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2009
1. I.A. Bitsanis, I.G. Economou and M. Yiannourakou, “Phase Equilibrium of Size-Dispersed Colloid Systems with Soft Pair Interactions: A Monte Carlo Study”, American Physical Society Meeting, Session Z10, Pittsburgh, Pennsylvania, USA (2009).
2. X. Krokidis, T. Spyriouni and I.G. Economou, “Predictive Models for Thermodynamic Properties and Phase Equilibria of Complex Fluid Mixtures Based on Molecular Theory, Molecular Simulations and Equations of State”, ACHEMA 2009, Frankfurt Am Main, Germany (2009).
3. Z.A. Makrodimitri and I.G. Economou, “Molecular Dynamics Simulation of Microscopic Structure and Physicochemical Properties of Elastomer Polymers”, 7th Greek Chemical Engineering Conference, Patras, Greece (2009).
4. I. Tsivintzelis, I.G. Economou and G.M. Kontogeorgis, “Modeling the Phase Behavior in Mixtures of Pharmaceuticals with Liquid or Supercritical Solvents”, 7th Greek Chemical Engineering Conference, Patras, Greece (2009).
5. I.A. Bitsanis, A.N. Rissanou, M. Yiannourakou and I.G. Economou, “Simulations of Temperature Induced Ageing and Crystallization in Dense Suspensions of Ultrasoft Colloids”, 7th Greek Chemical Engineering Conference, Patras, Greece (2009).
6. M. Yiannourakou, I.G. Economou and I.A. Bitsanis, “Analysis of Structure and Dynamics of Polydisperse Colloidal Systems”, 7th Greek Chemical Engineering Conference, Patras, Greece (2009).
7. N.M. Garrido, M. Jorge, A.J. Queimada, I.G. Economou and E.A. Macedo, “Molecular Simulation of the Hydration Free Energies of Substituted Barbiturates”, 24th European Symposium on Applied Thermodynamics, Santiago de Compostela, Spain (2009).
8. N.M. Garrido, A.J. Queimada, M. Jorge, E.A. Macedo and I.G. Economou, “1-Octanol / Water Partition Coefficients Based on Molecular Simulation of Absolute Solvation Energies”, 24th European Symposium on Applied Thermodynamics, Santiago de Compostela, Spain (2009).
9. R. Lundsgaard, G.M. Kontogeorgis, I.G. Economou and N.M. Garrido, “Modeling of Partition Coefficients of Additives in Polymer / Polymer and Polymer / Solvent Systems by Free Energy Calculations”, 24th European Symposium on Applied Thermodynamics, Santiago de Compostela, Spain (2009).
10. I.G. Economou, “Prediction of Thermodynamic and Transport Properties of Complex Fluid Mixtures Based on Molecular Simulation”, VIII Ibero-American Conference on Phase Equilibria and Fluid Properties for Process Design EQUIFASE 2009, Portugal (2009). Invited talk.
2008
1. I.G. Economou, “Molecular Design of Rubbery Polymers for Membrane Applications”, International Workshop on Molecular Modeling and Simulation in Applied Material Science, Frankfurt am Main, Germany (2008). Invited talk.
2. I.G. Economou, “Multi-Scale Modeling of Structure, Dynamic and Thermodynamic Properties of Ionic Liquids: Ab initio DFT Calculations, Molecular Simulation and Equation of State Predictions“, 11th European Meeting on Supercritical Fluids, Barcelona, Spain (2008). Invited talk.
3. I.G. Economou, “Molecular Simulation of Rubbery Polymer Membranes”, 23hd European Symposium on Applied Thermodynamics, Cannes, France (2008). Invited talk.
4. I.G. Economou, “Thermodynamic Properties and Phase Equilibria of Complex Fluid Mixtures: Equation of State Modeling”, Thermodynamic Colloquium, Erlangen, Germany (2008).
5. I.G. Economou and Z.A. Makrodimitri, “Atomistic Simulation of Poly(dimethyl siloxane): Structure, Thermodynamic and Diffusion Properties to Gases and n-Alkanes”, Centennial AIChE Annual Meeting, Session No 519, Philadelphia, Pennsylvania, USA (2008).
6. I.G. Economou, G.-E. Logotheti, J. Ramos and A. Vanin, “Ab Initio Calculations and Molecular Dynamics Simulations for [Imidazolium][Tf2N] Ionic Liquids: Microscopic Structure and Thermodynamic Properties”, Centennial AIChE Annual Meeting, Session No 182, Philadelphia, Pennsylvania, USA (2008).
