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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE ESCAPE26 12–15 June 2016 Grand Hotel Bernardin, Portorož, Slovenia Technical Program

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Page 1: Technical Program - escape26.um.siescape26.um.si/wp-content/uploads/2016/06/ESCAPE26_Program_Fi…ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016

ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

ESCAPE2612–15 June 2016

Grand Hotel Bernardin, Portorož, Slovenia

Technical Program

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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

ESCAPE2612–15 June 2016

Grand Hotel Bernardin, Portorož, Slovenia

Technical Program

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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

Welcome It is a great honor to organize and chair the 26th European Symposium on Computer Aided Process Engineering (ESCAPE 26) held in Portorož, Slovenia from the 12th to 15th of June 2016. We welcome you to this prominent symposium dedicated to Computer Aided Process Engineering (CAPE) and Process Systems Engineering. The ESCAPE 26 focuses on themes: Process-product Synthesis, Design and Integration; Modelling, Numerical Analysis, Simulation and Optimization; Process Operations and Control; Green Bioprocess Engineering and Advances in Biomedical Engineering; CAPE/PSE in Environmental Engineering; CAPE/PSE in Sustainable Energy Applications; CAPE Applications; and Education in CAPE/PSE. Out of 406 contributions, prepared by authors from 47 countries (Europe, the Americas, Africa, Asia and Australia), the ESCAPE 26 International Scientific Committee selected 176 oral presentations, 7 being plenary lectures, 18 keynote lectures, and 230 poster presentations. We beleive that your contributions to the conference will serve as a reference and motivate new ideas, developments and collaborations in the field of computer aided process engineering and beyond. We wish you all to enjoy the conference and nice stay in Portorož. Zdravko Kravanja Miloš Bogataj Conference Chair Conference Secretary

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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

International Scientific Committee Conference Chair Zdravko Kravanja, University of Maribor, Slovenia Themes Coordinators Process-product Synthesis, Design and Integration Mariano Martin, University of Salamanca, Spain Modelling, Numerical analysis, Simulation and Optimization Stratos Pistikopoulos, Texas A&M University, USA Process Operations and Control Sebastian Engell, TU Dortmund University, Germany Green Bioprocess Engineering and Advances in Biomedical Engineering David Bogle, University College London, UK CAPE/PSE in Environmental Engineering André Bardow, RWTH Aachen University, Germany CAPE/PSE in Sustainable Energy Applications Petar Varbanov, Pázmány Péter Catholic University, Hungary CAPE Applications Flavio Manenti, Politecnico di Milano, Italy Education in CAPE/PSE Antonio Espuña, Universitat Politecnica de Catalunya, Spain Members Mariano Martin, University of Salamanca, Spain Thomas Adams, McMaster University, Canada Mario Eden, Auburn University, USA Fengqi You, Northwestern University, USA Michael Fairweather, University of Leeds, UK Antonis Kokossis, National Technical University of Athens, Greece Rafiqul Gani, Technical University of Denmark, Denmark Andrzej Kraslawski, Lappeenranta University of Technology, Finland Jose Caballero, University of Alicante, Spain Gonzalo Guillén-Gosalbez, The University of Manchester, UK Stratos Pistikopoulos, Texas A&M University, USA Marianthi Ierapetritou, Rutgers University, USA Andreja Nemet, University of Maribor, Slovenia Ruth Misener, Imperial College London, UK Alexander Mitsos, RWTH Aachen University, Germany Michael Georgiadis, Aristotle University of Thessaloniki, Greece Lazaros Papageorgiou, University College London, UK Vivek Dua, University College London, UK Chrysanthos Gounaris, Carnegie Mellon University, USA Pei Liu, Tsinghua University, China Benoit Chachuat, Imperial College London, UK Carl Laird, Purdue University, USA Nikolaos Sahinidis, Carnegie Mellon University, USA Hermann Feise, BASF, Germany Davide Manca, Politecnico di Milano, Italy Moisès Graells, Universitat Politècnica de Catalunya, Spain Sebastian Engell, TU Dortmund University, Germany

Ana Barbosa-Póvoa, Técnico Lisboa, Portugal Luis Puigjaner, Universitat Politecnica de Catalunya, Spain Gintaras Reklaitis, Purdue University, USA Sigurd Skogestad, Norwegian University of Science and technology, Norway David Bogle, University College London, UK Paul Agachi, Kazakh British Technical University, Kazakhstan Andreas Linninger, University of Illinois at Chicago, USA Ioannis Androulakis, Rutgers University, USA Costas Kiparissides, Aristotle University of Thessaloniki, Greece Francois Marechal, École polytechnique fédérale de Lausanne, France Tony Kiss, AkzoNobel, The Netherlands Filip Logist, University of Leuven, Belgium Michael Narodoslawsky, Graz University of Technology, Austria André Bardow, RWTH Aachen University, Germany Jiří Klemeš, Pázmány Péter Catholic University, Hungary Peter Mizsey, Budapest University of Technology and Economics, Hungary Fabrizio Bezzo, University of Padova, Italy Ferenc Friedler, University of Pannonia, Hungary Niall Mac Dowell, Imperial College London, UK Petar Varbanov, Pázmány Péter Catholic University, Hungary Hon Loong Lam, The University of Nottingham Malaysia Campus, Malaysia Zainuddin A. Manan, University of Technology, Malaysia Sharifah Rafidah Wan Alwi, University of Technology, Malaysia

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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

Raymond Girard R. Tan, De la Salle University, Philippines Petro Kapustenko, Kharkiv Polytechnic Institute, Ukraine Igor Bulatov, The University of Manchester, UK Panos Seferlis, Aristotle University of Thessaloniki, Greece Sakis Papadopoulos, Centre for Research and Technology Hellas, Greece Tomislav Novosel, University of Zagreb, Croatia Franjo Cecelja, University of Surrey, UK Hella Tokos, University of Surrey, UK Niyi Isafiade, University of Cape Town, South Africa Michael Walmsley, The University of Waikato, New Zealand Flavio Manenti, Politecnico di Milano, Italy Tilman Barz, Austrian Institute of Technology, Austria Mattia Vallerio, University of Leuven, Belgium Guido Buzzi-Ferraris, Politecnico di Milano, Italy Massimiliano Barolo, The University of Padova, Italy Soledad Diaz, Planta Piloto de Ingeneria Quimica, Argentina Christos Maravelias, University of Wisconsin, USA Alessio Frassoldati, Politecnico di Milano, Italy Chi Wai Hui, The Hong Kong University of Science and Technology, China Rubens Maciel Filho, University of Campinas, Brazil Antonio Espuña, Universitat Politecnica de Catalunya, Spain Il Moon, Yonsei University, South Korea Henrique Matos, Técnico Lisboa, Portugal Zorka Novak Pintarič, University of Maribor, Slovenia Emilia Kondili, Technological Education Institute of Piraeus, Greece

Valentin Plesu, Polytechnic University of Bucharest, Romania Iqbal Mujtaba, University of Bradford, UK Elvis Ahmetović, University of Tuzla, Bosnia and Herzegovina Dimitrios Gerogiorgis, The University of Edinburgh, UK Lidija Čuček, University of Maribor, Slovenia Alexandra Elena Bonet-Ruiz, Polytechnic University of Bucharest, Romania Jordi Bonet-Ruiz, University of Barcelona, Spain Ignacio Grossmann, Carnegie Mellon University, USA Iiro Harjunkoski, ABB Corporate Research, Germany Lorenz Biegler, Carnegie Mellon University, USA Pedro Castro, University of Lisbon, Portugal Carlos Mendez, National University of Litoral, Argentina Cesar de Prada, University of Valladolid, Spain Ton Backx, Eindhoven University of Technology, Netherlands Claudio Scali, University of Pisa, Italy Rajagopalan Srinivasan, Indian Institute of Technology Gandhinagar, India Nilay Shah, Imperial College London, UK Peter Singstad, Cybernetica AS, Norway Stefan Kraemer, TU Dortmund University, Germany Igor Plazl, University of Ljubljana, Slovenia Xavier Joulia, ENSIACET, France Jean-Marc Le Lann, ENSIACET, France Jan Thullie, Silesian University of Technology, Poland Luis Cisternas, University of Antofagasta, Chile Sauro Pierucci, Politecnico di Milano, Italy Vladimir Mahalec, McMaster University, Canada

Local Organising Committee Chairman Zdravko Kravanja, University of Maribor, Slovenia Conference Secretary Miloš Bogataj, University of Maribor, Slovenia Members Igor Plazl, University of Ljubljana, Slovenia Neven Duić, University of Zagreb, Croatia Zorka Novak Pintarič, University of Maribor, Slovenia Mojca Slemnik, University of Maribor, Slovenia Andreja Nemet, University of Maribor, Slovenia Lidija Čuček, University of Maribor, Slovenia

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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

Overview 1

Grand Hotel Bernardin - Congress Center

Nearby Hotels

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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

Overview 2

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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

Overview 3

TECHNICAL PROGRAM: Overview

Sunday, 12th June 10:00 - 12:30 CAPE WP Business Meeting 12:30 - 13:30 CAPE WP Lunch Break 13:30 - 17:00 CAPE WP Business Meeting REGISTRATION OPENS at 14:00 GET TOGETHER PARTY at 18:00 Monday, 13th June

Parallel Sessions A Parallel Sessions B Parallel Sessions C Parallel Sessions D Parallel Sessions E 08:30 - 08:50 OPENING CEREMONY

08:50 - 09:35 PLENARY LECTURE (Prof. Jirí Jaromír Klemeš)

09:35 - 10:20 PLENARY LECTURE (Prof. Ana Paula Barbosa-Póvoa)

10:20 - 10:45 COFFEE BREAK

10:45 - 11:30 PLENARY LECTURE (Prof. Nick Sahinidis)

11:30 - 11:50 EFCE Excellence Award in Recognition of an Outstanding PhD Thesis on CAPE 2016 - Presentation

11:50 - 12:00 BREAK (10 min)

12:00 - 12:20

THEME 1: Keynote lecture 1.1

THEME 2: Oral presentations

THEME 3: Oral presentations

THEME 4: Oral presentations

THEME 7: Oral presentations

12:20 - 12:40

THEME 1: Oral Presentations

THEME 2: Keynote lecture 2.1

12:40 - 13:00

THEME 2: Oral presentations

THEME 3: Keynote lecture 3.1

13:00 - 14:30 LUNCH BREAK

14:30 - 14:50

THEME 1: Oral Presentations

THEME 2: Oral presentations

THEME 3: Oral presentations

THEME 4: Keynote lecture 4.1

THEME 7: Oral presentations

14:50 - 15:10

THEME 4: Keynote lecture 4.2

15:10 - 15:30

THEME 4: Oral presentations

15:30 - 15:50

THEME 7: Keynote lecture 7.1

15:50 - 16:10

THEME 7: Keynote lecture 7.2

16:10 - 16:50

THEME 7: Oral presentations

16:50 - 18:20 POSTER SESSION / COFFEE BREAK

Meetings (Monday, 13th June, 2016) 13:00 -14:30 EURECHA & CACE Business Meeting (Hall Adria)

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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

Overview 4

Tuesday, 14th June Parallel Sessions

A Parallel Sessions

B Parallel Sessions

C Parallel Sessions

D Parallel Sessions

E 08:30 - 09:10

THEME 1: Oral Presentations

THEME 2: Oral presentations

THEME 3: Oral presentations

THEME 6: Oral Presentations

THEME 8: Oral presentations

09:10 - 09:30

THEME 8: Keynote lecture 8.1

09:30 - 09:50

THEME 8: Keynote lecture 8.2

09:50 - 10:10

THEME 8: Oral presentations

10:10 - 10:30

THEME 6: Keynote lecture 6.1

10:30 - 11:00 COFFEE BREAK

11:00 - 11:45 PLENARY LECTURE (Prof. Adisa Azapagic)

11:45 - 12:30 PLENARY LECTURE (Dr. Hermann Feise)

12:30 - 14:00 LUNCH BREAK

14:00 - 14:20

THEME 1: Keynote lecture 1.2

THEME 2: Oral Presentations

THEME 3: Oral presentations

THEME 6: Oral Presentations

THEME 5: Oral presentations

14:20 - 14:40

THEME 1: Oral Presentations

THEME2: Keynote Lecture 2.2

14:40 - 15:00

THEME 2: Oral Presentations

THEME 3: Keynote lecture 3.1

15:00 - 15:20

THEME 3: Oral presentations

THEME 6: Keynote lecture 6.2

15:20 - 15:40

THEME 6: Oral Presentations

THEME 5: Keynote lecture 5.1

15:40 - 16:00

THEME 5: Keynote lecture 5.2

16:00 - 17:30 POSTER SESSION / COFFEE BREAK

Parallel Sessions A

Parallel Sessions B

Parallel Sessions C

Parallel Sessions D

17:30 - 17:50

THEME 1: Oral Presentations

THEME 2: Oral Presentations

THEME 3: Keynote lecture 3.3

THEME 6: Oral Presentations

17:50 - 18:30

THEME 3: Oral presentations

18:30 - 18:50

18:50 - 19:30

19:30 - GALA DINNER (St. Bernardin Square)

Meetings (Tuesday, 14th June, 2016) 12:30 -14:00 Advisory Board Meeting of Computers & Chemical Engineering (Hall Adria) 16:30 -17:30 Meeting of the IPC for the PSE-2018 (Hall Adria)

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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

Overview 5

Wednesday, 15th June Parallel Sessions A Parallel Sessions B Parallel Sessions C Parallel Sessions D 08:30 - 10:30

