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Keyword

group contribution method

Description: The group contribution method is a chemical modeling technique that estimates molecular or mixture properties by combining contributions assigned to structural groups.
Wikidata ID: wiki/Q1551016
OpenAlex ID: keywords/group-contribution-method
Group‐contribution estimation of activity coefficients in nonideal liquid mixtures
1975 · Aage Fredenslund, Russell L. Jones, et al. · AIChE Journal · 3,265
Hansen Solubility Parameters: A User's Handbook
1999 · Charlès M. Hansen · Thammasat University Digital Collections · 2,066
Estimation of Pure-component Properties From Group-contributions
1987 · K.G. JOBACK, R.C. REID · Chemical Engineering Communications · 1,967
Fast solvent screening via quantum chemistry: COSMO‐RS approach
2002 · Frank Eckert, Andreas Klamt · AIChE Journal · 1,800
Properties of polymers: their correlation with chemical structure; their numerical estimation and prediction from additive group contributions
1991 · Choice Reviews Online · 1,661
COSMO-RS: a novel and efficient method for the a priori prediction of thermophysical data of liquids
2000 · Andreas Klamt, Frank Eckert · Fluid Phase Equilibria · 1,291
New group contribution method for estimating properties of pure compounds
1994 · Leonidas Constantinou, Rafiqul Gani · AIChE Journal · 1,227
Group-contribution based estimation of pure component properties
2001 · Jorge Marrero, Rafiqul Gani · Fluid Phase Equilibria · 1,201
Vapor-liquid equilibria by UNIFAC group contribution. 5. Revision and extension
1991 · Henrik K. Hansen, Peter Rasmussen, et al. · Industrial & Engineering Chemistry Research · 1,026
Group contributions to the thermodynamic properties of non-ionic organic solutes in dilute aqueous solution
1981 · Sergio Cabani, Paolo Gianni, et al. · Journal of Solution Chemistry · 972
A modified UNIFAC group-contribution model for prediction of phase equilibria and heats of mixing
1987 · Bent L. Larsen, Peter Rasmussen, et al. · Industrial & Engineering Chemistry Research · 878
Additivity methods in molecular polarizability
1990 · Kenneth J. Miller · Journal of the American Chemical Society · 824
UNIFAC parameter table for prediction of liquid-liquid equilibriums
1981 · Thomas Magnussen, Peter Rasmussen, et al. · Industrial & Engineering Chemistry Process Design and Development · 814
Guide to CO 2 Separations in Imidazolium-Based Room-Temperature Ionic Liquids
2009 · Jason E. Bara, Trevor K. Carlisle, et al. · Industrial & Engineering Chemistry Research · 714
PSRK: A Group Contribution Equation of State Based on UNIFAC
1991 · T. Holderbaum, J. Gmehling · Fluid Phase Equilibria · 691
Correlation and prediction of gas permeability in glassy polymer membrane materials via a modified free volume based group contribution method
1997 · J.Y. Park, D.R. Paul · Journal of Membrane Science · 635
SIMPOL.1: a simple group contribution method for predicting vapor pressures and enthalpies of vaporization of multifunctional organic compounds
2008 · J. F. Pankow, W. E. Asher · Atmospheric chemistry and physics · 610
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Estimation of heats of formation of organic compounds by additivity methods
1993 · N. Cohen, S. W. Benson · Chemical Reviews · 607
Vapor-liquid Equilibria Using Unifac: A Group-Contribution Method
2012 · Aage Fredenslund, Jürgen Gmehling, et al. · 533
Hansen solubility parameter as a tool to predict cocrystal formation
2011 · Mohammad Amin Mohammad, Amjad Alhalaweh, et al. · International Journal of Pharmaceutics · 530
Critical Properties, Normal Boiling Temperatures, and Acentric Factors of Fifty Ionic Liquids
2007 · J. O. Valderrama, P. A. Robles · Industrial & Engineering Chemistry Research · 520
Vapor-liquid equilibriums by UNIFAC group contribution. Revision and extension. 2
1982 · Juergen Gmehling, Peter Rasmussen, et al. · Industrial & Engineering Chemistry Process Design and Development · 505
Prediction of Hansen Solubility Parameters with a New Group-Contribution Method
2008 · Emmanuel Stefanis, Costas Panayiotou · International Journal of Thermophysics · 479
Estimation of Solvent Activities in Polymer Solutions Using a Group-Contribution Method
1978 · Takeru Oishi, John M. Prausnitz · Industrial & Engineering Chemistry Process Design and Development · 448
Estimation of Molecular Linear Free Energy Relation Descriptors Using a Group Contribution Approach
1999 · James A. Platts, Darko Butina, et al. · Journal of Chemical Information and Computer Sciences · 441
Works count: 4,243
Citation count: 117,600
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