7. P. Ahlstrom, K. Aim, R. Dohrn, R. Elliott, L. Fele-Zilnik, G. Jackson, J.-N. Jaubert, M.E. Rebello de A. Macedo, J. Pekka Pokki, K. Reczey, A. Victorov and I.G. Economou, “A Survey of Thermodynamics and Transport Properties in Chemical Engineering Education in Europe and the USA”, Centennial AIChE Annual Meeting, Session No 62, Philadelphia, Pennsylvania, USA (2008).
2007
1. Z.A. Makrodimitri and I.G. Economou, “Atomistic Simulation of Silicon-Containing Elastomers: Force Field Development, Structure and Thermodynamic Properties of Polymer Melt and Solubility of n-Alkanes, n-Perfluoroalkanes, Noble and Light Gases”, 11th International Conference on Properties & Phase Equilibria for Product and Process Design, Hersonissos, Crete, Greece (2007).
2. A.N. Rissanou, L.D. Peristeras and I.G. Economou, “Calculation of the Effect of Macromolecular Architecture on Structure and Thermodynamic Properties of Linear - Tri-arm Polyethylene Blends from Monte Carlo Simulation”, 11th International Conference on Properties & Phase Equilibria for Product and Process Design, Hersonissos, Crete, Greece (2007).
3. E.K. Karakatsani and I.G. Economou, “Prediction of Thermodynamic Properties and Phase Equilibria of Polar Multicomponent Mixtures from Perturbation Theory”, 11th International Conference on Properties & Phase Equilibria for Product and Process Design, Hersonissos, Crete, Greece (2007).
4. M.C. Kroon, E.K. Karakatsani, M. Montero, I.G. Economou, G.-J. Witkamp and C.J. Peters, “Experimental Measurements and Modeling using tPC-PSAFT of the Phase Behavior of the Ternary Ionic Liquid System CO2 + water + [bmim]NO3”, 11th International Conference on Properties & Phase Equilibria for Product and Process Design, Hersonissos, Crete, Greece (2007).
5. E. Tritopoulou and I.G. Economou, “Molecular Simulation of Thermodynamic Properties of Glycols in Pure State and in Aqueous Solutions”, 6th Greek Chemical Engineering Conference, Athens, Greece (2007).
6. M. Yiannourakou, I.G. Economou and I.A. Bitsanis, “Phase Equilibria of Polydisperse Colloidal Systems”, 6th Greek Chemical Engineering Conference, Athens, Greece (2007).
7. I.G. Economou, A. Grenner, I. Tsivintzelis, C. Panayiotou and G.M. Kontogeorgis, “Evaluation of Statistical Mechanics-Based Equations of State for Complex Fluid Mixtures”, 6th European Congress of Chemical Engineering, Copenhagen, Denmark (2007).
8. I.G. Economou, E.K. Karakatsani, M.C. Kroon, C.J. Peters and G.-J. Witkamp, “Modeling of Ionic Liquid Binary and Ternary Mixture Phase Equilibria at Low and High Pressure With the tPC-PSAFT”, 6th European Congress of Chemical Engineering, Copenhagen, Denmark (2007).
9. I.G. Economou, Z.A. Makrodimitri, A. Tihic and G.M. Kontogeorgis, “Molecular Simulation and Macroscopic Modeling of Thermodynamic and Transport Properties of Silicon-Containing Rubbery Polymer – Solvent Mixtures”, 6th European Congress of Chemical Engineering, Copenhagen, Denmark (2007).
10. H. Leontiadou and I.G. Economou, “Structure and Thermodynamic Properties of Poly(ethylene oxide) from Molecular Dynamics Simulations”, Thermodynamics 2007, Paris, France (2007).
11. G.-E. Logotheti, F.J. Ramos-Diaz and I.G. Economou, “Molecular Modelling of 1-n-hexyl-3-methylimidazolium bis(trifluoromethanesulfonyl)imide Ionic Liquid”, Thermodynamics 2007, Paris, France (2007).
12. Z.A. Makrodimitri and I.G. Economou, “Molecular Modeling of Polydimethylsiloxane Mixtures”, International Conference on Computational Methods in Science and Engineering 2007, Corfu, Greece (2007).
13. M. Yiannourakou, I.A. Bitsanis and I.G. Economou, “Phase Equilibrium of Colloid Systems with Particle Size Dispersity: A Molecular Dynamics Study”, International Conference on Computational Methods in Science and Engineering 2007, Corfu, Greece (2007).