THEME 1: Oral Presentations

THEME 2: Oral Presentations

THEME 1: Oral Presentations

THEME 7: Oral presentations

10:30 - 11:00 COFFEE BREAK

11:00 - 11:20

THEME 1: Keynote lecture 1.3

THEME 2: Oral Presentations

THEME 1: Oral Presentations

THEME 7: Oral presentations

11:20 - 13:00

THEME 1: Oral Presentations

THEME 2: Oral Presentations

13:00 - 14:30 LUNCH BREAK

14:30 - 15:15 PLENARY LECTURE (Prof. Jean-Marc Le Lann)

15:15 - 16:00 PLENARY LECTURE (Prof. Rafiqul Gani)

16:00 - 16:15

Presentation of ESCAPE 27 Farewell

Workshop (Wednesday, 15th June, 2016) 8:30-10:30 ProcessBuilder workshop – Advanced process modelling and flowsheeting (Hall Adria)

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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

Overview 6

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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

ESCAPE26 Detailed Technical Program

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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

Sunday 12th 9

Sunday, 12th 10:00 to 12:30 CAPE WP Business Meeting (Hall Adria) 12:30 to 13:30 CAPE WP Lunch Break (Sunset Restaurant) 13:30 to 17:00 CAPE WP Business Meeting (Hall Adria) REGISTRATION OPENS at 14:00 (Hotel Lobby) GET TOGETHER PARTY at 18:00 (Grand Café and Piano Bar & Grand Garden Covered Terrace)

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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

Sunday 12th 10

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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

Monday 13th 11

Monday, 13th

08:30 to 08:50 Opening Ceremony (EVROPA - A+C) Prof. Rafiqul Gani, President of EFCE Prof. Jean-Marc Le Lann, Vice-President of EFCE Prof. Jiří Jaromír Klemeš, CAPE WP Prof. Slavko Kaučič, President of Slovenian Chemical Society Prof. Zdravko Kravanja, Chair

08:50 to 09:35 Plenary Lecture 1 (EVROPA - A+C)

Chaired by Prof. Ignacio Grossmann. Process Integration: Pinch Analysis and Mathematical Programming - Directions for Future Development Jiří Jaromír Klemeš, Petar Varbanov, Pázmány Péter Catholic University , Hungary

09:35 to 10:20 Plenary Lecture 2 (EVROPA - A+C) Chaired by Prof. Efstratios N. Pistikopoulos. Challenges and Opportunities in Sustainable Supply Chains Ana Paula Barbosa-Póvoa, Instituto Superior Técnico, Portugal

10:20 to 10:45 Coffee break (EVROPA foyer)

10:45 to 11:30 Plenary Lecture 3 (EVROPA - A+C) Chaired by Prof. Rafiqul Gani. The ALAMO approach to machine learning Nick Sahinidis, Carnegie Mellon University, United States of America

11:30 to 11:50 EFCE Excellence Award in Recognition of an Outstanding PhD Thesis on CAPE 2016- Presentation (EVROPA - A+C) Chaired by Prof. Rafiqul Gani, Prof. Jiří Jaromír Klemeš.

11:50 to 12:00 Break (EVROPA foyer & EMERALD foyer)

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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

Monday 13th 12

Parallel Session A, Theme 1: Oral Presentations Monday, 13th,12:00 to 13:00 Chaired by Prof. Fengqi You, Ass. Prof. Mariano Martin. In room EVROPA - A+C

12:00 KEYNOTE: Production of Benzene, Toluene, and the Xylenes from Natural Gas via Methanol

480

Alexander Niziolek, Onur Onel, Christodoulos Floudas 12:20 Novel process for direct conversion of CO2 to dimethyl carbonate using catalytic

membrane reactors 330

Rik Kuenen, Harro Mengers, Louis van der Ham, Tony Kiss 12:40 Optimization of a sour water stripping plant using surrogate models 10

Natalia Quirante, Jose A. Caballero 13:00 to 14:30 Lunch (Sunset Restaurant) 13:00 to 14:30 EURECHA & CACE Business Meeting (Hall Adria) Parallel Session A, Theme 1: Oral Presentations Monday, 13th, 14:30 to 16:50 Chaired by Dr. Thomas Adams II, Prof. Mario R. Eden. In room EVROPA - A+C

14:30 Enhanced Production of Methanol from switchgrass: CO2 to methanol 14 Mariano Martin, Ignacio E. Grossmann

14:50 A feasibility-based algorithm for Computer Aided Molecular and Process Design of solvent-based separation systems

28

Smitha Gopinath, Amparo Galindo, George Jackson, Claire Adjiman 15:10 Techno-economic analysis of the production of epiclorhydrin from glycerol 15

Alberto Almena, Mariano Martin 15:30 Economic risk-based analysis: Effect of technical and market price uncertainties on the

production of glycerol-based isobutanol 107

Gürkan Sin, Carina L. Gargalo, Krist V. Gernaey 15:50 Dynamic Behavior Of A Multi-Tasking Reactive Distillation Column For Production Of

Silane, Dichlorosilane And Monochlorosilane 103

Cesar Ramírez-Márquez, Juan-Gabriel Segovia-Hernandez, Nelly Ramírez-Corona, Jorge Cervantes-Jauregui, Arturo JIménez

16:10 Multiobjective Optimization Of Membrane Networks For Fractionation Of Protein Hydrolysate From Fish By-Products

131

Ricardo Abejon, Azucena Abejon, Marie Pierre Belleville, Jose Sanchez-Marcano, Aurora Garea, Angel Irabien

16:30 Multi-period Sequential Synthesis of Heat Exchanger Networks and Utility Systems including storages

324

Alberto Mian, Emanuele Martelli, François Maréchal

16:50 to 18:20 Poster session (EMERALD foyer)

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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

Monday 13th 13

Parallel Session B, Theme 2: Oral Presentations Monday, 13th, 12:00 to 13:00 Chaired by Prof. Efstratios N. Pistikopoulos, Prof. Il Moon. In room EVROPA - B

12:00 Modeling, Simulation and Economic Evaluation of a Hybrid CO2 Capture Process for Oxidative Coupling of Methane

412

Alberto Penteado, Erik Esche, Robert Wilhelm, Hamid Reza Godini, Daniel Salerno, Gregor Tolksdorf, Victor Alejandro Merchan, Günter Wozny

12:20 KEYNOTE: Innovative computational tools and models for the design, optimization and control of carbon capture processes

813

David Miller, Deb Agarwal, Debangsu Bhattacharyya, Joshua Boverhof, Yang Chen, John Eslick, Jim Leek, Jinliang Ma, Priyadarshi Mahapatra, Brenda Ng, Nick Sahinidis, Charles Tong, Stephen E. Zitney

12:40 Multi-level modelling of sustainable chemical production; From CFD to LCA 161 Pratham Arora, Andrew Hoadley, Sanjay Mahajani, Anuradda Ganesh

13:00 to 14:30 Lunch (Sunset Restaurant) 13:00 to 14:30 EURECHA & CACE Business Meeting (Hall Adria)

Parallel Session B, Theme 2: Oral Presentations Monday, 13th, 14:30 to 16:50 Chaired by Dr. Ruth Misener, Ass. Prof. Henrique Matos. In room EVROPA - B

14:30 Dynamic optimization of desalination system designs using Aspen Custom Modeler 517 Sidra Malik, Parisa Bahri, Linh Vu

14:50 Solution of Chance-Constrained Mixed-Integer Nonlinear Programming Problems 32 Erik Esche, David Müller, Sebastian Werk, Ignacio Grossmann, Günter Wozny

15:10 Price Adjustment in Price-based Coordination Using Quadratic Approximation 73 Simon Wenzel, Radoslav Paulen, Stefan Krämer, Benedikt Beisheim, Sebastian Engell

15:30 Testing the Non-Diagonal Quadratic Convex Reformulation Technique 110 Otto Nissfolk, Ray Pörn, Tapio Westerlund

15:50 Automatic Model Reduction of Population Balance Models by Proper Orthogonal Decomposition

63

Dmytro Khlopov, Michael Mangold 16:10 Minimizing the complexity of surrogate models for optimization. 99

Julian Straus, Sigurd Skogestad 16:30 Optimal dynamic experiment design for guaranteed parameter estimation 252

Anwesh Reddy Gottu Mukkula, Radoslav Paulen 16:50 to 18:20 Poster session (EMERALD foyer)

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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

Monday 13th 14

Parallel Session C, Theme 3: Oral Presentations Monday, 13th, 12:00 to 13:00 Chaired by Prof. Sebastian Engell, Prof. Alexander Mitsos. In room EVROPA - D

12:00 Chance constrained dynamic real-time optimization of microgrids with day-ahead commitments for external power exchange

34

Michael Zachar, Prodromos Daoutidis 12:20 Comparison of Continuous-Time Models for Adjustable Robust Optimization in Process

Scheduling under Uncertainty 126

Nikolaos H. Lappas, Chrysanthos E. Gounaris 12:40 KEYNOTE:

Multi-objective optimization of energy networks under demand uncertainty 261

Edwin Zondervan, Ignacio E. Grossmann 13:00 to 14:30 Lunch (Sunset Restaurant) 13:00 to 14:30 EURECHA & CACE Business Meeting (Hall Adria) Parallel Session C, Theme 3: Oral Presentations Monday, 13th, 14:30 to 16:50 Chaired by Prof. Michail Georgiadis, Dr. Pedro Castro. In room EVROPA - D

14:30 Strategic Energy Planning under Uncertainty: a Mixed-Integer Linear Programming Modeling Framework for Large-Scale Energy Systems

656

Stefano Moret, Michel Bierlaire, François Maréchal 14:50 Discrete-Time Mixed-Integer Programming Models for Production Scheduling in

Multistage Facilities 119

Andres Merchan, Hojae Lee, Christos Maravelias 15:10 Integrating Uncertainty into Urban Energy System Design 556

Jakob Rager, Stefano Moret, Mathias Pernet, François Maréchal 15:30 Computational experiments on sampling methods for uncertainty propagation, and the

implications for simulation-based optimization (SIMOPT) 614

Ismail Fahmi, Selen Cremaschi 15:50 On Optimal Assignment of Cold Standby Components for Multi-Channel Safety

Interlocks 45

Chuei-Tin Chang, Yu-Chih Wang 16:10 Optimal Feature Selection for Designing a Fault Diagnosis System 378

Mohammad Hamed Ardakani, Mahdieh Askarian, Ahmed Shokry Abdel Aleem Taha Zied, Gerard Escudero, Moisès Graells, Antonio Espuña

16:30 Framework for assessing social sustainability in supply chains 699 Tamara Popovic, Ana Carvalho, Andrzej Kraslawski, Ana Paula Barbosa-Póvoa

16:50 to 18:20 Poster session (EMERALD foyer)

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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

Monday 13th 15

Parallel Session D, Theme 4: Oral Presentations Monday, 13th, 12:00 to 13:00 Chaired by Prof. Costas Kiparissides, Prof. Alajos Mészáros. In room EMERALD-B

12:00 Modelling and model- based control of haemodialysis 319 Thomas Eck, Vivek Dua

12:20 Application of pharmacokinetic modeling to personalized therapies 545 Roberto Andrea Abbiati, Valentina Depetri, Federico Scotti, Davide Manca

12:40 Geometry optimization of a fibrous scaffold based on mathematical modelling and CFD simulation of a dynamic cell culture

476

Tannaz Tajsoleiman, Mohammad J Abdekhodaie, Krist V. Gernaey, Ulrich Krühne 13:00 to 14:30 Lunch (Sunset Restaurant) 13:00 to 14:30 EURECHA & CACE Business Meeting (Hall Adria) Parallel Session D, Theme 4: Oral Presentations Monday, 13th, 14:30 to 15:50 Chaired by Dr. Vivek Dua, Prof. David L. Bogle. In room EMERALD-B

14:30 KEYNOTE: A pharmacokinetic-pharmacodynamic model for individualisation of an oral anticoagulant therapy

225

Luigi Bosa, Riccardo De Luca, Myriam Ferrari, Massimiliano Barolo, Fabrizio Bezzo, Roberto Padrini

14:50 KEYNOTE: Mathematical Modeling of a Raceway Pond System for Biofuels Production

51

Jose Gomez, Kai Höffner, Paul Barton 15:10 Multi-objective optimisation of flavour and processing time in beer fermentation via

dynamic simulation 348

Alistair D. Rodman, Dimitrios Gerogiorgis 15:30 A Predictive Model for Energy Metabolism and ATP Balance in Mammalian Cells:

Towards the Energy-Based Optimization of mAb Production. 533

Ana Quiroga, Maria M Papathanasiou, Efstratios N. Pistikopoulos, Athanasios Mantalaris 16:50 to 18:20 Poster session (EMERALD foyer)

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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

Monday 13th 16

Parallel Session E, Theme 7: Oral Presentations Monday, 13th, 12:00 to 13:00 Chaired by Prof. Soledad Diaz, Prof. Chi Wai Hui. In room EMERALD-A

12:00 Automated data review in secondary pharmaceutical manufacturing by pattern recognition techniques

263

Natascia Meneghetti, Pierantonio Facco, Fabrizio Bezzo, Chrismono Himawan, Simeone Zomer, Massimiliano Barolo

12:20 H2TT – A pinch analysis software tool for refinery hydrogen network management 297 João P. Marques, Henrique Matos, Clemente Pedro Nunes, Nuno M. Oliveira

12:40 First-principles rheological modelling and parameter estimation for nanoparticle-based smart drilling fluids

349

Simon I. Reilly, Zisis Vryzas, Vassilios C. Kelessidis, Dimitrios Gerogiorgis 13:00 to 14:30 Lunch (Sunset Restaurant) 13:00 to 14:30 EURECHA & CACE Business Meeting (Hall Adria)

