EUROPEAN SYMPOSIUM ON COMPUTER-AIDED PROCESS ENGINEERING- 15 COMPUTER-AIDED CHEMICAL ENGINEERING Advisory Editor: R. Gani Volume 1: Distillation Design in Practice (L.M. Rose) Volume 2: The Art of Chemical Process Design (G.L. Wells and L.M. Rose) Volume 3: Computer Programming Examples for Chemical Engineers (G. Ross) Volume 4: Analysis and Synthesis of Chemical Process Systems (K. Hartmann and K. Kaplick) Volume 5: Studies in Computer-Aided Modelling. Design and Operation Part A: Unite Operations (1. Pallai and Z. Fony6, Editors) Part B: Systems (1. Pallai and G.E. Veress, Editors) Volume 6: NeuralN etworks for Chemical Engineers (A.B. Bulsari, Editor) Volume 7: Material and Energy Balancing in the Process Industries - From Microscopic Balances to Large Plants (V.V. Veverka and F. Madron) Volume 8: EuropeanS ymposium on Computer Aided Process Engineering-10 (S. Pierucci, Editor) Volume 9: EuropeanS ymposium on Computer Aided Process Engineering-11 (R. Gani and S.B. Jorgensen, Editors) Volume 10: European Symposium on Computer Aided Process Engineering-12 (J. Grievink and J. van Schijndel, Editors) Volume 11: Software Architectures and Tools for Computer Aided Process Engineering (B. Braunschweig and R. Gani, Editors) Volume 12: Computer Aided Molecular Design: Theory and Practice (L.E.K. Achenie, R. Gani and V. Venkatasubramanian, Editors) Volume 13: Integrated Design and Simulation of Chemical Processes (A.C. Dimian) Volume 14: European Symposium on Computer Aided Process Engineering-13 (A. Kraslawski and I. Turunen, Editors) Volume 15: Process Systems Engineering 2003 (Bingzhen Chen and A.W. Westerberg, Editors) Volume 16: Dynamic Model Development: Methods, Theory and Applications (S.P. Asprey and S. Macchietto, Editors) Volume 17: The Integration of Process Design and Control (P. Seferlis and M.C. Georgiadis, Editors) Volume 18: European Symposium on Computer-Aided Process Engineering-14 (A. Barbosa-P6voa and H. Matos, Editors) Volume 19: Computer Aided Property Estimation for Process and Product Design (M. Kontogeorgis and R. Gani, Editors) Volume 20: European Symposium on Computer-Aided Process Engineering-15 (L. Puigjaner and A. Espufia, Editors) COMPUTER-AIDED CHEMICAL ENGINEERING, 20B E U R O P E A N S Y M P O S I U M ON C O M P U T E R - A I D E D PROCESS ENGINEERING- 15 38 th European Symposium of the Working Party on Computer Aided Process Engineering ESCAPE-15, 29 May- 1 June 2005, Barcelona, Spain Edited by Luis Puigjaner UPC-ETSEIB Barcelona, Spain Antonio Espufia UPC-ETSEIB Barcelona, Spain ELSEVIER 2005 Amsterdam - Boston - Heidelberg - London - New York - Oxford Paris - San Diego - San Francisco - Singapore - Sydney - Tokyo ELSEVIER B.V. ELSEVIER Inc. ELSEVIER Ltd. ELSEVIER Ltd. Sara Burgerhartstraat 25 525 B Street The Boulevard 84 Theobalds Road P.O. Box 211, 1000 AE Suite 1900, San Diego Langford Lane, Kidlington, London WC1X 8RR Amsterdam, The Netherlands CA 92101-4495, USA Oxford OX5 1GB, UK UK © 2005 Elsevier B.V. All rights reserved. This work is protected under copyright by Elsevier B.V., and the following terms and conditions apply to its use: Photocopying Single photocopies of single chapters may be made for personal use as allowed by national copyright laws. Permission of the Publisher and payment of a fee is required for all other photocopying, including multiple or systematic copying, copying for advertising or promotional purposes, resale, and all forms of document delivery. Special rates are available for educational institutions that wish to make photocopies for non-profit educational classroom use. Permissions may be sought directly from Elsevier's Rights Department in Oxford, UK: phone (+44) 1865 843830, fax (+44) 1865 853333, e-mail: [email protected]. Requests may also be completed on-line via the Elsevier homepage (http://www.elsevier. com/locate/permissions). In the USA, users may clear permissions and make payments through the Copyright Clearance Center, Inc., 222 Rosewood Drive, Danvers, MA 01923, USA; phone: (+1) (978) 7508400, fax: (+1) (978) 7504744, and in the UK through the Copyright Licensing Agency