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Research Output

Journal article

Partition Coefficients of Organic Molecules in Squalane and Water/Ethanol Mixtures by Molecular Dynamics Simulations

Lundsgaard, R., Kontogeorgis, G. & Economou, I. G., 2011, In : Fluid Phase Equilibria. 306, 2, p. 162-170

Research output: Contribution to journalJournal articleResearchpeer-review

Phase equilibria modeling of methanol-containing systems with the CPA and sPC-SAFT equations of state

Tybjerg, P. C. V., Kontogeorgis, G., Michelsen, M. L. & Stenby, E. H., 2010, In : Fluid Phase Equilibria. 288, 1-2, p. 128-138

Research output: Contribution to journalJournal articleResearchpeer-review

Phase Equilibria of Mixtures Containing Glycol and n-Alkane: Experimental Study of Infinite Dilution Activity Coefficients and Modeling Using the Cubic-Plus-Association Equation of State

Afzal, W., Breil, M. P., Théveneau, P., Mohammadi, A. H., Kontogeorgis, G. & Richon, D., 2009, In : Industrial & Engineering Chemistry Research. 48, 24, p. 11202-11210

Research output: Contribution to journalJournal articleResearchpeer-review

Phase Equilibria of Mixtures Containing Organic Sulfur Species (OSS) and Water/Hydrocarbons: VLE Measurements and Modeling Using the Cubic-Plus-Association Equation of State

Awan, J., Tsivintzelis, I., Breil, M., Coquelet, C., Richon, D. & Kontogeorgis, G., 2010, In : Industrial & Engineering Chemistry Research. 49, 210, p. 12718-12725

Research output: Contribution to journalJournal articleResearchpeer-review

Phase Equilibria of Three Binary Mixtures: Methanethiol + Methane, Methanethiol + Nitrogen, and Methanethiol + Carbon Dioxide

Awan, J., Tsivintzelis, I., Coquelet, C. & Kontogeorgis, G., 2012, In : Journal of Chemical and Engineering Data. 57, p. 896-901

Research output: Contribution to journalJournal articleResearchpeer-review

Open Access
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449 Downloads (Pure)

Phase Equilibrium Measurements and Modeling of 1-Propanethiol+1-Butanethiol + CH4 in Methane Ternary System at 303, 336, and 368 K and Pressure Up to 9 MPa

Awan, J. A., Coquelet, C., Tsivintzelis, I. & Kontogeorgis, G., 2016, In : Journal of Chemical and Engineering Data. 61, 1, p. 41-44

Research output: Contribution to journalJournal articleResearchpeer-review

Open Access
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132 Downloads (Pure)

Phase equilibrium modelling for mixtures with acetic acid using an association equation of state

Muro Sunè, N., Kontogeorgis, G., von Solms, N. & Michelsen, M. L., 2008, In : Industrial & Engineering Chemistry Research. 47, 15, p. 5660-5668

Research output: Contribution to journalJournal articleResearchpeer-review

Phase equilibrium of North Sea oils with polar chemicals: Experiments and CPA modeling

Frost, M. G., Kontogeorgis, G. M., von Solms, N., Haugum, T. & Solbraa, E., 2016, In : Fluid Phase Equilibria. 424, p. 122–136

Research output: Contribution to journalJournal articleResearchpeer-review

Pitfalls of using the geometric-mean combining rule in the density gradient theory

Liang, X., Michelsen, M. L. & Kontogeorgis, G., 2016, In : Fluid Phase Equilibria. 415, p. 75-83

Research output: Contribution to journalJournal articleResearchpeer-review

Potential theory of adsorption for associating mixtures: possibilities and limitations

Bjørner, M. G., Shapiro, A. & Kontogeorgis, G., 2013, In : Industrial & Engineering Chemistry Research. 52, 7, p. 2672-2684

Research output: Contribution to journalJournal articleResearchpeer-review

Predicting enhanced absorption of light gases in polyethylene using simplified PC-SAFT and SAFT-VR

Haslam, A. J., von Solms, N., Adjiman, C. S., Galindo, A., Jackson, G., Paricaud, P., Michelsen, M. L. & Kontogeorgis, G., 2006, In : Fluid Phase Equilibria. 243, 1-2, p. 74-91