Parallel Session E, Theme 7: Oral Presentations Monday, 13th, 14:30 to 16:50 Chaired by Asc. Prof. Flavio Manenti, Prof. Massimiliano Barolo. In room EMERALD-A

14:30 Cognitive Engineering for Process Safety: Effective Training for Process Operators using Eye Gaze Patterns

708

Babji Srinivasan, Madhu Kodappully, Rajagopalan Srinivasan 14:50 CFD simulation of boiling flows for nuclear reactor thermal hydraulic applications 137

Marco Colombo, Michael Fairweather 15:10 Investigating the energy-water-carbon nexus of mega-scale chemicals production

from Appalachian shale gas 294

Chang He, Fengqi You 15:30 KEYNOTE:

Configurable Scheduling Solution using Flexible Heuristics 53

Iiro Harjunkoski, Reinhard Bauer 15:50 KEYNOTE:

Systematic Design of the Green Ethylene Glycol Downstream Process under the Generalized Disjunctive Programming Framework

207

Michele Corbetta, Ignacio E. Grossmann, Flavio Manenti, Marco Bernardi, Alessandra Frattini

16:10 Development of soft sensor with neural network and nonlinear variable selection for crude distillation unit process

114

Kai Sun, Shao-hsuan Huang, Jialin Liu, Shi-Shang Jang, David Shan-Hill Wong 16:30 Integration of Energy-Cost Optimization and Production Scheduling using

Multiparametric Programming 186

Hubert Hadera, Rachid Labrik, Juha Mäntysaari, Guido Sand, Iiro Harjunkoski, Sebastian Engell

16:50 to 18:20 Poster session (EMERALD foyer)

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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

Tuesday 14th 17

Tuesday 14th

Parallel Session A, Theme 1: Oral Presentations Tuesday, 14th, 08:30 to 10:30, Chaired by Prof. Antonis Kokossis, Prof. Michael Fairweather. In room EVROPA - A+C

08:30 Optimal Reuse Of Flowback Wastewater In Shale Gas Hydraulic Fracturing Operations Considering Economic And Safety Aspects

317

Luis Fernando Lira-Barragán, Juan Martinez-Gomez, Jose Maria Ponce-Ortega, Medardo Serna-Gonzalez, Mahmoud M. El-Halwagi

08:50 Enhanced down-stream processing of biobutanol in the ABE fermentation process 328 Costin Sorin Bildea, Iulian Patrascu, Juan-Gabriel Segovia-Hernandez, Tony Kiss

09:10 Optimization of OSN Membrane Cascades for Separating Organic Mixtures 122 Vincentius Surya Kurnia Adi, Marcus Cook, Ludmila Peeva, Andrew G Livingston, Benoit Chachuat

09:30 Design and comparison of optimal reactor concepts for the hydroformylation of olefins by use of a probabilistic design framework

466

Nicolas Maximilian Kaiser, Robert Flassig, Kai Sundmacher 09:50 Economically optimal multi-actor processing networks: material flows and price

assignment of the intermediates using Lagrangian decomposition 470

Ana Inés Torres, Tomasz Bochenski, Jens Ejbye Schmidt, George Stephanopoulos 10:10 Synthesis of Mass Exchange Networks Using Mathematical Programming and Detailed

Exchanger Designs 645

Michael Short, Adeniyi Isafiade, Klaus Moller, Zdravko Kravanja 10:30 to 11:00 Coffee break

11:00 to 11:45 Plenary Lecture 4 (EVROPA - A+C) Chaired by Prof. André Bardow.

ESCAPE-ing into a sustainable future: Can we optimise our way to sustainable development? Adisa Azapagic, The University of Manchester, United Kingdom (Great Britain)

11:45 to 12:30 Plenary Lecture 5 (EVROPA - A+C)

Chaired by Prof. Antonio Espuña.

What engineers needs to know - An industrial view of chemical engineering education Hermann Feise, BASF Se, Germany

12:30 to 14:00 Lunch (Sunset Restaurant) 12:30 to 14:00 Advisory Board Meeting of Computers & Chemical Engineering (Hall Adria) Parallel Session A, Theme 1: Oral Presentations Tuesday, 14th, 14:00 to 16:00 Chaired by Prof. Rafiqul Gani, Prof. Jose A. Caballero. In room EVROPA - A+C

14:00 KEYNOTE: Integrated Computer-aided Framework for Sustainable Chemical Product design and Evaluation

479

Sawitree Kalakul, Stefano Cignitti, Lei Zhang, Rafiqul Gani 14:20 Computer-Aided Molecular Design by Combining Genetic Algorithms and COSMO-RS 37

Jan Scheffczyk, Lorenz Fleitmann, Annett Schwarz, André Bardow, Kai Leonhard 14:40 Optimal design and synthesis of shale gas processing and NGL recovery processes 175

Jian Gong, Fengqi You 15:00 Predictive Modelling of Phase-Transfer Catalyst Systems for Improved and Innovative

Design 277

Amata Anantpinijwatna, Sun Hyung Kim, Mauricio Sales-Cruz, Rafiqul Gani 15:20 Systematic solvent evaluation for artemisinin recovery in continuous pharmaceutical

manufacturing 347

Hikaru G. Jolliffe, Dimitrios Gerogiorgis 15:40 One-stage approach for the integrated design of ORC processes and working fluids

using PC-SAFT 443

Johannes Schilling, Matthias Lampe, Joachim Gross, André Bardow

16:00 to 17:30 Poster session (EMERALD foyer) 16:30 to 17:30 Meeting of the IPC for the PSE-2018 (Hall Adria)

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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

Tuesday 14th 18

Parallel Session A, Theme 1: Oral Presentations Tuesday, 14th, 17:30 to 18:50 Chaired by Prof. Tony Kiss, Prof. François Maréchal. In room EVROPA - A+C

17:30 Application of a Simultaneous Approach for Process Scheduling and Water Minimisation in Batch Plants

677

Jui-Yuan Lee, Dominic Foo 17:50 Disjunctive Models for Strategic Midstream Delivery Agreements in Shale Gas

Development 315

Markus Drouven, Ignacio Grossmann 18:10 Synthesis of preliminary system designs for offshore oil and gas production 478

Tuong-Van Nguyen, Gürkan Sin, Brian Elmegaard 18:30 Development of advanced computational tools for the intensification of monoclonal

antibody production 561

Maria M Papathanasiou, Ana Quiroga, Richard Oberdieck, Athanasios Mantalaris, Efstratios N. Pistikopoulos

From 19:30 Gala dinner (St. Bernardin Square)

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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

Tuesday 14th 19

Parallel Session B: Theme 2: Oral Presentations Tuesday 14th, 08:30 to 10:30, Chaired by Dr. Benoit Chachuat, Prof. Nuno M. Oliveira. In room EVROPA - B

08:30 Computationally Efficient Steady-State Process Simulation by Applying a Simultaneous Dynamic Method

169

Alexander Zinser, Liisa Rihko-Struckmann, Kai Sundmacher 08:50 Optimal Operating Condition of Fluidized Bed Propellant Incinerator Considering

Fluidization Effect and Reaction of the Particles 391

Sunghyun Cho, Chanho Park, Min Oh, Jungsu Park, Hyunsoo Kim, Il Moon 09:10 Simplification of Variable Transitive Relationship for Equation-oriented Models through a

Directed Graph Method 325

Fei Zhao, Xi Chen 09:30 Set-valued integration of uncertain dynamic systems with sensitivity analysis capability 396

Nikola D. Peric, Mario E, Villanueva, Benoit Chachuat 09:50 Efficient simulation of heterogeneity and stochasticity in microbial processes 407

Robert Flassig, Dennis Pischel, Kai Sundmacher 10:10 Computational workflow management in the context of model-based design of

experiments 637

Sigve Karolius, Mandar Thombre, Heinz A. Preisig

10:30 to 11:00 Coffee break

11:00 to 11:45 Plenary Lecture 4 (EVROPA - A+C) Chaired by Prof. André Bardow.

ESCAPE-ing into a sustainable future: Can we optimise our way to sustainable development? Adisa Azapagic, The University of Manchester, United Kingdom (Great Britain)

11:45 to 12:30 Plenary Lecture 5 (EVROPA - A+C)

Chaired by Prof. Antonio Espuña.

What engineers needs to know - An industrial view of chemical engineering education Hermann Feise, BASF Se, Germany

12:30 to 14:00 Lunch (Sunset Restaurant) 12:30 to 14:00 Advisory Board Meeting of Computers & Chemical Engineering (Hall Adria)

Parallel Session B, Theme 1: Oral Presentations Tuesday, 14th, 14:00 to 16:00 Chaired by Prof. Nick Sahinidis, Asc. Prof. Alexandra Elena Bonet Ruiz. In room EVROPA - B

14:00 Optimization Methods for Catalyst Design 101 Jeff Herron, Manos Mavrikakis, Christos Maravelias

14:20 KEYNOTE: Input-Independent Nonlinear Model Order Reduction in Reaction Engineering

586

Jens Bremer, Pawan Goyal, Lihong Feng, Peter Benner, Kai Sundmacher 14:40 Bayesian treed Gaussian process method for process monitoring 611

Hangzhou Wang, Vinícius Veloso de Melo 15:00 On the reduction of the overestimation in verified simulation by model reformulation 639

Carlos Perez-Galvan, I.David L. Bogle 15:20 Constrained Smoothing of Experimental Data in the Identification of Kinetic Models 726

Carolina Vertis, Nuno M. Oliveira, Fernando P. Bernardo 15:40 Model analysis and optimization under uncertainty using highly efficient integration

techniques 738

Fernando P. Bernardo 16:00 to 17:30 Poster session (EMERALD foyer) 16:30 to 17:30 Meeting of the IPC for the PSE-2018 (Hall Adria)

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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

Tuesday 14th 20

Parallel Session B: Theme 2: Oral Presentations Tuesday, 14th, 17:30 to 18:30 Chaired by Prof. Luis Puigjaner, Prof. Paul Barton. In room EVROPA - B

17:30 Modeling and simulation of phase change and nonideality in multistream heat exchangers

163

Harry Watson, Donghoi Kim, Truls Gundersen, Paul Barton 17:50 Optimal Design of an Integrated Radiant Syngas Cooler and Steam Methane Reformer

using NLP and Stochastic Algorithms 490

Jaffer Ghouse, Thomas Adams II 18:10 Smart Adaptive Sampling for Surrogate Modelling 224

Sushant Garud, Iftekhar Karimi, Markus Kraft From 19:30 - Gala dinner (St. Bernardin Square)

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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

Tuesday 14th 21

Parallel Session C, Theme 3: Oral Presentations Tuesday, 14th, 08:30 to 10:30 Chaired by Dr. Iiro Harjunkoski, Ass. Prof. Chrysanthos E. Gounaris. In room EVROPA - D

08:30 Parallel multi-parametric programming 64 Richard Oberdieck, Efstratios N. Pistikopoulos

08:50 An extended comparison study of large scale data-driven prediction methods based on variable selection, latent variables, penalized regression and machine learning

551

Ricardo Rendall, Ana Pereira, Marco Reis 09:10 Dynamic Multi-Scenario Approach to the Robust and Profitable Online Optimization &

Optimal Control of Batch Processes 320

Francesco Rossi, Gintaras Reklaitis, Guido Buzzi-Ferraris, Flavio Manenti 09:30 Extracting Knowledge from Historical Databases for Process Monitoring using Feature

Extraction and Data Clustering 293

Michael Thomas, Jose Romagnoli 09:50 Computational tools for the advanced control of periodic processes - Application to a

chromatographic separation 562

Maria M Papathanasiou, Richard Oberdieck, Athanasios Mantalaris, Efstratios N. Pistikopoulos

10:10 A framework for Simultaneous State Estimation and Robust Hybrid Model Predictive Control in Intravenous Anaesthesia

353

Ioana Nascu, Richard Oberdieck, Efstratios N. Pistikopoulos

10:30 to 11:00 Coffee break

11:00 to 11:45 Plenary Lecture 4 (EVROPA - A+C) Chaired by Prof. André Bardow.

ESCAPE-ing into a sustainable future: Can we optimise our way to sustainable development? Adisa Azapagic, The University of Manchester, United Kingdom (Great Britain)

11:45 to 12:30 Plenary Lecture 5 (EVROPA - A+C)

Chaired by Prof. Antonio Espuña.

