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Journal article
2020

A computational tool for parameter estimation in EoS: New methodologies and natural gas phase equilibria calculations

Abunahman, S. S., dos Santos, L. C., Tavares, F. W. & Kontogeorgis, G. M., 2020, In : Chemical Engineering Science. 215, 13 p., 115437.

Research output: Contribution to journalJournal articleResearchpeer-review

A group contribution-based prediction method for the electrical conductivity of ionic liquids

Chen, Y., Cai, Y., Thomsen, K., Kontogeorgis, G. M. & Woodley, J. M., 2020, In : Fluid Phase Equilibria. 509, 9 p., 112462.

Research output: Contribution to journalJournal articleResearchpeer-review

A model-based solvent selection and design framework for organic coating formulations

Jhamb, S. V., Liang, X., Dam-Johansen, K. & Kontogeorgis, G. M., 2020, In : Progress in Organic Coatings. 140, 9 p., 105471.

Research output: Contribution to journalJournal articleResearchpeer-review

A multi-layered view of chemical and biochemical engineering

Gani, R., Bałdyga, J., Biscans, B., Brunazzi, E., Charpentier, J-C., Drioli, E., Feise, H., Furlong, A., Geem, K. M. V., Hemptinne, J-C. D., Kate, A. J. B. T., Kontogeorgis, G. M., Manenti, F., Marin, G. B., Mansouri, S. S., Piccione, P. M., Povoa, A., Rodrigo, M. A., Sarup, B., Sorensen, E. & 2 others, Udugama, I. A. & Woodley, J. M., 2020, In : Chemical Engineering Research and Design. 155, p. 133-145

Research output: Contribution to journalJournal articleResearchpeer-review

A new study of associating inhomogeneous fluids with classical density functional theory

Camacho Vergara, E. L., Kontogeorgis, G. M. & Liang, X., 2020, (Accepted/In press) In : Molecular Physics.

Research output: Contribution to journalJournal articleResearchpeer-review

A review of computer-aided design of paints and coatings

Jhamb, S., Enekvist, M., Liang, X., Zhang, X., Dam-Johansen, K. & Kontogeorgis, G. M., 2020, In : Current Opinion in Chemical Engineering. 27, p. 107-120

Research output: Contribution to journalJournal articleResearchpeer-review

Computerbaseret design af organiske coatings

Jhamb, S., Liang, X., Dam-Johansen, K. & Kontogeorgis, G. M., 2020, In : Dansk Kemi. 101, 1, p. 12-14

Research output: Contribution to journalJournal articleCommunication

Open Access
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Cost optimization and flexibility analysis for the liquefaction of an associated natural gas stream

Eini, S., Kontogeorgis, G. M. & Rashtchian, D., 2020, In : Journal of Energy Resources Technology. 142, 6, 9 p., JERT-19-1723.

Research output: Contribution to journalJournal articleResearchpeer-review

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Equations of state in three centuries. Are we closer to arriving to a single model for all applications?

Kontogeorgis, G. M., Liang, X., Arya, A. & Tsivintzelis, I., 2020, In : Chemical Engineering Science: X. 7, 20 p., 100060.

Research output: Contribution to journalJournal articleResearchpeer-review

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Modeling systems relevant to the biodiesel production using the CPA equation of state. Part 2. Systems with supercritical CO2

Tsivintzelis, I., Ali, S. & Kontogeorgis, G. M., 2020, In : Fluid Phase Equilibria. 504, 11 p., 112337.

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, (Accepted/In press) In : AIChE Journal.

Research output: Contribution to journalJournal articleResearchpeer-review

2019

An integrated approach for the design of emulsified products

Kontogeorgis, G. M., Mattei, M., Ng, K. M. & Gani, R., 2019, In : A I Ch E Journal. 65, 1, p. 75-86

Research output: Contribution to journalJournal articleResearchpeer-review

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108 Downloads (Pure)

Comparison of two crossover procedures for describing thermodynamic behavior of normal alkanes from singular critical to regular classical regions

Jamali, A., Vinhal, A. P. C. M., Behnejad, H., Yan, W. & Kontogeorgis, G. M., 2019, In : Fluid Phase Equilibria. 495, p. 33-46

Research output: Contribution to journalJournal articleResearchpeer-review

Computer-aided design of ionic liquids for hybrid process schemes

Chen, Y., Koumaditi, E., Gani, R., Kontogeorgis, G. M. & Woodley, J. M., 2019, In : Computers and Chemical Engineering. 130, 17 p., 106556.