2006
1. I.A. Bitsanis, A.N. Rissanou, D. Vlassopoulos and I.G. Economou, “Molecular Dynamics Studies of Temperature Induced Solidification in Suspensions of Multi-arm Star Polymers”, 3rd Annual European Rheology Conference, Hersonisos, Crete, Greece (2006).
2. I.G. Economou, A.N. Rissanou and L.D. Peristeras, “Molecular Simulation of Polymer Blends”, 22hd European Symposium on Applied Thermodynamics, Helsingor, Denmark (2006).
3. E.K. Karakatsani and I.G. Economou, “Rigorous Extension of SAFT-Based Equations of State to Polar Molecular Fluids and Their Mixtures”, 22hd European Symposium on Applied Thermodynamics, Helsingor, Denmark (2006).
4. M.C. Kroon, E.K. Karakatsani, I.G. Economou, G.-J. Witkamp and C.J. Peters, “Modeling of the Carbon Dioxide Solubility in Imidazolium-Based Ionic Liquids with the tPC-PSAFT Equation of State”, 22hd European Symposium on Applied Thermodynamics, Helsingor, Denmark (2006).
5. I. Tsivintzelis, T. Spyriouni and I.G. Economou, “Modeling of Phase Equilibria with Non Random Hydrogen Bonding (NRHB) and Statistical Associating Fluid (SAFT) Theories”, 22hd European Symposium on Applied Thermodynamics, Helsingor, Denmark (2006).
6. Z.A. Makrodimitri, V.E. Raptis and I.G. Economou, “Molecular Dynamics Simulation of Structure, Thermodynamic and Dynamic Properties of Poly(dimethylsilamethylene), Poly(dimethylsilatrime-thylene) and their Alternating Copolymer”, 22hd European Symposium on Applied Thermodynamics, Helsingor, Denmark (2006).
7. M.C. Kroon, E.K. Karakatsani, I.G. Economou, G.-J. Witkamp and C.J. Peters, “Modeling of the Carbon Dioxide Solubility in Imidazolium-Based Ionic Liquids with the tPC-PSAFT Equation of State”, 16th Symposium on Thermophysical Properties, Boulder, Colorado, USA (2006).
8. I.G. Economou, A.N. Rissanou, L.D. Peristeras and D.N. Theodorou, “Structure and Thermodynamic Properties of Linear - Tri-Arm Polyolefin Blends Based on Novel Atomistic Monte Carlo Simulation Schemes”, AIChE Annual Meeting, Session No 202, San Francisco, California, USA (2006).
9. I.G. Economou, M.C. Kroon, E. Karakatsani, C.J. Peters and G.-J. Witkamp, “Modeling Carbon Dioxide - Imidazolium-Based Ionic Liquid Phase Equilibria with the tPC-PSAFT Equation of State”, AIChE Annual Meeting, Session No 28, San Francisco, California, USA (2006).
10. I.G. Economou and E. Karakatsani, “Perturbation Thermodynamic Theory for Polar Fluids: Pure Components and Mixtures”, AIChE Annual Meeting, Session No 309, San Francisco, California, USA (2006).
11. I.G. Economou, Z.A. Makrodimitri and V.E. Raptis, “Molecular Dynamics Simulation of Structure, Thermodynamic, Dynamic and Hydrocarbon Permeability Properties of Silicon-Containing Elastomers with Promising Membrane Material Behavior”, AIChE Annual Meeting, Session No 437, San Francisco, California, USA (2006).
12. Z.A. Makrodimitri and I.G. Economou, “Atomistic Simulation of Silicon-Containing Polymers: Force Field Development, Structure and Thermodynamic Properties of Polymer Melts and Solubility of Organic Compounds”, 6th Hellenic Conference in Polymers, Patras, Greece (2006).
13. A.N. Rissanou, I.G. Economou and A.Z. Panagiotopoulos, “Monte Carlo Simulation of the Phase Behavior of Model Dendrimers”, 6th Hellenic Conference in Polymers, Patras, Greece (2006).
14. M. Yiannourakou, I.A. Bitsanis, A.N. Rissanou, I.G. Economou and D. Vlassopoulos, “Mesoscopic Simulations of T-Induced Solidification in Dense Suspensions of Ultrasoft Supramolecules”, 6th Hellenic Conference in Polymers, Patras, Greece (2006).
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