What engineers needs to know - An industrial view of chemical engineering education Hermann Feise, BASF Se, Germany

12:30 to 14:00 Lunch (Sunset Restaurant) 12:30 to 14:00 Advisory Board Meeting of Computers & Chemical Engineering (Hall Adria)

Parallel Session C, Theme 3: Oral Presentations Tuesday, 14th, 14:00 to 16:00 Chaired by Prof. Ana Paula Barbosa-Póvoa, Prof. Marco Reis. In room EVROPA - D

14:00 Using Transient Measurements in Iterative Steady-State Optimizing Control 164 Weihua Gao, Sebastian Engell

14:20 Optimal Start-Up and Operation Policy for an Ultrafiltration Membrane Unit in Whey Separation

537

Muhammed Bahadir Saltik, Leyla Özkan, Marc Jacobs, Albert van der Padt 14:40 KEYNOTE:

Dynamic Real-time Optimization Under Uncertainty Applied on a Hydroformylation Mini-plant

43

David Müller, Erik Esche, Markus Illner, Tobias Pogrzeba, Marcel Schmidt, Reinhard Schomäcker, Lorenz T. Biegler, Günter Wozny

15:00 Application of a multiple time-scale rolling horizon optimization technique for improved load-following of an integrated solid-oxide fuel cell/compressed air energy storage plant with zero emissions

581

Jake Nease, Nina Monteiro, Thomas Adams II 15:20 Sensor Fault Detection and Fault Tolerant Control of a Crude Distillation Unit 717

Sulaiman Lawal, Jie Zhang 15:40 First Steps towards Online Optimal Control of Molecular Weight in Batch and Semi-

batch Free-Radical Polymerization Reactors 385

Navid Ghadipasha, Aryan Geraili, Jose Romagnoli, Carlos Castor, Wayne Reed

16:00 to 17:30 Poster session (EMERALD foyer) 16:30 to 17:30 Meeting of the IPC for the PSE-2018 (Hall Adria)

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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

Tuesday 14th 22

Parallel Session C: Theme 3: Oral Presentations Tuesday,14th, 17:30 to 18:30 Chaired by Prof. Gintaras Reklaitis, Asc. Prof. Selen Cremaschi. In room EVROPA - D

17:30 KEYNOTE: Decision Making Across Different Scales: From Process Control to Supply Chain Management

815

Marianthi Ierapetritou, Nihar Sahay 17:50 Distributed minimum batch time optimization for batch reactors with shared resources 536

Lukas Samuel Maxeiner, Sebastian Engell 18:10 A Framework for Integrated Scheduling and Control using Discrete-Time Empirical

Models 204

Cara Touretzky, Iiro Harjunkoski, Michael Baldea 18:30 On–line Approach for Diagnosis and Rectification of Model–Plant Mismatch in Open

Reaction Systems using Incremental Framework 668

Darsha Kumar Dhurvas, Shankar Narasimhan, Nirav Bhatt From 19:30 - Gala dinner (St. Bernardin Square)

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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

Tuesday 14th 23

Parallel Session D: Theme 6: Oral Presentations Tuesday, 14th, 08:30 to 10:30, Chaired by Dr. Petar Varbanov, Dr. Marianthi Ierapetritou. In room EMERALD-B

08:30 Reliable Integrated Energy Systems Design for Continuous Processes incorporating Renewables Generation

147

Oluwamayowa Amusat, Paul Shearing, Eric Fraga 08:50 Process and Economic Optimisation of a Milk Processing Plant with Integration of Solar

Thermal Energy 447

Fabian Bühler, Tuong-Van Nguyen, Brian Elmegaard 09:10 Systematic methodology for selection of the most energetically feasible route for oil

extraction from Botryococcus braunii microalgae 518

Sofia Chaudry, Parisa Bahri, Navid Moheimani 09:30 Structure optimization of power-to-chemicals (P2C) networks by linear programming for

the economic utilization of renewable surplus energy 519

Dominik Schack, Liisa Rihko-Struckmann, Kai Sundmacher 09:50 Energy Supply Chain Optimisation for Capacity and Investment Planning 557

Christiana Papapostolou, Emilia Kondili, John K. Kaldellis 10:10 KEYNOTE:

Optimal design and synthesis of algae processing network under uncertainty based on return over investment

178

Jian Gong, Fengqi You

10:30 to 11:00 Coffee break

11:00 to 11:45 Plenary Lecture 4 (EVROPA - A+C) Chaired by Prof. André Bardow.

ESCAPE-ing into a sustainable future: Can we optimise our way to sustainable development? Adisa Azapagic, The University of Manchester, United Kingdom (Great Britain)

11:45 to 12:30 Plenary Lecture 5 (EVROPA - A+C)

Chaired by Prof. Antonio Espuña.

What engineers needs to know - An industrial view of chemical engineering education Hermann Feise, BASF Se, Germany

12:30 to 14:00 Lunch (Sunset Restaurant) 12:30 to 14:00 Advisory Board Meeting of Computers & Chemical Engineering (Hall Adria)

Parallel Session D: Theme 6: Oral Presentations Tuesday,14th, 14:00 to 16:00 Chaired by Dr. Franjo Cecelja, Dr. Adeniyi Isafiade. In room EMERALD-B

14:00 Co-gasification of torrefied wood biomass and sewage sludge 777 Peter Trop, Marko Agrez, Danijela Urbancl, Darko Goricanec

14:20 Non-intrusive Appliance Load Monitoring for Electric Energy Systems Simulation and Analysis – A case study in India

712

Babji Srinivasan, Nikita Patel, Rajagopalan Srinivasan 14:40 Integrated Biorefinery Design for the Co-production of Premium Quality Liquid Fuels and

Propylene 693

Zhihong Yuan, Mario R. Eden 15:00 KEYNOTE:

P-Graph Approach to Carbon-Constrained Energy Planning Problems 772

Raymond Tan, Kathleen Aviso, Dominic Foo 15:20 Comparison of different heat exchanger tube designs used in latent heat thermal

energy storage systems – a transient numerical study 97

Martin Koller, Anton Beck, Heimo Walter, Michael Hameter 15:40 An integrated unit commitment model incorporating electric vehicles as a flexible and

responsive load 362

Nikolaos E. Koltsaklis, Michail Georgiadis 16:00 to 17:30 Poster session (EMERALD foyer) 16:30 to 17:30 Meeting of the IPC for the PSE-2018 (Hall Adria)

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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

Tuesday 14th 24

Parallel Session D, Theme 3: Oral Presentations Tuesday, 14th, 17:30 to 18:30 Chaired by Prof. Adisa Azapagic, Prof. Zorka Novak Pintarič. In room EMERALD-B

17:30 Efficient optimization-based design of energetically intensified distillation processes 197 Thomas Waltermann, Mirko Skiborowski

17:50 Residential microgrid design optimisation under uncertain μCHP characteristics 503 Carmen Wouters, Eric Fraga, Adrian M James

18:10 A computer-aided scenario analysis of national and regional energy systems based on feasible technology options

679

Yasunori Kikuchi, Yuichiro Kanematsu, Tatsuya Okubo 18:30 The re-development of Total Site Analysis into a synthesis model to optimize and

integrate biorefineries: selection of process portfolios to save energy 714

Konstantinos Pyrgakis, Antonis Kokossis From 19:30 - Gala dinner (St. Bernardin Square)

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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

Tuesday 14th 25

Parallel Session E, Theme 8: Oral Presentations Tuesday, 14th, 08:30 to 10:30, Chaired by Prof. Valentin Plesu, Prof. Antonio Espuña. In room EMERALD-A

08:30 A Multivariable Model Predictive Control Simulation Project in a Computer Aided Master's Degree Course

295

Carla Pinheiro 08:50 Quality Education in Romanian Chemical Engineering Higher Education 749

Petrica Iancu, Tiberiu Dinu Danciu, Razvan Onofrei, Valentin Plesu 09:10 KEYNOTE:

The Bologna Reform toward Outcomes-Based Education of Computer-Aided Chemical Engineering

558

Zorka Novak Pintarič, Zdravko Kravanja 09:30 KEYNOTE:

An Ontological Approach to Chemical Engineering Curriculum Development 27

Madeleine Bussemaker, Nikolaos Trokanas, Franjo Cecelja 09:50 Process simulation integrated with experimental Thermodynamics Lab to Chem. Eng.

undergraduate students 723

M. Rosinda C. Ismael, Henrique Matos 10:10 Innovative 3D training platform for recycling of waste coming from Electric and

Electronic Devices – RECDEV 788

Peter Glavič, Leonidas Somakos, Konstantinos Aravossis, Nikos Papastamatiou, Thaleia- Rozalinta Chasapidi-Mavroeidi, S. Tzovaras, Bohdan Stejskal , Aida Szilahy

10:30 to 11:00 Coffee break

11:00 to 11:45 Plenary Lecture 4 (EVROPA - A+C) Chaired by Prof. André Bardow.

ESCAPE-ing into a sustainable future: Can we optimise our way to sustainable development? Adisa Azapagic, The University of Manchester, United Kingdom (Great Britain)

11:45 to 12:30 Plenary Lecture 5 (EVROPA - A+C) Chaired by Prof. Antonio Espuña.

What engineers needs to know - An industrial view of chemical engineering education Hermann Feise, Basf Se, Germany

12:30 to 14:00 Lunch (Sunset Restaurant) 12:30 to 14:00 Advisory Board Meeting of Computers & Chemical Engineering (Hall Adria)

Parallel Session E, Theme 5: Oral Presentations Tuesday, 14th, 14:00 to 16:00 Chaired by Prof. André Bardow, Prof. Fabrizio Bezzo. In room EMERALD-A

14:00 A Leader-Follower Game-Based Life Cycle Optimization Framework and Application 176 Jiyao Gao, Fengqi You

14:20 Macro- and Micro-economic Perspectives regarding the Syntheses of Sustainable Bio-Fuels Supply Networks

782

Žan Zore, Lidija Čuček, Zdravko Kravanja 14:40 Incorporating LCA indicators into optimal electric vehicles charging strategies: An

integrated modelling approach 88

Gonzalo Bustos-Turu, Miao Guo, Koen H. van Dam, Salvador Acha, Nilay Shah 15:00 Synthesis and Design Strategies of Interplant Water Networks using Water Mains with

Quality Specifications 231

Sabla Alnouri, Patrick Linke, Sumit Bishnu, Mahmoud M. El-Halwagi 15:20 KEYNOTE:

Integrated Hybrid Life Cycle Optimization Framework with Application to Sustainable Design of A Biofuel Supply Chain

156

Dajun Yue, Fengqi You 15:40 KEYNOTE:

Multi-objective Optimisation Approach for the Synthesis of Water Treatment Plants 588

Mariya Koleva, Songsong Liu, Craig Styan, Lazaros Papageorgiou

16:00 to 17:30 Poster session (EMERALD foyer) 16:30 to 17:30 Meeting of the IPC for the PSE-2018 (Hall Adria) From 19:30 - Gala dinner (St. Bernardin Square)

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Tuesday 14th 26

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Wednesday 15th 27

Wednesday, 15th

Parallel Session A, Theme 1: Oral Presentations Wednesday, 15th, 08:30 to 10:30 Chaired by Prof. Ignacio Grossmann, Prof. George Stephanopoulos. In room EVROPA - A+C

08:30 Multiobjective retrofitting methodology for manufacturing processes of active pharmaceutical ingredients considering environment, health and safety risks

30

Hirokazu Sugiyama, Akiko Segawa, Satoshi Yoshikawa, Takayuki Toyama, Hayao Nakanishi, Emi Kikuchi-Uehara, Masahiko Hirao

08:50 Mineral concentration plants design using rigorous models 497 Edelmira Gálvez, Renato Acosta, Luis Cisternas

09:10 Conceptual Design of an Oil Shale Retorting Process Integrated with Chemical Looping for Hydrogen Production

381

Qingchun Yang, Yu Qian, Siyu Yang 09:30 A Study on the Endogenous Symbiosis of First and Second Generation Biorefineries:

Towards a Systematic Methodology 750

Aikaterini Mountraki, Antonis Kokossis, Bouchra Benjelloun- Mlayah 09:50 Data Reconciliation for Energy System Flowsheets 799

Jun Yow Yong, Andreja Nemet, Milos Bogataj, Žan Zore, Petar Varbanov, Zdravko Kravanja, Jiří Jaromír Klemeš

10:10 Enhanced process for methanol production by CO2 hydrogenation 329 Tony Kiss, J. J. Pragt, H. J. Vos, G. Bargeman, M. T. de Groot

8:30 to10:30 ProcessBuilder workshop – Advanced process modelling and flowsheeting (Hall Adria) 10:30 to 11:00 Coffee break Parallel Session A, Theme 1: Oral Presentations Wednesday, 15th, 11:00 to 13:00 Chaired by Prof. Jiří Jaromír Klemeš, Dr. Andreja Nemet. In room EVROPA - A+C

11:00 KEYNOTE: A Convex Hull formulation for the design of optimal mixtures

26

Suela Jonuzaj, Claire Adjiman 11:20 Sustainable Chemical Process Development through an Integrated Systematic

Framework 287

Emmanouil Papadakis, Anjan K. Tula, Amata Anantpinijwatna, Deenesh K. Babi, Rafiqul Gani

11:40 Phenomena Based Process Intensification of Toluene Methylation for Sustainable Para-xylene Production Process

375

Nateetorn Anantasarn, Deenesh Babi, Uthaiporn Suriyapraphadilok, Rafiqul Gani 12:00 Reverse Design of Ionic Liquids for the Absorption of CO2 379

Sarah Davis, Robert H. Herring III, Mario R. Eden 12:20 Techno-Economic Evaluation of an Oxidative Coupling of Methane Process at Industrial

Scale Production 615

Daniel Salerno, Hamid-Reza Godini, Alberto Penteado, Erik Esche, Günter Wozny 12:40 A Systematic Approach For The Hydrotreating of Biodiesel and Petroleum-Diesel Blends 600

Eduardo Perez-Cisneros, Mauricio Sales-Cruz, Alberto Ochoa-Tapia, Tomas Viveros-Garcia, Ricardo Lobo-Oehmichen

13:00 to 14:30 Lunch (Sunset Restaurant)

14:30 to 15:15 Plenary Lecture 6 (EVROPA - A+C) Chaired by Prof. Gintaras Reklaitis.

Management of "Systematic Innovation": A kind of quest for the Holy Grail!? Jean-Marc Le Lann, Stéphane Negny, Celine Bryon-Portet, University of Toulouse, INP, France

15:15 to 16:00 Plenary Lecture 7 (EVROPA - A+C)

Chaired by Prof. Jiří Jaromír Klemeš.