Research output: Contribution to journalJournal articleResearchpeer-review

Effect of the composition of biomass on the quality of syngas produced from thermochemical conversion based on thermochemical data prediction

Dai, B., Zhu, W., Mu, L., Guo, X., Qian, H., Liang, X. & Kontogeorgis, G. M., 2019, In : Energy and Fuels. 33, 6, p. 5253-5262

Research output: Contribution to journalJournal articleResearchpeer-review

Gas Adsorption and Interfacial Tension with Classical Density Functional Theory

Camacho Vergara, E. L., Kontogeorgis, G. M. & Liang, X., 2019, In : Industrial & Engineering Chemistry Research. 58, 14, p. 5650-5664

Research output: Contribution to journalJournal articleResearchpeer-review

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Group Contribution Based Estimation Method for Properties of Ionic Liquids

Chen, Y., Kontogeorgis, G. M. & Woodley, J. M., 2019, In : Industrial and Engineering Chemistry Research. 58, 10, p. 4277-4292

Research output: Contribution to journalJournal articleResearchpeer-review

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High-pressure densities of n-decane+o-xylene mixtures: Measurement and modelling

Kang, K., Zhu, S., Liang, X., Kontogeorgis, G. M. & Wang, X., 2019, In : Fluid Phase Equilibria. 498, p. 1-8

Research output: Contribution to journalJournal articleResearchpeer-review

Integrated ionic liquid and process design involving azeotropic separation processes

Chen, Y., Gani, R., Kontogeorgis, G. M. & Woodley, J. M., 2019, In : Chemical Engineering Science. 203, p. 402-414

Research output: Contribution to journalJournal articleResearchpeer-review

Modeling of Gas Solubility Using the Electrolyte Cubic Plus Association Equation of State

Sun, L., Kontogeorgis, G. M., von Solms, N. & Liang, X., 2019, In : Industrial and Engineering Chemistry Research. 58, 37, p. 17555-17567

Research output: Contribution to journalJournal articleResearchpeer-review

Modeling the phase behaviour of bitumen/n-alkane systems with the cubic plus association (CPA) equation of state

Zhang, Y., Arya, A., Kontogeorgis, G. & Yarranton, H., 2019, In : Fluid Phase Equilibria. 486, p. 119-138

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

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

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 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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18 Downloads (Pure)
2018
159 Downloads (Pure)

Application of COSMO-RS and UNIFAC for ionic liquids based gas separation

Liu, X., Zhou, T., Zhang, X., Zhang, S., Liang, X., Gani, R. & Kontogeorgis, G. M., 2018, In : Chemical Engineering Science. 192, p. 816-828

Research output: Contribution to journalJournal articleResearchpeer-review

eCPA: An ion-specific approach to parametrization

Schlaikjer, A., Thomsen, K. & Kontogeorgis, G. M., 2018, In : Fluid Phase Equilibria. 470, p. 176-187

Research output: Contribution to journalJournal articleResearchpeer-review

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120 Downloads (Pure)

Extensive Study of the Capabilities and Limitations of the CPA and sPC-SAFT Equations of State in Modeling a Wide Range of Acetic Acid Properties

Ribeiro, R. T. C. S., Alberton, A. L., Paredes, M. L. L., Kontogeorgis, G. M. & Liang, X., 2018, In : Industrial and Engineering Chemistry Research. 57, 16, p. 5690-5704

Research output: Contribution to journalJournal articleResearchpeer-review

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91 Downloads (Pure)

Hybrid Schemes for Intensified Chemical and Biochemical Process Alternatives

Garg, N., K.Tula, A., Eden, M. R., Kontogeorgis, G. M., Woodley, J. M. & Gani, R., 2018, In : Chemical engineering transactions. p. 517-522

