Publications
254 results found
Giner B, Bandres I, Lopez MC, et al., 2007, Phase equilibrium of liquid mixtures:: Experimental and modeled data using statistical associating fluid theory for potential of variable range approach, JOURNAL OF CHEMICAL PHYSICS, Vol: 127, ISSN: 0021-9606
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- Citations: 10
Giner B, Gascon I, Artigas H, et al., 2007, Phase equilibrium of binary mixtures of cyclic ethers plus chlorobutane isomers:: Experimental measurements and SAFT-VR modeling, JOURNAL OF PHYSICAL CHEMISTRY B, Vol: 111, Pages: 9588-9597, ISSN: 1520-6106
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- Citations: 18
Docherty H, Galindo A, Sanz E, et al., 2007, Investigation of the salting out of methane from aqueous electrolyte solutions using computer simulations, JOURNAL OF PHYSICAL CHEMISTRY B, Vol: 111, Pages: 8993-9000, ISSN: 1520-6106
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- Citations: 32
Giner B, Royo FM, Lafuente C, et al., 2007, Intermolecular potential model parameters for cyclic ethers and chloroalkanes in the SAFT-VR approach, FLUID PHASE EQUILIBRIA, Vol: 255, Pages: 200-206, ISSN: 0378-3812
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- Citations: 12
Pineiro MM, Galindo A, Parry AO, 2007, Surface ordering and capillary phenomena of confined hard cut-sphere particles, SOFT MATTER, Vol: 3, Pages: 768-778, ISSN: 1744-683X
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- Citations: 37
Keskes E, Adjiman CS, Galindo A, et al., 2006, A new physical absorption process for the capture of Co2 from Co2-rich natural gas streams, AIChE Annual Meeting, Conference Proceedings
The increasing importance of natural gas as a source of energy poses difficult gas separation design challenges, as the streams recovered from gas fields are at high pressures and can contain a high proportion of CO2. A new CO2/CH4 gas separation process is presented. Capture of CO2 from natural gas is carried out using an n-alkane solvent in a conventional physical absorption process. A methodology to find optimal process condition and solvent is developed using an advanced EOS, process modeling-optimization software, and detailed process cost estimation. Natural gas feeds containing ≤ 70% mole/mole of CO2 could be treated economically using this process. This is an abstract of a paper presented at the 2006 AIChE Annual Meeting (San Francisco, CA 11/12-17/2006).
Clark GNI, Haslam AJ, Galindo A, et al., 2006, Developing optimal Wertheim-like models of water for use in Statistical Associating Fluid Theory (SAFT) and related approaches, MOLECULAR PHYSICS, Vol: 104, Pages: 3561-3581, ISSN: 0026-8976
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- Citations: 153
Docherty H, Galindo A, 2006, A study of Wertheim's thermodynamic perturbation theory (TPT1) for associating fluids with dispersive interactions: the importance of the association range, 7th Liblice Conference on Statistical Mechanics of Liquids, Publisher: TAYLOR & FRANCIS LTD, Pages: 3551-3560, ISSN: 0026-8976
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- Citations: 11
Docherty H, Galindo A, Vega C, et al., 2006, A potential model for methane in water describing correctly the solubility of the gas and the properties of the methane hydrate, JOURNAL OF CHEMICAL PHYSICS, Vol: 125, ISSN: 0021-9606
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- Citations: 140
Haslam AJ, von Solms N, Adjiman CS, et al., 2006, Predicting enhanced absorption of light gases in polyethylene using simplified PC-SAFT and SAFT-VR, FLUID PHASE EQUILIBRIA, Vol: 243, Pages: 74-91, ISSN: 0378-3812
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- Citations: 32
Haslam AJ, Moen Ø, Adjiman CS, et al., 2006, Chapter 5 Design of polyolefin reactor mixtures, Vol: 22, Pages: 301-332, ISSN: 1570-7946
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- Citations: 1
Haslam AJ, Moen Ø, Adjiman CS, et al., 2006, Design of polyolefin reactor mixtures, Computer Aided Chemical Engineering; Multiscale Modelling of Polymer Properties, Editors: Laso, Perpète, Amsterdam, Publisher: Elsevier, Pages: 301-332, ISBN: 978-0-444-52187-3
Keskes E, Adjiman CS, Galindo A, et al., 2006, Integrating Advanced Thermodynamics and Process and Solvent Design for Gas Separation, 16TH EUROPEAN SYMPOSIUM ON COMPUTER AIDED PROCESS ENGINEERING AND 9TH INTERNATIONAL SYMPOSIUM ON PROCESS SYSTEMS ENGINEERING, Vol: 21, Pages: 743-748, ISSN: 1570-7946
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- Citations: 1
Sheldon TJ, Giner B, Adjiman CS, et al., 2006, The derivation of size parameters for the SAFT-VR equation of state from quantum mechanical calculations, MULTISCALE MODELLING OF POLYMER PROPERTIES, Vol: 22, Pages: 143-159, ISSN: 1570-7946
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- Citations: 8
Behzadi B, Patel BH, Galindo A, et al., 2005, Application of a SAFT-VR equation of state using MSA and a yukawa potential for VLE calculations of electrolyte solutions, 7th World Congress of Chemical Engineering, GLASGOW2005, incorporating the 5th European Congress of Chemical Engineering, Pages: 59-60
An EOS based on the statistical associating fluid theory generalized to include potentials of variable range was applied to pure associating solvents (water, n-propanol, i-propanol, n-butanol, and n-pentanol) and more commonly encountered electrolyte solutions containing the ions Li+, Na+, K+, Ca++, Br--, Cl-, I-, OH-, and NO 3-. The model incorporated the Yukawa attraction potential for segment-segment interactions between solvent segments and also for the segment-ion interactions, and the non-restricted mean-spherical approximation to account for the long-range interactions between ionic species. The resulting model could correlate VLE for the pure solvents and binary solvent/salt mixtures accurately, using a minimum number of regressed temperature and concentration-independent interaction energy, interaction range and size parameters, which have been obtained, in both salt-specific and ion-specific forms, using a global optimization procedure. This is an abstract of a paper presented at the 7th World Congress of Chemical Engineering (Glasgow, Scotland 7/10-14/2005).