Models and Modelling Tools for Chemical Product and Process Design Rafiqul Gani, Technical University of Denmark, Denmark

16:00 to 16:15 Presentation of ESCAPE 27 | Farewell (EVROPA - A+C)

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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

Wednesday 15th 28

Parallel Session B, Theme 2: Oral Presentations Wednesday, 15th, 08:30 to 10:30 Chaired by Dr. Olga Arsenyeva, Prof. Fengqi You. In room EVROPA - B

08:30 Optimization of Economic and Operability Performances of WGSR Membrane Reactor Configurations

290

Shuey Zi Saw, Jobrun Nandong 08:50 Optimal design and operation of semi-batch reactive distillation for Methyl Lactate

Synthesis with fixed product demand 303

Dhia Aqar, Nejat Rahmanian, Iqbal Mujtaba 09:10 Merging information from batch and continuous flow experiments for the identification

of kinetic models of benzyl alcohol oxidation 321

Federico Galvanin, Noor Al-Rifai, Enhong Cao, Asterios Gavriilidis, Vivek Dua 09:30 Implementation of hybrid DEM-PBM approach to reduce the computational cost of

powder mixing modeling 420

Ashutosh Tamrakar, Subhodh Karkala, Nirupaplava Metta, Rohit Ramachandran 09:50 Multi-Scale Modeling of Solid Electrolyte Interface Formation in Lithium-Ion Batteries 62

Fridolin Röder, Richard D. Braatz, Ulrike Krewer 10:10 Equation-based rigorous modelling of the NOx absorption process: model

development and process optimization 500

Ines Vilarinho, Nuno M. Oliveira, Belmiro Duarte, Susana Pereira

8:30 to 10:30 ProcessBuilder workshop – Advanced process modelling and flowsheeting (Hall Adria) 10:30 to 11:00 Coffee break

Paralell Session B, Theme 2: Oral Presentations Wednesday, 15th, 11:00 to 13:00 Chaired by Prof. Truls Gundersen, Dr. David Miller. In room EVROPA - B

11:00 Calculation of the Optimal Distribution of the Active Metal Site Concentration in a Ziegler-Natta Catalyst to Maximize Polymer Yield in Olefin Polymerizations

680

Mohammed Adel Alkatheri, Apostolos Baltsas, Costas Kiparissides 11:20 Global Optimization for a Continuous Location-Allocation Model for Centralized and

Distributed Manufacturing 338

Cristiana Lara, Ignacio Grossmann 11:40 Dynamic Simulation and Optimization of an Industrial Process for Tributyl Citrate

Production 389

Juan D. Fonseca , Abderrazak M. Latifi, Alvaro Orjuela, Ivan D. Gil, Gerardo Rodríguez 12:00 A hierarchical coordination approach for the optimal operation of a sugar

crystallization process 242

Reinaldo Hernandez, Fawad Shamim, Radoslav Paulen, Sebastian Engell 12:20 Spatial Branch-and-Bound Algorithm for the Global Optimization of MIQCPs 173

Pedro Castro 12:40 Bayesian Optimisation with Dimension Scheduling Algorithm: Application to Biological

Systems 352

Doniyor Ulmasov, Caroline Baroukh, Benoit Chachuat, Marc Deisenroth, Ruth Misener

13:00 to 14:30 Lunch (Sunset Restaurant)

14:30 to 15:15 Plenary Lecture 6 (EVROPA - A+C) Chaired by Prof. Gintaras Reklaitis.

Management of "Systematic Innovation": A kind of quest for the Holy Grail!? Jean-Marc Le Lann, Stéphane Negny, Celine Bryon-Portet, University of Toulouse, INP, France

15:15 to 16:00 Plenary Lecture 7 (EVROPA - A+C) Chaired by Prof. Jiří Jaromír Klemeš.

Models and Modelling Tools for Chemical Product and Process Design Rafiqul Gani, Technical University of Denmark, Denmark

16:00 to 16:15 Presentation of ESCAPE 27 | Farewell (EVROPA - A+C)

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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

Wednesday 15th 29

Parallel Session C, Theme 1: Oral Presentations Wednesday, 15th, 08:30 to 10:30, Chaired by Dr. Stanislav Boldyryev, Asc. Prof. Elvis Ahmetović. In room EVROPA - D

08:30 Screening methodology for biorefinery and power to chemicals concepts 651 Emanuela Peduzzi, Guillaume Boissonnet, François Maréchal

08:50 A Hybrid GA-DT Molecular Design Method for Relating Reaction Rate to Reactant/Product Structure while Considering Solvent Influence

710

Shounak Datta, Vikrant A. Dev, Mario R. Eden 09:10 Electricity vs hydrogen: whole-systems optimisation of integrated wind-hydrogen-

electricity networks for decarbonising the domestic transport sector in Great Britain 140

Sheila Samsatli, Nouri J. Samsatli, Alfredo Ramos, Mark Matchett, Nigel P. Brandon, Nilay Shah

09:30 Long-term planning and retrofitting of supply and distribution chains with decaying performance

276

Ana Somoza, Carlos Pozo, Gonzalo Guillen Gosalbez, Moisès Graells 09:50 Renewable electricity integration at a regional level: Cantabria case study 79

Antonio Dominguez-Ramos, Sheila Samsatli, Nilay Shah, Angel Irabien 10:10 Optimal Planning Of Distributed Systems Of Refineries And Biorefineries Considering

Pollution Trading With Forest Plantations 376

Aurora de Fátima Sánchez-Bautista, José Ezequiel Santibañez-Aguilar, Fengqi You, Jose Maria Ponce-Ortega

8:30 to 10:30 ProcessBuilder workshop – Advanced process modelling and flowsheeting (Hall Adria) 10:30 to 11:00 Coffee break

Parallel Session C, Theme 1: Oral Presentations Wednesday,15th, 11:00 to 13:00 Chaired by Dr. Lidija Čuček, Dr. Petar Varbanov. In room EVROPA - D

11:00 Optimization of heat exchanger networks involving isothermal and non-isothermal mixing by global and local solvers

811

Zlatan Mujkić, Nidret Ibrić, Milos Bogataj, Zdravko Kravanja, Elvis Ahmetović 11:20 Risk Management of Shale Gas Supply Chain under EUR Uncertainty 174

Jiyao Gao, Fengqi You 11:40 Ammonia supply chains: A new framework for renewable generation with a case study

for Minnesota 472

Andrew Allman, Prodromos Daoutidis 12:00 Towards a sustainable hydrogen economy: role of carbon price for achieving GHG

emission targets 339

Marta Moreno-Benito, Paolo Agnolucci, Will McDowall, Lazaros Papageorgiou 12:20 Optimization of Lignocellulosic Waste Biorefinery using Multi-Actor Multi-Objective

Mathematical Framework 433

Muhammad Tahir Ashraf, Ana Inés Torres, Chuanji Fang, Iwona Cybulska, Mette Hedegaard Thomsen, Jens Ejbye Schmidt, George Stephanopoulos

12:40 Time-series aggregation for synthesis of distributed energy supply systems by bounding error in operational expenditure

262

Björn Bahl, Alexander Kümpel, Matthias Lampe, André Bardow

13:00 to 14:30 Lunch (Sunset Restaurant)

14:30 to 15:15 Plenary Lecture 6 (EVROPA - A+C) Chaired by Prof. Gintaras Reklaitis.

Management of "Systematic Innovation": A kind of quest for the Holy Grail!? Jean-Marc Le Lann, Stéphane Negny, Celine Bryon-Portet, University of Toulouse, INP, France

15:15 to 16:00 Plenary Lecture 7 (EVROPA - A+C) Chaired by Prof. Jiří Jaromír Klemeš.

Models and Modelling Tools for Chemical Product and Process Design Rafiqul Gani, Technical University of Denmark, Denmark

16:00 to 16:15 Presentation of ESCAPE 27 | Farewell (EVROPA - A+C)

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Wednesday 15th 30

Parallel Session D, Theme 7: Oral Presentations Wednesday, 15th, 08:30 to 10:30, Chaired by Ass. Prof. Dimitrios Gerogiorgis, Dr. Tilman Barz. In room EMERALD-A

08:30 Capacity planning for the Air Separation Industry with Rational Markets and Uncertainty 748 Anvitha Kandiraju, Pablo Garcia-Herreros, Pratik Misra, Erdem Arslan, Sanjay Mehta, Ignacio E. Grossmann

08:50 TAEE Sustainable Process Design and Simulation 757 Olivia Ana Perederic, Valentin Plesu, Petrica Iancu, Alexandra Elena Bonet Ruiz, Jordi Bonet Ruiz, Bertram Muchan

09:10 Integrated management of hierarchical levels: towards a CAPE tool 4 Canan Dombayci, Sergio Medina, Moisès Graells, Antonio Espuña

09:30 A generic methodology for superstructure optimization of different processing networks 238 Maria-Ona Bertran, Rebecca Frauzem, Lei Zhang, Rafiqul Gani

09:50 A Holistic Approach to Model Integration Using a Domain Ontology 248 Linsey Koo, Nikolaos Trokanas, Franjo Cecelja

10:10 SolACE: An Open Source Package for Nonlinear Model Predictive Control and State Estimation for (Bio)Chemical Processes

682

Satyajeet Bhonsale, Mattia Vallerio, Dries Telen, Dominique Vercammen, Filip Logist, Jan Van Impe

8:30 to 10:30 ProcessBuilder workshop – Advanced process modelling and flowsheeting (Hall Adria) 10:30 to 11:00 Coffee break

Parallel Session D: Themes 7 and 2: Oral Presentations Wednesday, 15th, 11:00 to 13:00 Chaired by Prof. Zorka Novak Pintarič, Prof. Fernando P. Bernardo. In room EMERALD-A

11:00 Application of a knowledge management system to a dropwise additive manufacturing system for pharmaceuticals

218

Elcin Icten, Girish Joglekar, Arun Giridhar, Gintaras Reklaitis 11:20 Short-term crude mix and operating conditions optimization for oil refinery operations 255

Pedro Castillo Castillo, Gang Fu, Vladimir Mahalec, (Pedro Castro) 11:40 Projection-based Reformulation and Decomposition Algorithm for A Class of Mixed-

Integer Bilevel Linear Programs 157

Dajun Yue, Fengqi You 12:00 Mo-Mcs: An Efficient Multibojective Optimization Algorithm For The Optimization Of

Temperature/pressure Swing Adsorption Cycles 498

Lisa Joss, Federico Capra, Matteo Gazzani, Marco Mazzotti, Emanuele Martelli 12:20 Convergence Rate of McCormick Relaxations in Chemical Engineering 544

Jaromil Najman, Alexander Mitsos 12:40 Global optimization of nonconvex bilevel problems: implementation and

computational study of the Branch-and-Sandwich algorithm 685

Remigijus Paulavicius, Polyxeni-M. Kleniati, Claire Adjiman

13:00 to 14:30 Lunch (Sunset Restaurant)

14:30 to 15:15 Plenary Lecture 6 (EVROPA - A+C) Chaired by Prof. Gintaras Reklaitis.

Management of "Systematic Innovation": A kind of quest for the Holy Grail!? Jean-Marc Le Lann, Stéphane Negny, Celine Bryon-Portet, University of Toulouse, INP, France

15:15 to 16:00 Plenary Lecture 7 (EVROPA - A+C) Chaired by Prof. Jiří Jaromír Klemeš.

Models and Modelling Tools for Chemical Product and Process Design Rafiqul Gani, Technical University of Denmark, Denmark

16:00 to 16:15 Presentation of ESCAPE 27 | Farewell (EVROPA - A+C)

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Monday 13th - Poster Session 31

Poster session 1 Monday 13, 16:50 to 18:20 In room EMERALD foyer

Slot Title 1 Modelling of a Reactive Distillation in the production process of high purity Cyclohexanone

to produce caprolactam. David Lorenzo, Carlos Perez-Galvan, Cristian Triana, Aurora Santos, Arturo Romero, I.David L. Bogle

2 Assessment of chemical looping combustion process by dynamic simulation Ana-Maria Cormos, Dora-Andreea Chisalita

3 Simulation and optimization on the molecular weight distribution of free radical polymerization with non-ideal reactors Chi Zhang, Xi Chen, Chaozhong Xu, Jiajun Wang

4 Security Framework for the Electronic Management System of a Total Site Utility System Oscar Manso

5 Optimization of hydrogen supply chain network design by multi-objective genetic algorithms Jesus Ochoa Robles, Sofia De Leon Almaraz, Catherine Azzaro-Pantel

6 Using Dynamic Simulation for Risk Assessment: Application to Exothermic Reaction Fatine Berdouzi, Nelly Olivier-Maget, Nadine Gabas

7 A Novel Experimental Strategy for Validating Human Failure Probabilities in Risk Assessment Mohd Umair Iqbal, Rajagopalan Srinivasan

8 Synthesis of intensified processes from a superstructure of phenomena building blocks Hanns Kuhlmann, Mirko Skiborowski

9 An Optimal Scheduling of the Heliostat Field in a Solar Tower Power Plant Qian Zhao, Yuhong Zhao

10 Performance Evaluation of Unsteady Processes with Dynamic and Temporal Flexibility Indices Chuei-Tin Chang, Yi-Chung Kuo

11 Optimization and Monte Carlo Simulation for Product Launch Planning and Scheduling under Uncertainty Catarina Marques, Samuel Moniz, Jorge Pinho de Sousa, Ana Paula Barbosa-Póvoa

12 Mid-term scheduling model based on state-task netwotk for considering plant specific constraints in pharmaceutical manufacturing Gioele Casola, Lukas Eberle, Christian Siegmund, Markus Mattern, Hirokazu Sugiyama

13 Optimization of shale gas supply chain network and operations under uncertain conditions Jorge Chebeir, Aryan Geraili, Jose Romagnoli

14 Material Flow Analysis and Life Cycle Assessment Study for Sustainable Management of Wastes of Metropolitan Electricity Authority (MEA) Ornmanee Yahom, Pomthong Malakul, Ampira Charoensaeng

15 Modelling and optimization framework for the multi-objective design of buildings Joan Carreras, Gonzalo Guillen Gosalbez, Dieter Boer, Carlos Pozo, Jose A. Caballero, Ruben Ruiz-Femenia, Laureano Jiménez