Rapid Clearance Service (CLARCS), 90 Tottenham Court Road, London W1P 0LP, UK; phone: (+44) 20 7631 5555; fax: (+44) 20 7631 5500. Other countries may have a local reprographic rights agency for payments. Derivative Works Tables of contents may be reproduced for internal circulation, but permission of the Publisher is required for external resale or distribution of such material. Permission of the Publisher is required for all other derivative works, including compilations and translations. Electronic Storage or Usage Permission of the Publisher is required to store or use electronically any material contained in this work, including any chapter or part of a chapter. Except as outlined above, no part of this work may be reproduced, stored in a retrieval system or transmitted in any form or by any means, electronic, mechanical, photocopying, recording or otherwise, without prior written permission of the Publisher. Address permissions requests to: Elsevier's Rights Department, at the fax and e-mail addresses noted above. Notice No responsibility is assumed by the Publisher for any injury and/or damage to persons or property as a matter of products liability, negligence or otherwise, or from any use or operation of any methods, products, instructions or ideas contained in the material herein. Because of rapid advances in the medical sciences, in particular, independent verification of diagnoses and drug dosages should be made. First edition 2005 Library of Congress Cataloging in Publication Data A catalog record is available from the Library of Congress. British Library Cataloguing in Publication Data A catalogue record is available from the British Library. ISBN: 0-444-51990-4 (Part A) 0-444-51991-2 (Part B) 0-444-51987-4 (Set) 0-444-51992-0 (CD) ISSN: 1570-7946 (Series) The paper used in this publication meets the requirements of ANSI/NISO Z39.48-1992 (Permanence of Paper). Printed in The Netherlands. Contents- Part B Process Operation and Control A Framework for the Mixed Integer Dynamic Optimisation of Waste Water Treatment Plants using Scenario-Dependent Optimal Control J. Busch, M. Santos', J. Oldenburg, A. Cruse and W. Marquardt ............................. 955 On-line Fault Diagnosis Support for Real Time Evolution applied to Multi- Component Distillation S. Ferrer-Nadal, I. Ydlamos-Ruiz, M. Graells and L. Puigjaner .............................. 961 Real-Time Feasibility of Nonlinear Predictive Control for Semi-batch Reactors H. Arellano-Garcia, T. Bar,,, M. Wendt and G. Wozny ............................................ 967 Control of Integrated Process Networks - A Multi-Time Scale Perspective M. Baldea and P. Daoutidis . ..................................................................................... 973 Minimum-Cost Operation in Heat-Exchanger Networks A. H. Gonzdlez and J. L. Marchetti ........................................................................... 979 An Online Decision Support Framework for Managing Abnormal Supply Chain Events M. Bansal, A. A dhitya, R. Srinivasan and i. A. Karimi ............................................. 985 Novel Scheduling of a Mixed Batch/Continuous Sugar Milling Plant using Petri nets M. Ghaeli, P. A. Bahri and P. L. Lee ........................................................................ 991 Improving Short-Term Planning by incorporating Scheduling Consequences P. Hei./nen, I. Bouwmans and Z. Verwater-Lukszo ................................................... 997 Multi-scale Planning and Scheduling in the Pharmaceutical Industry H. Stefansson and N. Shah ...................................................................................... 1003 Initiation and Inhibiting Mechanisms for Multi-tasking Control in Discrete Event Systems S. Macchietto, N. J. Alsop, R. J. Baird Z. P. Feng and B. H. Chen ....................... 1009 Model Based Parametric Control in Anaesthesia P. Dua, V. Dua and E. N. Pistikopoulos ................................................................. 1015 Anti-Slug Control Experiments on a Small-Scale Two-Phase Loop H. Sivertsen and S. Skogestad ................................................................................. 