Research output: Contribution to journalJournal articleResearchpeer-review

Prediction and correlation of high-pressure gas solubility in polymers with simplified PC-SAFT

von Solms, N., Michelsen, M. L. & Kontogeorgis, G., 2005, In : Industrial & Engineering Chemistry Research. 44, 9, p. 3330-3335

Research output: Contribution to journalJournal articleResearchpeer-review

Prediction of Gas Injection Effect on Asphaltene Precipitation Onset Using the Cubic and Cubic-Plus-Association Equations of State

Arya, A., Liang, X., von Solms, N. & Kontogeorgis, G., 2017, In : Energy and Fuels. 31, 3, p. 3313-3328

Research output: Contribution to journalJournal articleResearchpeer-review

Open Access
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332 Downloads (Pure)

Prediction of Gas Solubilities in Elastomeric Polymers for the Design of Thermopane Windows

Thorlaksen, P., Abildskov, J. & Kontogeorgis, G., 2002, In : Fluid Phase Equilibria. 211, 1, p. 17-33

Research output: Contribution to journalJournal articleResearchpeer-review

Prediction of Liquid-Liquid Equilibrium for Binary Polymer Solutions with Simple Activity Coefficient Models

Kontogeorgis, G. M., Saraiva, A., Fredenslund, A. & Tassios, D. P., 1995, In : Industrial and Engineering Chemistry Research. 34, 5, p. 1823-1834

Research output: Contribution to journalJournal articleResearchpeer-review

Prediction of micelle formation for aqueous polyoxyethylene alcohol solutions with the UNIFAC model

Cheng, H., Kontogeorgis, G. & Stenby, E. H., 2002, In : Industrial & Engineering Chemistry Research. 41, 5, p. 892-898

Research output: Contribution to journalJournal articleResearchpeer-review

Prediction of Solid-Gas Equilibria with the Peng-Robinson Equation of State

Coutsikos, P., Magoulas, K. & Kontogeorgis, G., 2003, In : Journal of Supercritical Fluids. 25, 3, p. 197-212

Research output: Contribution to journalJournal articleResearchpeer-review

Preparation and structural characterisation of novel and versatile amphiphilic octenyl succinic anhydride-modified hyaluronic acid derivatives

Eenschooten, C. D., Guillaumie, F., Kontogeorgis, G., Stenby, E. H. & Schwach-Abdellaoui, K., 2010, In : Carbohydrate Polymers. 79, 3, p. 597-605

Research output: Contribution to journalJournal articleResearchpeer-review

Process analysis of shea butter solvent fractionation using a generic systematic approach

A. Perederic, O., Mansouri, S. S., Appel, S., Sarup, B., Gani, R., Woodley, J. M. & Kontogeorgis, G., 2020, In : Industrial & Engineering Chemistry Research. 59, 19, p. 9152-9164

Research output: Contribution to journalJournal articleResearchpeer-review

Process Design of Industrial Triethylene Glycol Processes Using the Cubic-Plus-Association (CPA) Equation of State

Arya, A., Maribo-Mogensen, B., Tsivintzelis, I. & Kontogeorgis, G. M., 2014, In : Industrial & Engineering Chemistry Research. 53, 29, p. 11766-11778

Research output: Contribution to journalJournal articleResearchpeer-review

Process engineering versus product engineering - A case study on volatile organic compounds removal

Coutinho, J. A. P., Vilela, T., Pereira, P., Santos, M. M. M. & Kontogeorgis, G., 2005, In : Chemical Engineering Research & Design. 83, A4, p. 1-5

Research output: Contribution to journalJournal articleResearchpeer-review

PρT measurements and modelling of (n-decane + m-xylene) mixtures from 293.15 K to 363.15 K at pressures up to 60 MPa

Kang, K., Liang, X., Kontogeorgis, G. M. & Wang, X., 2019, In : Journal of Chemical Thermodynamics. 135, p. 107-115

Research output: Contribution to journalJournal articleResearchpeer-review

Re: A.H. Mohammadi and D. Richon on "Data and prediction of water content of high pressure nitrogen, methane and natural gas" [Fluid Phase Equililbria 252 (2007) 162-174]