16 Energy integration of a hydrotreating process for the production of biojet fuel Claudia Gutiérrez-Antonio, Fernando Israel Gómez-Castro, Araceli G. Romero-Izquierdo, Salvador Hernández

17 A Supercritical Reactive Separation Process to Obtain Biopesticides (phorbol-esters) in the Biodiesel Production from Jatropha curcas Eduardo Perez-Cisneros, Mauricio Sales-Cruz, Verónica Rodríguez-López, Xenia Mena-Espino, Tomas viveros-Garcia

18 Process design and integration of various carbon capture approaches into the energy sector and other energy-intensive industrial applications Calin-Cristian Cormos, Letitia Petrescu, Ana-Maria Cormos, Paul-Serban Agachi

19 Utilising Semantics for Improved Decision Making in Bio-refinery Value Chains Nikolaos Trokanas, Madeleine Bussemaker, Franjo Cecelja

20 Using PLS and NIR spectra to model the first-breakage step of a grain milling process Filippo Dal-Pastro, Pierantonio Facco, Fabrizio Bezzo, Massimiliano Barolo, Eliana Zamprogna

21 Heat Exchanger Network Design with Fouling Effects Sawanya Bamrungsab, Kitipat Siemanond

22 Modelling of starch production by microalgal biomass under multi-nutrient limitation Gonzalo Figueroa-Torres, Constantinos Theodoropoulos

23 Solvent Design for Post Combustion Chemical Absorption Process Muhammad Zulhilmi Ahmad, Haslenda Hashim, Nor Alafiza Yunus

24 Modeling SER Biomass Gasification Using Neural Networks Alia Salah, Lutz Hanel, Marcel Beirow, Günter Scheffknecht

25 Biodiesel from Sunflower Oil: Development of Process Model via Lab scale Experiment and Optimisation Elisabetta Mercuri, Davide Manca, Omran Abderazag, Raj Patel, Iqbal Mujtaba

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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

Monday 13th - Poster Session 32

Slot Title 26 Cost-based analysis about a newly designed two-staged reverse osmosis process with draw

solute Kiho Park, Do Yeon Kim, Dae Ryook Yang

27 Total Site Resource Efficiency Janez Petek, Peter Glavič, Anja Kostevšek

28 Derivative-Free Chemical Process Synthesis by Memetic Algorithms Coupled to Aspen Plus Process Models Maren Urselmann, Christophe Foussette, Tim Janus, Stephen Tlatlik, Axel Gottschalk, Michael T. M. Emmerich, Thomas Bäck, Sebastian Engell

29 Intensified separation processes for the recovery and dehydration of bio-ethanol from an actual lignocellulosic fermentation broth Carlo Edgar Torres-Ortega, Ben-Guang Rong

30 Optimising biomass-based energy supply chains for sustainable mobility Federico d'Amore, Fabrizio Bezzo

31 Evaluation of the production of lipids for fuels and proteins from microalgae using a two-level Lagrangian decomposition Tomasz Bochenski, Ana Inés Torres, Muhammad Tahir Ashraf, Jens Ejbye Schmidt, George Stephanopoulos

32 Wastewater Quality Impact on Water Management in Shale Gas Supply Chain Omar Guerra, Andres Calderon, Lazaros Papageorgiou, Gintaras Reklaitis

33 A Comparative Study of Fischer-Tropsch Synthesis for Liquid Transportation Fuels Production from Biomass Pengcheng Li, Zhihong Yuan, Mario R. Eden

34 Hydrogen Sulfide Scavenging Simulation in HYSYS André Young, Fernando Pessoa, Eduardo Queiroz

35 Conceptual Crystallization Process Design for Separation and Purification of Phosphorus from Complex Wastes Yi Liu, Haiyan Qu, Ben-Guang Rong

36 Kinetics of Phycocyanobilin Cleavage from C-Phycocyanin by Methanolysis Chandrakant Malwade, Maria Cinta Roda-Serrat, Knud Villy Christensen, Xavier Fretté, Lars Porskjær Christensen

37 Biosyngas conversion by FT synthesis with high loaded Fe-based catalysts: kinetic parameters regression Alberto Comazzi, Federico Galli, Flavio Manenti, Claudia Bianchi, Carlo Pirola

38 Synthesis and optimization of microalgae biorefineries Melina Psycha, Antonis Kokossis

39 Taylor-Made Modeling and Solution of Novel Process Units by Modular CAPE-OPEN-based Flowsheeting Gregor Tolksdorf, Erik Esche, Jasper van Baten, Günter Wozny

40 Model-based framework for enhanced and controlled operation of a fed-batch bioreactor: xylitol production Héctor Hernández-Escoto, Oscar Andrés Prado-Rubio, Ricardo Morales-Rodriguez

41 Analysis and simulation of catalytic reforming process using a kinetic model for hydrocarbons of 5-10 carbons Elvira Lopez-Sanchez, Arturo Ortíz-Arroyo, Angel Castro-Agüero

42 Multi-parametric statistical analysis of economic data for continuous pharmaceutical manufacturing Brigitta Nagy, Gyorgy J. Marosi, Dimitrios Gerogiorgis

43 Impact of crude unit model accuracy on refinery production planning Gang Fu, Pedro Castillo Castillo, Vladimir Mahalec

44 Systematic framework for design and implementation of advanced plant-wide multilayer sensing and control architecture into continuous pharmaceutical manufacturing plant Ravendra Singh, Fernando J. Muzzio, Marianthi Ierapetritou, Rohit Ramachandran

45 Ionic Liquids Role for in Multifeedstock / Multiproduct Integrated Biorefineries Manuel Rodriguez, Ismael Diaz

46 Robust fault isolation using stable principal component pursuit Zhengbing Yan, Yuan Yao

47 Incremental Learning Fault Detection Algorithm Based on Hyperplane-Distance Mohammad Hamed Ardakani, Gerard Escudero, Moisès Graells, Antonio Espuña

48 Developing a Soft Sensor with Online Variable Selection for Industrial Multi-mode Processes Jialin Liu, Shi-Shang Jang, David Shan-Hill Wong

49 Material Flow Analysis (MFA) and Life Cycle Assessment (LCA) Study for Sustainable Management of PVC Wastes in Thailand Suriyaphong Nakem, Manit Nithithanakul, Pomthong Malakul

50 Multiscale Simulation of Bubbly Flows Kenneth Asiagbe, Michael Fairweather, Derrick Njobuenwu, Marco Colombo

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Monday 13th - Poster Session 33

Slot Title 51 Integrated modeling of agricultural and industrial processes within life cycle design for

environment Kotaro Ouchida, Yasunori Kikuchi, Tatsuya Okubo

52 A Stochastic Programming Approach for the Optimal Placement of Gas Detectors by Application of Atmospheric Dispersion Modeling Tools Jaehoon Cho, Hyunseung Kim, Dongil Shin

53 Anaerobic Bioreactor Modeling Cansu Birgen, Heinz A. Preisig, Alexander Wentzel, Sidsel Markussen, Bernd Wittgens, Ujjaini Sarkar, Anindita Ganguly, Sudeshna Saha, Sibashish Baksi

54 Novel Plant-Wide Process Design of Dichlorohydrin Production by Glycerol Hydrochlorination San-Jang Wang, Siao-Han Huang, David Shan-Hill Wong, Shi-Shang Jang

55 Building semantically-enabled community hubs in biorewables, biorefineries and bioenergy Eirini Siougkrou, Antonis Kokossis

56 Systematic, efficient and consistent LCA calculations for chemical and biochemical processes Kaesinee Petchkaewkul, Pomthong Malakul, Rafiqul Gani

57 Effects of bioethanol pretreatments on the broth concentration and its impacts in the optimal design of product separation and purification processes André Rodrigues Gurgel da Silva, Carlo Edgar Torres-Ortega, Ben-Guang Rong

58 Targeting the hydrogen network and optimal feed using rigorous simulation Wang Dai, Guilian Liu

59 Exergy Analysis of an Ethanol from Syngas Production Plant Júlio C. C. Miranda, Harvey Arellano-Garcia, Rubens Maciel Filho, Maria Regina Wolf Maciel, Gustavo Ponce

60 Estimation of membrane fouling parameters for concentrating lactose using nanofiltration Ayush Sharma, Martin Jelemenský, Radoslav Paulen, Miroslav Fikar

61 Adjustable Robust Optimization for Scheduling of Batch Processes under Uncertainty Hanyu Shi, Fengqi You

62 An intelligent decision making and notification system based on a knowledge-enabled supervisory monitoring platform Chrysovalantou Ziogou, Stelios Krinidis, Dimosthenis Ioannidis, Simira Papadopoulou, Dimitrios Tzovaras, Spyros Voutetakis

63 Hydrocracking Reaction Model of Petroleum Heavy Cuts Using Molecular Reconstruction Claudia Ximena Ramirez Novoa, Juan Esteban Torres Macias, David de Jesus Perez, Viatcheslav Kafarov, Alexander Guzman Monsalve

64 Modelling of organophilic and hydrophilic pervaporation to compete with distillation Andras Jozsef Toth, Eniko Haaz, Peter Mizsey

65 Population Balance Applied to Microalgae Growth Ergys Pahija, Yingzong Liang, Chi Wai Hui

66 Natural gas liquids (NGL) recovery in the liquified natural gas production Mengyu Wang, Ali Abbas

67 Economical, Environmental and Dynamic Optimization Applied to Hybrid Processes for the Purification of Biobutanol Eduardo Sánchez-Ramírez, Juan José Quiroz-Ramírez, Salvador Hernández, Juan-Gabriel Segovia-Hernandez

68 Group - Interaction Contribution Approach for prediction of Electrochemical Properties of Ionic Liquids Khadra Mokadem, Mourad Korichi

69 Design of a chemical batch plant: a study of dedicated parallel lines with intermediate storage and the plant performance Floor Verbiest, Trijntje Cornelissens, Johan Springael

70 Development of a model for identifying the optimal biogas system design for particular applications in Sub-Saharan Africa Gloria Rupf, Parisa Bahri, Karne de Boer, Mark McHenry

71 Process and heat integrated design of a novel NGL recovery scheme Mohd Shariq Khan, Iftekhar Karimi

72 Design and Control of Azeotropic Dividing Wall Column for Separating Furfural-Water Mixture Xing Qian, Shengkun Jia, Sigurd Skogestad, Xigang Yuan

73 Integrated Transhipment Models for Synchronous Screening of Treatment Technologies and Targeting of Fresh Water and Recycle Flows Athanassios Nikolakopoulos, Dimitrios Faskiotis, Antonis Kokossis

74 Analysis of Operational HEN Flexibility via Interval Arithmetic Pascal Floquet, Gilles Hetreux, Raphaele Thery-Hetreux

75 Optimisation of maintenance planning into the production of biopharmaceuticals with performance decay using a continuous-time formulation Miguel Vieira, Songsong Liu, Tânia Pinto-Varela, Ana Paula Barbosa-Póvoa, Lazaros Papageorgiou

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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

Monday 13th - Poster Session 34

Slot Title 76 A Comprehensive Kinetic Investigation of the Ring Opening of L,L-Lactide in the Presence of

Multifunctional Polyalcohols Prokopis Pladis, Konstantina Karidi, Dimitrios Meimaroglou, Costas Kiparissides

77 Dynamic Impact Milling Model with a Particle-Scale Breakage Kernel Qinglin Su, Zoltant Nagy, Chris Rielly

78 Levelised Value of Electricity - A Systemic Approach to Technology Valuation Clara Heuberger, Iain Staffell, Nilay Shah, Niall Mac Dowell

79 A Generic PAT Software Interface for On-Line Monitoring and Control of Chromatographic Separation Systems Anders Holmqvist, Anton Sellberg

80 Power-to-Heat: Opportunities in Reserve Market Participation for Flexible Chemical Production Christoph Westerwalbesloh, Ganzhou Wang, Alexander Mitsos

81 Multimodal Green Food Supply Chain Design and Planning under Uncertainty Ana Gomes, Tânia Pinto-Varela, Ana Paula Barbosa-Póvoa

82 Acrolein yield optimization in a propylene oxidation pilot plant Minghai Lei, François Lesage, Serge Tretjak, Abderrazak M. Latifi

83 Sugar extraction by moving-bed diffusers in ethanol production: development of a simulation tool Victor Coelho Geraldo , Edvaldo R. Morais, Eduardo Coselli Vasco de Toledo, Charles Jesus, Antonio Bonomi, Rubens Maciel Filho

84 Optimization of Batch Extractive Distillation with Off-cut Recycle and Varying Feed Composition Laszlo Hegely, Peter Lang

85 Bifurcation analysis of process stability of continuous fluidized bed agglomeration with external product classification Andreas Bück, Maximilian Wegner, Christoph Neugebauer, Stefan Palis, Evangelos Tsotsas

86 A New Technology to Optimize the Use of H2S Scavengers in the Crude Oil Production Ewerton Calixto, Fernando Pessoa, Eduardo Queiroz, André Castro

87 Modeling and simulation of diffusion process in tissue spheroids encaged into microscaffolds (lockyballs) Janaina de Andréa Dernowsek, Rodrigo Alvarenga Rezende, Veronica E. Passamai , Julia A. Nogueira , Viviane F. Lara , Fabio A. Vilalba , Vladimir Mironov , Jorge V.L. da Silva

88 Computer aided design of a process of extraction of heavy and extra heavy crude by injecting solvents in reservoir Yeimmy Peralta-Ruiz

89 Evaluation of the process of production and refining of Colombian crude oil by exergy analysis methodology Karen Cogollo-Herrera, Angel Gonzalez-Delgado, Yeimmy Peralta-Ruiz