1021 Using CLP and MILP for Scheduling Commodities in a Pipeline L. Magat6o, L. V R. Arruda and F. Neves Jr ......................................................... 1027 Scheduling of a Pipeless Multi-Product Batch Plant using Mixed-Integer Programming Combined with Heuristics S. Panek, S. Engell and C. Lessner . ........................................................................ 1033 On the State-Task Network Formulation: Time Representations C. T. Maravelias ...................................................................................................... 1039 Optimization of Biopharmaceutical Manufacturing with Scheduling Tools - Experiences from the Real World C. A. Siletti, D. Petrides and A. Koulouris .............................................................. 1045 vi Advances in Robust Optimization Approaches for Scheduling under Uncertainty S. L. Janak and C. A. Floudas ................................................................................. 1051 Proactive Approach to address Robust Batch Process Scheduling under Short-Term Uncertainties A. Bonfill, A. Espu~a and L. Puigjaner ................................................................... 1057 A Rigorous MINLP for the Simultaneous Scheduling and Operation of Multiproduct Pipeline Systems R. Rejowski Jr. and J. M. Pinto ............................................................................... 1063 Multicommodity Transportation and Supply Problem with Stepwise Constant Cost Function Z. Lelkes, E. Rev, T. Farkas, Z. Fonyo, T. Kovacs and I. Jones .............................. 1069 Design and Planning of Supply Chains with Reverse Flows M. I. Gomes Salema, A. P. Barbosa-P6voa and A. Q. Novais ................................ 1075 Heterogeneous Batch Distillation Processes: Real System Optimization S. Pommier, S. Massebeuf V. Gerbaud, O. Baudouin, P. Baudet andX. Joulia .... 1081 Modelling and Optimisation of Distributed-Parameter Batch and Semi-batch Reactor Systems X. Zheng, Robin Smith and C. Theodoropoulos ...................................................... 1087 Optimal Start-up of Micro Power Generation Processes P. I. Barton, A. Mitsos and B. Chachuat ................................................................. 1093 Performance Monitoring of Industrial Controllers Based on the Predictability of Controller Behavior R. A. Ghraizi, E. Martinez, C. de Prada, F. Cifuentes and J. L. Martinez ............. 1099 A Systematic Approach to Plant-Wide Control Based on Thermodynamics L. T. Antelo, I. Otero-Muras, J. R. Banga and A. A. Alonso ................................... 1105 A Multiple Model, State Feedback Strategy for Robust Control of Nonlinear Processes F. E Wang, P. A. Bahri, P. L. Lee and I. T. Cameron ............................................ 1111 A Robust Discriminate Analysis Method for Process Fault Diagnosis D. Wang and J. A. Romagnoli ................................................................................. 1117 Learning in Intelligent Systems for Process Safety Analysis C. Zhao and V. Venkatasubramanian ..................................................................... 1123 Multivariate Decision Trees for the Interrogation of Bioprocess Data K. Kipling, G. Montague, E. B. Martin and A. J. Morris ........................................ 1129 On a New Definition of a Stochastic-Based Accuracy Concept of Data Reconciliation-Based Estimators M. Bagajewicz ......................................................................................................... 1135 The Integration of Process and Spectroscopic Data for Enhanced Knowledge Extraction in Batch Processes C. W. L. Wong, R. E. A. Escott, A. J. Morris and E. B. Martin ............................... 1141 A Systematic Approach for Soft Sensor Development B. Lin, B. Recke, P. Renaudat, J. Knudsen and S. B. Jorgensen ............................. 1147 vii Application of Multi-Objective Optimisation to Process Measurement System Design D. Brown, F. MarOchal, G. Heyen and J. Paris ...................................................... 