilibria ◽

Vapor Liquid Equilibria ◽

Vapor Liquid

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Kinetics of neutral hydrolysis of 1-benzoyl-3-phenyl-1,2,4-triazole in highly aqueous media: analysis of effects of added ethanol and propan-1-ol in terms of pairwise group interaction parameters

Journal of the Chemical Society Perkin Transactions 2 ◽

10.1039/p29920002035 ◽

1992 ◽

pp. 2035 ◽

Cited By ~ 5

Author(s):

Harm Benak ◽

Jan B. F. N. Engberts ◽

Michael J. Blandamer

Keyword(s):

Aqueous Media ◽

Group Interaction ◽

Media Analysis ◽

Interaction Parameters ◽

Kinetics Of ◽

Hydrolysis Of

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Analysis of a concept for predicting missing group interaction parameters of the UNIFAC model using connectivity indices

AIChE Journal ◽

10.1002/aic.11891 ◽

2009 ◽

Vol 55 (6) ◽

pp. 1614-1625 ◽

Cited By ~ 6

Author(s):

André Mohs ◽

Antje Jakob ◽

Jürgen Gmehling

Keyword(s):

Group Interaction ◽

Interaction Parameters ◽

Unifac Model ◽

Connectivity Indices

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Contributions of additional group interaction parameters through limiting activity coefficient measurements on aliphatic alcohols, aromatic hydrocarbons, ketones and an ester in tetrahydroxyethylethylenediamine and tetraethylene pentamine

Chemical Engineering Journal ◽

10.1016/s1385-8947(99)00092-3 ◽

1999 ◽

Vol 75 (2) ◽

pp. 87-92 ◽

Cited By ~ 1

Author(s):

S.M. Ashraf ◽

M. Ramakrishna ◽

D.H.L. Prasad ◽

M. Bhagwanth Rao

Keyword(s):

Activity Coefficient ◽

Aromatic Hydrocarbons ◽

Group Interaction ◽

Aliphatic Alcohols ◽

Interaction Parameters ◽

Additional Group ◽

Tetraethylene Pentamine

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Addition of the sulfhydryl group (SH) to the PPR78 model: Estimation of missing group-interaction parameters for systems containing mercaptans and carbon dioxide or nitrogen or methane, from newly published data

Fluid Phase Equilibria ◽

10.1016/j.fluid.2012.08.007 ◽

2012 ◽

Vol 334 ◽

pp. 197-203 ◽

Cited By ~ 25

Author(s):

Romain Privat ◽

Jean-Noël Jaubert

Keyword(s):

Carbon Dioxide ◽

Group Interaction ◽

Sulfhydryl Group ◽

Interaction Parameters ◽

Published Data ◽

Model Estimation

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