90 Computer-aided evaluation of agar production from Gracilaria sp. red algae Yeimmy Peralta-Ruiz, Angel Gonzalez-Delgado

91 An Enhanced Group-Interaction Contribution Method for the Prediction of Normal Boiling and Critical points Khaled Mansour, Mourad Korichi

92 Convex Model for Global Optimization of Water Distribution System Yingzong Liang, Ergys Pahija, Chi Wai Hui

93 Multi-objective optimization for the biotechnological conversion of lignocellulosic biomass to value-added products. Arturo Álvarez del Castillo-Romo, Ricardo Morales-Rodriguez, Alicia Román-Martínez

93 Design of a multiproduct lignocellulosic biorefinery through the process modelling of a feasible superstructure Ségolène Belletante, Ludovic Montastruc, Stéphane Negny, Serge Domenech

95 Modelling of a Post-combustion CO2 Capture Process Using Bootstrap Aggregated Extreme Learning Machines Jie Zhang, Zhongjing Bai, Fei Li, Meihong Wang, Eni Oko, Zhihua Xiong, Dexian Huang

96 Conceptual coal and coke-oven gas to synthetic natural gas process with high efficiency and low emission Yi Man, Siyu Yang, Yu Qian

97 Global sensitivity analysis of reverse osmosis processes Freddy Lucay, Luis Cisternas, Edelmira Gálvez

98 Optimization of amine based carbon capture by genetic algorithm Laszlo Hegely, Ferenc Denes, David Nagy, Peter Lang

99 Model-based monitoring of thermal-hydraulic performance of refinery heat exchangers undergoing fouling Emilio Diaz-Bejarano, Francesco Coletti, Sandro Macchietto

100 Integrated multi-level bioenergy supply chain modelling applied to sugarcane biorefineries in South Africa Florent Delval, Miao Guo, Koen H. van Dam, Jonas Stray, Kate Haigh, Johann Görgens, Nilay Shah

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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

Monday 13th - Poster Session 35

Slot Title 101 Multi-objective optimization for designing sustainable wastewater treatment networks

Juan I. Padrón-Páez, Oscar Andrés Prado-Rubio, Ana Carvalho, Alicia Román-Martínez 102 A Methodology For Linear Modeling Applied To The Scheduling In The Synthesis Of Ethanol

From Sugarcane Bagasse Viviana Quintero Dallos, Claudia Valderrama, Roberto Pineda, Liliana Hernandez, Viatcheslav Kafarov

103 Minimum Reflux of Complex Distillation Columns: Adiabatic Flash Method on Enthalpy-Composition Diagram José D. Olguín-Ángeles, Arturo Ortíz-Arroyo, Angel Castro-Agüero

104 Conceptual design for the separation of a mixture of isoamyl acetate and isoamyl alcohol Oscar Dario Rojas, Gerardo Rodríguez, Ivan D. Gil

105 Chemical Looping Reforming: Impact on the Performances Due to Carbon Fouling on Catalyst Giuseppe Diglio, Piero Bareschino, Erasmo Mancusi, Francesco Pepe

106 Energy consumption maps for quaternary distillation sequences Fernando Israel Gómez-Castro, Norma E. Ramírez-Vallejo, Juan G. Segovia-Hernández, Claudia Gutiérrez-Antonio, Massimiliano Errico, Abel Briones-Ramírez, Jöns Sánchez-Aguilar

107 Modelling Reaction-Diffusion Dynamics In Microsystems Tomaz Urbic, Igor Plazl, Ivan Pribec

108 A New Methodology to Reduce the Exergy Loss of Distillation Columns Using Rigorous Process Simulation Lucas Bonfim Rocha, Thiago Cavali, Laureano Jiménez, Sérgio Faria

108 Coupled Thermo-Chemical-Mechanical modelling of underground coal gasification cavity growth Epameinondas Andrianopoulos, Anna Korre, Sevket Durucan, Guangyao Si, Sebastian Franzsen

110 Study of thermal efficiency in heavy oil reservoirs submitted to steam injection by using numerical simulation Antonio Gurgel, Anthony Diniz, Edson Araujo, Davi Lima, Wilson Mata, Marcos Rodrigues, Tarcilio Dutra Junior

111 Optimal design of water exchanges in eco-industrial parks through a game theory approach Manuel Ramos, Marianne Boix, Didier Aussel, Ludovic Montastruc, Serge Domenech

112 A Novel Approach to Include Limited Equipment Connectivity in State-Task Network Models Mikael Nyberg

113 Development of Neural Network techniques based Renewable Energy Forecasting Framework for Process Industries Soobin Lee, Jun-Hyung Ryu, Bri-Mathias Hodge, In-Beum Lee

114 Analysis of the intermittency of the steam alternating solvent process (SAS) applied to a heavy oil reservoir Davi Lima, Edson Araujo, Antonio Gurgel, Anthony Diniz, Wilson Mata

115 A new energy efficient process retrofit to eliminate back-mixing for absorption and stabilization unit Xuegang Liu, Junjie Chen, Changchun He, Bingjian Zhang, Qinglin Chen

116 Mathematical Modeling-based Energy System Operation Strategy considering Energy Storage Systems Jun-Hyung Ryu, Bri-Mathias Hodge

117 Framework for optimization and scheduling of a copper production plant Olli Suominen, Ville Mörsky, Risto Ritala, Matti Vilkko

118 Water And Energy. Why Not Optimize Them Simultaneously? Elva Arzate, Ignacio Grossmann, Pedro Huitzil, Blanca E. Martínez

119 Empirical modelling to support scale up of primary pharmaceutical processes Melanie Dumarey, Sameer Talwar, Mohammad Yahyah, John Peterson

120 Effect of Thickness Dependent Physical Aging in Process Simulation of O2/ N2 Gas Separation Using Polymeric Membranes Kok Keong Lau, Serene Sow Mun Lock, Azmi Mohd Shariff, Yin Fong Yeong

121 Population Balance Modelling of Liquid-liquid Extraction Columns using the Sectional Quadrature Method Of Moments (SQMOM) Samer Alzyod, Menwer Attarakih, Abdelmalek Hasseine, Hans-Joerg Bart

122 CFD Modelling of Bubbly Gas Flow using Coupled OPOSPM-Mixture Flow Model Menwer Attarakih, Abdelmalek Hasseine, Hans-Joerg Bart

123 Multiscale Modeling Concept At The Micro Scale Tomaz Urbic, Igor Plazl, Anže Prasnikar, Filip Strnisa

124 Influence of mill configuration on stability of continuous fluidised bed layering granulation with external product classification Christoph Neugebauer, Stefan Palis, Andreas Bück, Eugen Diez, Stefan Heinrich, Evangelos Tsotsas, Achim Kienle

125 Optimization of a crude oil distillation unit based on total-process simulation Kan Wang, Bingjian Zhang, Qinglin Chen

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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

Monday 13th - Poster Session 36

Slot Title 126 A General Representation for Modeling of Energy Supply Chains

Magdalini A. Kalaitzidou, Michail Georgiadis, Georgios Kopanos 127 Condition-based chemical cleaning of crude oil fouling deposits – a conceptual model

Laura Lanchas-Fuentes, Emilio Diaz-Bejarano, Francesco Coletti, Sandro Macchietto 128 Fuzzy Control of a Distillation Column

Anna Vasičkaninová, Monika Bakošová, Alajos Mészáros  

   

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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

Tuesday 14th - Poster Session 37

Poster session 2 Tuesday 14, 16:00 to 17:30 In room EMERALD foyer

Slot Title 1 A MILP model for targeting minimum annual operating cost of a heat-integrated resource

allocation network with regeneration units Sami Ghazouani, Assaad Zoughaib, Solène Le Bourdiec

2 Heat Exchanger Network Synthesis using a Genetic Algorithms-Particle Swarm Optimization Hybrid Method and Parallel Processing Leandro Pavão, Mauro Ravagnani

3 FI2EPI - A freeware tool for performing Heat Integration based on Pinch Analysis Pedro M. Pereira, Maria Cristina Fernandes, Henrique Matos

4 Optimization of Aeration Power in a Sequential Batch Reactor Jimena Ferreira Quagliata, Adrián Ferrari, Soledad Gutierrez, Argimiro R. Secchi

5 A Mixed Integer Programming Model for Sustainable Water Management in Macroscopic Systems Vicente Rico-Ramirez, Jaime Garibay-Rodriguez, José María Ponce-Ortega

6 Mathematical Optimization of Real-time Waste Incineration Scheduling in the Industry Matteo Abaecherli, Daniel Santos, Elisabet Capón-García , Konrad Hungerbühler

7 Enabling Sulfur-rich Coal Sources for Gassification without Emissions Andrea Bassani, Eva Maria Speelmanns, Flavio Manenti

8 Effect of Solvent Feeding Time on the Start-up Operation of an Extractive Distillation Column Ícaro Cazé Nunes, Marcella Feitosa de Figueirêdo, Karoline Dantas Brito, Romildo Pereira Brito

9 Downstream Petroleum Supply Chains Planning under Uncertainty Leão José Fernandes, Susana Relvas, Douglas Alem, Ana Paula Barbosa-Póvoa

10 Prediction of the solubility in supercritical carbon dioxide: a hybrid thermodynamic/QSPR approach Pavel Gurikov, Igor Lebedev, Andrey Kolnoochenko, Natalia Menshutina, Irina Smirnova

11 Synthesis of Heat Exchangers Network (HEN) and Optimization under Variability and Uncertainty Faysal Al Khulaifi, Eid Al Mutairi

12 Conceptual process design of Boric Acid production from Ulexite: A case study for engineering education Constanza Cruz, Yendery Ramirez, Sebastián Herrera, Luis Cisternas

13 Impact of protein co-production on techno-economic feasibility of microalgal biodiesel Soumyajit Sen Gupta, Yogendra Shastri, Sharad Bhartiya

14 Modeling and analysis of a soybean biorefinery for the production of refined oil, biodiesel and different types of flours Cristine de Pretto, Paulo Tardioli, Caliane Costa

15 Optimization Of Preventive Maintenance Program For Imaging Equipment In Hospitals Danahe Marmolejo-Correa, Rosa Gabriela Juárez-Valdivia, Alejandra Rodríguez-Navarro

16 Unit commitment Scheduling including transmission constraints: a MILP formulation Gonzalo Alvarez, Marian Marcovecchio, Pío Aguirre

17 Enhanced data envelopment analysis for sustainability assessment Ángel Galán-Martín, Gonzalo Guillen Gosalbez

18 Economic Evaluation of Hybrid FO-crystallization-RO Desalination Process Kiho Park, Do Yeon Kim, Dae Ryook Yang

19 Experimental Studies and Model Based Optimisation of Microalgal Production of Fuels and Chemicals Mesut Bekirogullari, Constantinos Theodoropoulos

20 Mechanistic models for process development and optimization of fed-batch fermentation systems Lisa Mears, Stuart M. Stocks, Mads O. Albaek, Gürkan Sin, Krist V. Gernaey

21 Integrated design and operation assessment of an embedded supervisory automation framework for a hybrid hydrogen-enabled power generation system Chrysovalantou Ziogou, Damian Giaouris, Simira Papadopoulou, Spyros Voutetakis

22 Robust multi-objective optimal control of dynamic biological networks Philippe Nimmegeers, Dries Telen, Mickey Beetens, Filip Logist, Jan Van Impe

23 A model-based investigation of genetically modified microalgae strains Andrea Bernardi, Andrea Meneghesso, Giorgio Perin, Tomas Morosinotto, Fabrizio Bezzo

24 Mathematical Programming Approach for the desing of Intensified Thermally Coupled Distitallion Sequences Jose A. Caballero, Juan A. Reyes-Labarta

25 Modelling and Simulation of an Industrial Riser in Fluid Catalytic Cracking Process Yakubu John, Raj Patel, Iqbal Mujtaba

26 Ontology construction for multi-network models Heinz A Preisig, Tobias Arne Elve

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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

Tuesday 14th - Poster Session 38

Slot Title 27 Dynamic Metabolic Modelling of Cupriavidus necator DSM 545 in PHB Production from

Glycerol Chenhao Sun, Colin Webb, Constantinos Theodoropoulos

28 Imputation of Missing data with Ordinary Kriging for Enhancing Fault Detection and Diagnosis Mohammad Hamed Ardakani, Ahmed Shokry Abdel Aleem Taha Zied, Ghazal Saki, Gerard Escudero, Moisès Graells, Antonio Espuña

29 Simulation of Turbulent Particulate Flows for Nuclear Waste Management: Agglomeration in vertical flows Derrick Njobuenwu, Michael Fairweather

30 Modelling and optimization of compact subsea separation system Tamal Das, Preben Fürst Tyvold, Johannes Jäschke

31 Modelling and optimization of an activated sludge wastewater treatment process Ioana Nascu, Ioan Nascu

32 Design of sustainable municipal wastewater treatment plants Juan I. Padrón-Páez, Sofía De-León Almaraz, Alicia Román-Martínez

33 MINLP Wastewater Stabilization Ponds Synthesis using Rigorous Models under Different Scenarios María Paz Ochoa, Vanina Estrada, Patricia M. Hoch

34 Is Wood Waste only for burning? A methodology for Best Pathway Identification of waste recovery Gisèle Abi Chahla, Assaad Zoughaib, Cong-Toan Tran, Romain Farel

35 Environmental assessment of biodiesel production topologies from wastewater using computer-aided tools Erika Fernández Conrado, Julis Orozco Marrugo, Angel Gonzalez-Delgado, Yeimmy Peralta-Ruiz