Research output: Contribution to journalJournal articleResearchpeer-review

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7 Downloads (Pure)

Improvement of predictive tools for vapor-liquid equilibrium based on group contribution methods applied to lipid technology

Damaceno, D. S., Perederic, O. A., Ceriani, R., Kontogeorgis, G. M. & Gani, R., 2018, In : Fluid Phase Equilibria. 470, p. 249-258

Research output: Contribution to journalJournal articleResearchpeer-review

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Improvement of the PR-CPA equation of state for modelling of acid gases solubilities in aqueous alkanolamine solutions

Wang, T., El Ahmar, E., Coquelet, C. & Kontogeorgis, G. M., 2018, In : Fluid Phase Equilibria. 471, p. 74-87

Research output: Contribution to journalJournal articleResearchpeer-review

Modeling Hydrofluoroolefins with the Cubic Plus Association and Perturbed-Chain Statistical Associating Fluid Theory Equations of State

Kang, K., Wang, X., Kontogeorgis, G. M. & Liang, X., 2018, In : Industrial and Engineering Chemistry Research. 57, p. 17289–17300

Research output: Contribution to journalJournal articleResearchpeer-review

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40 Downloads (Pure)

Multicomponent Vapor–Liquid Equilibrium Measurement and Modeling of Ethylene Glycol, Water, and Natural Gas Mixtures at 6 and 12.5 MPa

Kruger, F. J., Kontogeorgis, G. M., Solbraa, E. & von Solms, N., 2018, In : Journal of Chemical and Engineering Data. 63, 9, p. 3628-3639

Research output: Contribution to journalJournal articleResearchpeer-review

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45 Downloads (Pure)

New association schemes for mono-ethylene glycol: Cubic-Plus-Association parameterization and uncertainty analysis

Kruger, F., Kontogeorgis, G. M. & von Solms, N., 2018, In : Fluid Phase Equilibria. 458, p. 211–233

Research output: Contribution to journalJournal articleResearchpeer-review

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28 Downloads (Pure)

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

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86 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

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53 Downloads (Pure)

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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1 Downloads (Pure)

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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115 Downloads (Pure)

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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5 Downloads (Pure)

Undersøiske fabrikker: Naturgasproduktion direkte fra havbunden

Kruger, F. J., Kontogeorgis, G. M., Solbraa, E. & von Solms, N., 2018, In : Dansk Kemi. 99, 7, p. 26-27

Research output: Contribution to journalJournal articleCommunication

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40 Downloads (Pure)
2017

Data Requirements and Modeling for Gas Hydrate-Related Mixtures and a Comparison of Two Association Models

Liang, X., Aloupis, G. & Kontogeorgis, G. M., 2017, In : Journal of Chemical and Engineering Data. 62, 9, p. 2592-2605

Research output: Contribution to journalJournal articleResearchpeer-review

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199 Downloads (Pure)

Dimerization of Carboxylic Acids: An Equation of State Approach

Tsivintzelis, I., Kontogeorgis, G. & Panayiotou, C., 2017, In : Journal of Physical Chemistry Part B: Condensed Matter, Materials, Surfaces, Interfaces & Biophysical. 121, 9, p. 2153-2163

Research output: Contribution to journalJournal articleResearchpeer-review

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939 Downloads (Pure)

Evaluation of equations of state for simultaneous representation of phase equilibrium and critical phenomena

Pinto Coelho Muniz Vinhal, A., Yan, W. & Kontogeorgis, G., 2017, In : Fluid Phase Equilibria. 437, p. 140-154

Research output: Contribution to journalJournal articleResearchpeer-review

Modeling of Asphaltene Precipitation from Crude Oil with the Cubic Plus Association Equation of State

Arya, A., Liang, X., von Solms, N. & Kontogeorgis, G., 2017, In : Energy and Fuels. 31, 2, p. 2063-2075

Research output: Contribution to journalJournal articleResearchpeer-review

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355 Downloads (Pure)