Folas, G., Froyna, E. W., Lovland, J., Kontogeorgis, G. & Solbraa, E., 2007, In : Fluid Phase Equilibria. 255, 1, p. 98-98

Research output: Contribution to journalJournal articleResearchpeer-review

Recent advances with association models for practical applications

Tsivintzelis, I., Bjørner, M. G. & Kontogeorgis, G. M., 2018, In : Molecular Physics. 116, 15-16, p. 1921-1944

Research output: Contribution to journalJournal articleResearchpeer-review

Open Access
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143 Downloads (Pure)

Selective oxidation of benzyl alcohol in dense CO2: Insight by phase behavior modeling

Beier, M. J., Grunwaldt, J-D., Tsivintzelis, I., Jensen, A. D., Kontogeorgis, G. M. & Baiker, A., 2012, In : Journal of Supercritical Fluids. 63, p. 199-207

Research output: Contribution to journalJournal articleResearchpeer-review

Simple activity coefficient model for the prediction of solvent activities in polymer solutions

Kontogeorgis, G. M., Fredenslund, A. & Tassios, D. P., 1993, In : Industrial and Engineering Chemistry Research. 32, 2, p. 362-372

Research output: Contribution to journalJournal articleResearchpeer-review

Simulation and evaluation of utilization pathways of biomasses based on thermodynamic data prediction

Qian, H., Chen, W., Zhu, W., Liu, C., Lu, X., Guo, X., Huang, D., Liang, X. & Kontogeorgis, G. M., 2019, In : Energy. 173, p. 610-625

Research output: Contribution to journalJournal articleResearchpeer-review

Simultaneous Description of Activity Coefficients and Solubility with eCPA

Schlaikjer, A., Thomsen, K. & Kontogeorgis, G., 2017, In : Industrial and Engineering Chemistry Research. 56, 4, p. 1074-1089

Research output: Contribution to journalJournal articleResearchpeer-review

Open Access
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473 Downloads (Pure)

Solubility of syngas components in water acetic acid and alcohol using new standard fugacity methodology

Torli, M., Geer, L., Kontogeorgis, G. M. & Fosbøl, P. L., 2018, In : Industrial and Engineering Chemistry Research. 57, p. 16958–16977

Research output: Contribution to journalJournal articleResearchpeer-review

Open Access
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111 Downloads (Pure)

Solvation phenomena in association theories with applications to oil & gas and chemical industries

Kontogeorgis, G., Folas, G., Muro Sunè, N., Roca Leon, F. & Michelsen, M. L., 2008, In : Oil & Gas Science & Technology. 63, 3, p. 305-319

Research output: Contribution to journalJournal articleResearchpeer-review

Structure Optimization of Tailored Ionic Liquids and Process Simulation for Shale Gas Separation

Liu, X., Chen, Y., Zeng, S., Zhang, X., Zhang, S., Liang, X., Gani, R. & Kontogeorgis, G. M., 2020, In : AIChE Journal. 66, 2, e16794.

Research output: Contribution to journalJournal articleResearchpeer-review

Sustainable solutions by integrating process synthesis-intensification

Garg, N., Woodley, J. M., Gani, R. & Kontogeorgis, G. M., 2019, In : Computers & Chemical Engineering. 126, p. 499–519

Research output: Contribution to journalJournal articleResearchpeer-review

Systematic identification method for data analysis and phase equilibria modelling for lipids systems

Perederic, O. A., Cunico, L. P., Kalakul, S., Sarup, B., Woodley, J. M., Kontogeorgis, G. M. & Gani, R., 2018, In : Journal of Chemical Thermodynamics. 121, p. 153-169

Research output: Contribution to journalJournal articleResearchpeer-review

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Systematic Model-Based Methodology for Substitution of Hazardous Chemicals

Jhamb, S., Liang, X., Gani, R. & Kontogeorgis, G. M., 2019, In : ACS Sustainable Chemistry & Engineering. 7, 8, p. 7652-7666

Research output: Contribution to journalJournal articleResearchpeer-review

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Taking Another Look at the van der Waals Equation of State – Almost 150 Years Later

Kontogeorgis, G. M., Privat, R. & Jaubert, J-N., 2019, In : Journal of Chemical and Engineering Data. 64, 11, p. 4619-4637 19 p.