Behzadi B, Ghotbi C, Galindo A, 2005, Application of the simplex simulated annealing technique to nonlinear parameter optimization for the SAFT-VR equation of state, CHEMICAL ENGINEERING SCIENCE, Vol: 60, Pages: 6607-6621, ISSN: 0009-2509
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- Citations: 24
del Río EM, Galindo A, de Miguel E, 2005, Density functional theory and simulation of the columnar phase of a system of parallel hard ellipsoids with attractive interactions -: art. no. 051707, PHYSICAL REVIEW E, Vol: 72, ISSN: 1539-3755
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- Citations: 16
Varga S, Purdy K, Galindo A, et al., 2005, Nematic-nematic phase separation in binary mixtures of thick and thin hard rods: Results from Onsager-like theories, PHYSICAL REVIEW E, Vol: 72, ISSN: 1539-3755
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- Citations: 36
Behzadi B, Patel BH, Galindo A, et al., 2005, Modeling electrolyte solutions with the SAFT-VR equation using Yukawa potentials and the mean-spherical approximation, FLUID PHASE EQUILIBRIA, Vol: 236, Pages: 241-255, ISSN: 0378-3812
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- Citations: 46
Purdy KR, Varga S, Galindo A, et al., 2005, Nematic phase transitions in mixtures of thin and thick colloidal rods, PHYSICAL REVIEW LETTERS, Vol: 94, ISSN: 0031-9007
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- Citations: 72
Patel BH, Docherty H, Varga S, et al., 2005, Generalized equation of state for square-well potentials of variable range, MOLECULAR PHYSICS, Vol: 103, Pages: 129-139, ISSN: 0026-8976
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- Citations: 61
Paricaud P, Galindo A, Jackson G, 2004, Modeling the cloud curves and the solubility of gases in amorphous and semicrystalline polyethylene with the SAFT-VR approach and flory theory of crystallization, INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH, Vol: 43, Pages: 6871-6889, ISSN: 0888-5885
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- Citations: 79
Colina CM, Galindo A, Blas FJ, et al., 2004, Phase behavior of carbon dioxide mixtures with <i>n</i>-alkanes and <i>n</i>-perfluoroalkanes, 15th Symposium on Thermophysical Properties, Publisher: ELSEVIER, Pages: 77-85, ISSN: 0378-3812
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- Citations: 45
Vega C, MacDowell LG, McBride C, et al., 2004, Molecular modeling of flexible molecules. Vapor-liquid and fluid-solid equilibria, 17th International Conference of Chemical Thermodynamics, Publisher: ELSEVIER, Pages: 37-51, ISSN: 0167-7322
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- Citations: 13
Galindo A, Vega C, Sanz E, et al., 2004, Computer simulation study of the global phase behavior of linear rigid Lennard-Jones chain molecules: Comparison with flexible models, JOURNAL OF CHEMICAL PHYSICS, Vol: 120, Pages: 3957-3968, ISSN: 0021-9606
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- Citations: 27
Kakhu AI, Apostolakou A, Giovanoglou A, et al., 2004, An integrated environment for the use of the SAFT-VR equation of state in process modelling, AIChE annual meeting, Austin, Texas, November 2004
Aguiar P, Adjiman CS, Galindo A, et al., 2004, Supported direct internal reforming solid oxide fuel cell to load changes, 14th European symposium on computer-aided process engineering, May 2004
Giovanoglou A, Adjiman CS, Galindo A, et al., 2004, Phase stability and equilibrium calculations in binary mixtures, AIChE annual meeting, Austin, Texas, November 2004
Giovanoglou A, Adjiman CS, Galindo A, et al., 2004, Towards robust and efficient phase equilibrium calculations in binary mixtures, Properties and phase equilibria for product and process design, Snowbird, Utah, May 2004
Blas FJ, Sanz E, Vega C, et al., 2003, Fluid-solid equilibria of flexible and linear rigid tangent chains from Wertheim's thermodynamic perturbation theory, JOURNAL OF CHEMICAL PHYSICS, Vol: 119, Pages: 10958-10971, ISSN: 0021-9606
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- Citations: 18
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