36 Quantifying the importance of flow maldistribution in numbered-up microreactors David Fernandes del Pozo, Timothy Van Daele, Daan Van Hauwermeiren, Krist V. Gernaey, Ingmar Nopens

37 Comparison between experimental and simulated data of a continuous distillation column: evaluation of mass-heat balances and trays efficiency Carlo Pirola

38 Structural and economic analysis of Industrial Symbiosis networks: a hybrid approach to assess investment opportunities Georgios Lignos, Simone Stancari, Stelios Bikos, Antonis Kokossis

39 Model Based Engineering of Process Plants using SysML Carlos Hernandez, Manuel Rodriguez, Ismael Diaz, Ricardo Sanz

40 Simultaneous Synthesis of Heat Exchanger Networks and Utility Systems: MINLP model, two-stage algorithm, initialization procedure and case study Emanuele Martelli, Cristina Elsido, Alberto Mian, François Maréchal

41 Global sensitivity analysis of computer-aided molecular design problem for the development of novel working fluids for power cycles Jerome Frutiger, Jens Abildskov, Gürkan Sin

42 A Microalgae-based Biorefinery Plant for the Production of Valuable Biochemicals: Design and Economics Giannis Penloglou, Christos Chatzidoukas, Costas Kiparissides

43 Simultaneous Optimization and Heat & Mass Integration of Gas Turbine and Air Separation Unit using Novel Simplified Model Maojian Wang, Chi Wai Hui, Guilian Liu

44 Modeling and optimal control of non-viral siRNA delivery Elnaz Jamili, Vivek Dua

45 Hybrid MILP/Simulation/Heuristic Algorithms to Complex Hoist Scheduling Problems Carlos A. Méndez, Natalia Basán

46 Design and evaluation of a high-density energy storage route with CO2 re-use, water electrolysis and methanol synthesis Grégoire Léonard, Diego Villarreal-Singer, Klaus Lackner

47 Lignocellulosic supply chain MILP model: a Hungarian case study Anna Panteli, Sara Giarola, Nilay Shah

48 Global Optimization of Gasoline Blending Model using Bound Contraction Technique Yolada Ounahasaree, Uthaiporn Suriyapraphadilok, Miguel Bagajewicz

49 Supply chain optimisation of Nipa-based ethanol supply chains in Thailand Remy Nguyen, Miao Guo, Charomgpun Musikavong, Noparat Bamroongrusa, Nilay Shah

50 A framework for modelling investment decisions in gas infrastructures including imperfect foresight of future markets Sara Giarola, Daniel Crow, Adam Hawkes

51 Simulation/Optimization of Carbon dioxide Capture Plant: A case study of AGRU from GSP 5 Wichuda Rachpitak, Kitipat Siemanond, Amr Henni

52 Modeling and simulation of a U-loop Reactor for Single Cell Protein Production Mengzhe Wu, Jakob Kjøbsted Huusom, Krist V. Gernaey, Ulrich Krühne

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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

Tuesday 14th - Poster Session 39

Slot Title 53 Purification of bioethanol from a fermentation process: Alternatives for dehydration

Carolina Conde-Mejía, Arturo Jiménez-Gutiérrez, Fernando Israel Gómez-Castro 54 Use of predictor corrector methods for multi-objective optimisation of large-scale systems

Tobias Keßler, Michael Mangold, Filip Logist 55 Inclusion of thermodynamic equations for efficient steady-state process optimization

Adriana Reyes Lua, Marie Solvik, Sigurd Skogestad 56 Green Approaches to Extract Astaxanthin from Shrimp Waste: Process Design and Economic

Evaluation Behnaz Razi Parjikolaei, Rime Bahij El-Houri, Massimiliano Errico, Knud Villy Christensen, Xavier Fretté

57 A new paradign in process synthesis – focus on design of power plants and industrial processes integrated with CO$_2$ capture Rahul Anantharaman, Truls Gundersen

58 Analysis of the Carbon Efficiency of a Hybrid XTL-CSP process Xinying Liu, Bilal Patel, Diane Hildebrandt

59 Enhanced Distillation Based on Feed Impurities Daniel Ortuño-Boter, Valentin Plesu, Alexandra Elena Bonet Ruiz, Jordi Bonet Ruiz, Petrica Iancu, Joan Llorens

60 Computer Aided Molecular Design of Reactants, Products and Solvents for Enhancement of Reaction Kinetics Vikrant A. Dev, Mario R. Eden, Nishanth G. Chemmangattuvalappil

61 Sustainable DME synthesis-design with CO2 utilization Weeranut Prasertsri, Rebecca Frauzem, Uthaiporn Suriyapraphadilok, Rafiqul Gani

62 Design and economic analysis of 1,2-propanediol derived from Crude glycerol Paweena Thammarat, Uthaiporn Suriyapraphadilok, Ampira Charoensaeng

63 Kriging based Fault Detection and Diagnosis Approach for Nonlinear Noisy Dynamic Processes Ahmed Shokry Abdel Aleem Taha Zied, Mohammad Hamed Ardakani, Gerard Escudero, Moisès Graells, Antonio Espuña

64 Automated process flowsheet synthesis for membrane processes using genetic algorithm: role of crossover operators Alireza Shafiee, Mobin Arab, Zhiping Lai, Zongwen Liu, Ali Abbas

65 Distillation Energy Assessment for Ammonia Recovery from Carbon Dioxide Absorption Cristina Mendez-Alvarez, Valentin Plesu, Alexandra Elena Bonet Ruiz, Jordi Bonet Ruiz, Petrica Iancu, Joan Llorens

66 A new scheme for process simulation by optimization Anna Hoffmann, Michael Bortz, Jakob Burger, Hans Hasse, Karl-Heinz Küfer

67 Improving proton exchange membrane efficiency of fuel cell by numerical simulation and optimization Chayanin Jawrungrit, Anuvat Sirivat, Kitipat Siemanond

68 PERKS: Software for Parameter Estimation in Reaction Kinetic Systems Aditya Tulsyan, Paul Barton

69 Influence of the mushy parameter on the numerical simulation of the melting and solidification process of phase change materials Michael Hameter, Heimo Walter

70 Mass and energy integration for the supercritical process for biodiesel production and a bioethanol dehydration train. Fernando Israel Gómez-Castro, Claudia Gutiérrez-Antonio, Araceli G. Romero-Izquierdo, Ricardo Morales-Rodriguez, Juan G. Segovia-Hernández

71 Multi-product reactive distillation for silanes production Nancy Medina-Herrera, Salvador Tututi-Avila, Juan-Gabriel Segovia-Hernandez, Arturo Jiménez-Gutiérrez

72 Evaluation of a calcium looping CO2 capture plant retrofit to a coal-fired power plant Dawid Hanak, Chechet Biliyok, Edwarad Anthony, Vasilije Manovic

73 Heat Exchanger Network Design with Multi-Stream Exchangers using Stage-Wise Superstructure Chanud Boonsup, Kitipat Siemanond

74 An MILP model for the optimization of hybrid renewable energy system Okechukwu Kelechi, Hella Tokos

75 Waste heat utilisation of Croatian cement industry accounting Total Site demands Stanislav Boldyryev, Hrvoje Mikulčić, Goran Krajačić, Neven Duić

76 Appropriate placement of compressors and expanders in sub-ambient heat exchanger networks Chao Fu, Truls Gundersen

77 Optimization of Energy Consumption in a Hydrotreating Process for Green Diesel Production from Palm Oil Paisan Kittisupakorn, Suwisa Sae-Ueng, Ajaree Suwatthikul

78 Optimal design of a styrene monomer plant under market volatility Riccardo Barzaghi, Alberto Conte, Piernico Sepiacci, Davide Manca

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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

Tuesday 14th - Poster Session 40

Slot Title 79 Process Integration of Heat Utilised from Exhaust Gases

Olga Arsenyeva, Jiří Jaromír Klemeš, Lidija Čuček, Petro O. Kapustenko, Yana S. Savchenko 80 Iterative Real-time Optimization of a homogenously catalyzed hydroformylation process

Reinaldo Hernandez, Sebastian Engell 81 A Reformulation Strategy for Deterministic Global Optimization of Ideal Multi-component

Distillation Processes Nick Mertens, Christian Kunde, Achim Kienle, Dennis Michaels

82 Inventory management during start-up operations of the benchmark chemical plant Hiroya Seki

83 Optimization of dynamic systems with rigorous path constraint satisfaction Johannes M.M. Faust, Jun Fu, Benoit Chachuat, Alexander Mitsos

84 Multi-Stage Adaptive Robust Optimisation over Bioconversion Product and Process Networks with Uncertain Feedstock Price and Biofuel Demand Daniel Garcia, Jian Gong, Fengqi You

85 Multiparametric Metamodels for Model Predictive Control of Chemical Processes Ahmed Shokry Abdel Aleem Taha Zied, Canan Dombayci, Antonio Espuña

86 Multi-objective optimization for regulating the product distribution of two-stage-riser fluidized catalytic pyrolysis process Ping Wang, Zhihong Yuan, Xuemin Tian

87 Control of Extractive Distillation Columns With Thermal Integration Wagner Brandão Ramos, Marcella Feitosa de Figueirêdo, Karoline Dantas Brito, Romildo Pereira Brito

88 Off-line optimisation and control of carbon capture operations Norhuda Abdul Manaf, Abdul Qadir, Ali Abbas

89 Closed-Loop Identification of Nonlinear Hammerstein Models Based on Subspace Identification Approach Jyh-Cheng Jeng, Po-An Chen

90 Process Operability Analysis Of A Generic Model Control Strategy Applied To A Chemical Process Adalício Uzêda, Arianne Barros, José Nilton Silva, Heleno Silva

91 Optimal regional resource utilisation - the St. Margarethen case Stephan Maier, Raphaela Hemma Maier, Christina Pfeifer, Michael Narodoslawsky

92 Managing uncertainty information for improved data-driven modelling Ricardo Rendall, Marco Reis, Swee-Teng Chin, Leo Chiang

93 Moving-horizon State Estimation with Gross-error Detection for a Hydroformylation Mini-plant Christian Hoffmann, Markus Illner, David Müller, Erik Esche, Günter Wozny, Lorenz T. Biegler, Jens-Uwe Repke

94 Simulation, optimization and control of heavy oil upgrading processes: application to a delayed coking unit Nadson Murilo Nascimento Lima, Paula Sbaite, Cesar Batistella, Rubens Maciel Filho, Maria Regina Wolf Maciel, Lílian Medina, Flavio Manenti, Marcelo Embiruçu

95 Improving the wastewater treatment plant performance through model predictive control strategies Chiara Foscoliano, Stefania Del Vigo, Stefania Tronci, Michela Mulas

96 Practical Implementation of RTO in a Industrial-Scale Vapor Recompression Distillation Process Danilo R.C. Menezes, José Eduardo A. Graciano, Fabio D. S. Liporace, Galo A. C. Le Roux

97 A Cooperative Distributed Model Predictive Control for Nonlinear Systems with Automatic Partitioning Luis Oliveira-Lopes, Rosiane Rocha

98 Synthesis of Multi-Period Heat Exchanger Networks Involving Multiple Sources of Utilities Adeniyi Isafiade, Michael Short

99 Optimal Power Sharing Control in Networked Fuel Cell Stacks Resmi Suresh M P, Ganesh Sankaran, Sreeram Joopudi, Suman Roy Choudhury, Shankar Narasimhan, Raghunathan Rengaswamy

100 Effective Sampling, Modeling and Optimization of Constrained Black-box Problems Ishan Bajaj, M M Faruque Hasan

101 Discovering valorisation paths in waste biorefineries using an ontology engineering approach Foteini Barla, Filopoimin Lykokanellos, Antonis Kokossis

102 Multi-Objective Optimization In A Petrochemical Complex with LCA considerations Antonio Gonzalez Castaño, Alberto Bandoni, Soledad Diaz

103 Process evaluation of the ecological performance of food and energy crop production systems René Kollmann, Franz Friebel, Georg Neugebauer, Michael Narodoslawsky

104 Life cycle modelling of a handicraft sector: the anchovy canning industry in Cantabria (Northern Spain) Maria Margallo, Jara Laso, Ruben Aldaco, Cristina Gazulla, Pere Fullana, Angel Irabien

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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

Tuesday 14th - Poster Session 41

Slot Title 105 PiXAR : Pinch and eXergy for the Analysis and Retrofit design of industrial processes

Stephane Gourmelon, Raphaele Thery-Hetreux, Pascal Floquet 106 Development of Hybrid Fuzzy-GMC for MSF Desalination Control System

Salih Alsadaie, Mohd Zanil, Azlan Hussain, Iqbal Mujtaba 107 Optimal design of industrial waste-to-energy networks

Vasco Bolis, Elisabet Capón-García , Konrad Hungerbühler 108 Hybrid plant-wide Simulation and Modelling using Reference nets and Java

Stefan Hubert, Darius Rückert, Antonio Delgado 109 Forest Supply Chain Optimization applying Generalized Disjunctive Programming

Maria Analia Rodriguez, Noelia Alasino, Aldo Vecchietti 110 Multi-scale modelling software framework facilitating simulation of interconnected scales

using surrogate-models Sigve Karolius, Heinz A. Preisig, Jonas Mairhofer, Henrik Rusche

 

 

 

 

 

 

 

 

 

 

 

 

 

 

 

 

 

 

 

 

 

 

 

 

 

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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

Tuesday 14th - Poster Session 42

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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

Memo 43

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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

Memo 44

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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

Memo 45

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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

Memo 46

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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

Memo 47

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ESCAPE26 | European Symposium on Computer Aided Process Engineering | 12-15 June 2016 | Portorož, Slovenia | Organized by Faculty of Chemistry and Chemical Engineering, University of Maribor, CAPE Working Party and EFCE

Memo 48