Research output: Contribution to journalJournal articleResearchpeer-review

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Ten years with the CPA (Cubic-Plus-Association) equation of state. Part 1. Pure compounds and self-associating systems

Kontogeorgis, G., Michelsen, M. L., Folas, G., Derawi, S., von Solms, N. & Stenby, E. H., 2006, In : Industrial & Engineering Chemistry Research. 45, 14, p. 4855-4868

Research output: Contribution to journalJournal articleResearchpeer-review

Ten years with the CPA (Cubic-Plus-Association) equation of state. Part 2. Cross-associating and multicomponent systems

Kontogeorgis, G., Michelsen, M. L., Folas, G., Derawi, S., von Solms, N. & Stenby, E. H., 2006, In : Industrial & Engineering Chemistry Research. 45, 14, p. 4869-4878

Research output: Contribution to journalJournal articleResearchpeer-review

Termodynamiske modeler for produktionskemikaliers egenskaber

Derawi, S., Michelsen, M. L., Kontogeorgis, G. & Stenby, E. H., 2003, In : Dansk Kemi. 84, p. 15-17

Research output: Contribution to journalJournal articleCommunication

Ternary Vapor–Liquid Equilibrium Measurements and Modeling of Ethylene Glycol (1) + Water (2) + Methane (3) Systems at 6 and 12.5 MPa

Kruger, F. J., Danielsen, M. V., Kontogeorgis, G. M., Solbraa, E. & von Solms, N., 2018, In : Journal of Chemical and Engineering Data. 63, 5, p. 1789-1796 8 p.

Research output: Contribution to journalJournal articleResearchpeer-review

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The Debye-Hückel theory and its importance in modeling electrolyte solutions

Kontogeorgis, G. M., Maribo-Mogensen, B. & Thomsen, K., 2018, In : Fluid Phase Equilibria. 462, p. 130-152

Research output: Contribution to journalJournal articleResearchpeer-review

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Thermodynamic modeling of acidic gas solubility in aqueous solutions of MEA, MDEA and MEA-MDEA blends

Vrachnos, A., Kontogeorgis, G. & Voutsas, EC., 2006, In : Industrial & Engineering Chemistry Research. 45, 14, p. 5148-5154

Research output: Contribution to journalJournal articleResearchpeer-review

Thermodynamic Modeling of Natural Gas Systems Containing Water

Karakatsani, E. K. & Kontogeorgis, G. M., 2013, In : Industrial & Engineering Chemistry Research. 52, 9, p. 3499-3513

Research output: Contribution to journalJournal articleResearchpeer-review

Thermodynamics of Paint Related Systems with Engineering Models

Lindvig, T., Michelsen, M. L. & Kontogeorgis, G., 2001, In : A I Ch E Journal. 47, 11, p. 2573-2584

Research output: Contribution to journalJournal articleResearchpeer-review

Thermodynamics of Triethylene Glycol and Tetraethylene Glycol Containing Systems Described by the Cubic-Plus-Association Equation of State

Breil, M. P. & Kontogeorgis, G., 2009, In : Industrial & Engineering Chemistry Research. 48, 11, p. 5472-5480

Research output: Contribution to journalJournal articleResearchpeer-review

The role of monomer fraction data in association theories—Can we improve the performance for phase equilibrium calculations?

Tsivintzelis, I., Bøgh, D., Karakatsani, E. & Kontogeorgis, G., 2014, In : Fluid Phase Equilibria. 365, p. 112-122

Research output: Contribution to journalJournal articleResearchpeer-review

Thirty Years with EoS/GE Models - What Have We Learned?

Kontogeorgis, G. M. & Coutsikos, P., 2012, In : Industrial & Engineering Chemistry Research. 51, 11, p. 4119-4142

Research output: Contribution to journalJournal articleResearchpeer-review

Open Access
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Towards Predictive Association Theories

Kontogeorgis, G., Tsivintzelis, I., Michelsen, M. L. & Stenby, E. H., 2011, In : Fluid Phase Equilibria. 301, 2, p. 244-256

Research output: Contribution to journalJournal articleResearchpeer-review