1153 Utilities Systems On-Line Optimization and Monitoring: Experiences from the Real World D. Ruiz, J. Mamprin, C. Ruiz, D. Nelson and G. Roseme ....................................... 1159 A Continuous-Time Formulation for Scheduling Multi-Stage Multi-product Batch Plants with Non-identical Parallel Units L. Fu and L A. Karimi .............................................................................................. 1165 Optimal Scheduling of Supply Chains: A New Continuous-Time Formulation A. C. S. Amaro andA. P. Barbosa-P6voa ............................................................... 1171 Effect of Pricing, Advertisement and Competition in Multisite Capacity Planning M. Bagq/ewicz ......................................................................................................... 1177 Multi-objective Optimization of Curds Manufacture N. G. Vaklieva, A. Espu~a, E. G. Shopova, B. B. Ivanov and L. Puigianer ............ 1183 Global Supply Chain Network Optimization for Pharmaceuticals R. T. Sousa, N. Shah and L. G. Papageorgiou ........................................................ 1189 Linear Quadratic Control Problem in Biomedical Engineering L E Sanchez Chdvez, R. Morales-Mendndez and S. O. Martinez Chapa ............... 1195 Using Structured and Unstructured Estimators for Distillation Units: A Critical Comparison F. Bezzo, R. Muradore and M. Barolo .................................................................... 1201 Modeling of Complex Dynamics in Reaction-Diffusion-Convection Model of Cross- Flow Reactor with Thermokinetic Autocatalysis T. TrdvniOkovd, L Schreiber and M. KubiOek ......................................................... 1207 A Design and Scheduling RTN Continuous-time Formulation P. M. Castro, A. P. Barbosa-P6voa and A. Q. Novais ............................................ 1213 Use of Perfect Indirect Control to Minimize the State Deviations E. S. Hori, S. Skogeslad and W. H. Kwong ............................................................. 1219 Constraints Propagation Techniques in Batch Plants Planning and Scheduling M. T. M. Rodrigues and L. Gimeno ......................................................................... 1225 Information Logistics for Supply Chain Management within Process Industry Environments M. Vegelti, S. Gonnet, G. Henning and H. Leone ................................................... 1231 Plant Structure Based Equipment Assignment in Control Recipe Generation Considering Conflicts with Other Batches T. Fuchino and H. Watanabe .................................................................................. 1237 IMC Design of Cascade Control M. R. Cesca and J. L. Marchetti .............................................................................. 1243 Robust Model-Based Predictive Controller for Hybrid System via Parametric Programming A. M. Manthanwar, V. Sakizlis, V. Dua and E. N. Pistikopoulos ............................ 1249 viii Model Based Operation of Emulsion Polymerization Reactors with Evaporative Cooling: Application to Vinyl Acetate Homopolymerization S. Arora, R. Gesthuisen and S. Engell ..................................................................... 1255 Event-Based Approach for Supply Chain Fault Analysis R. Sarrate, F. Nejjari, F. D. Mele, J. Quevedo and L. Puigjaner ........................... 1261 Back-off Application for Dynamic Optimisation and Control of Nonlinear Processes S. 1. Biagiola, A. Bandoni and J. L. Figueroa ......................................................... 1267 Operational Planning of Crude Oil Processing Terminals A. M. Blanco, A. B. Morales Diaz, A. Rodriguez Angeles and A. Sdnchez ............. 1273 A Hierarchical Approach to Optimize LNG Fractionation Units H. E. Alfadala, B. M. Ahmad andA. F. Warsame ................................................... 1279 First Principles Model Based Control M. Rodriguez and D. Pdrez ..................................................................................... 1285 On-line Oxygen Uptake Rate as a New Tool for Monitoring and Controlling the SBR Process S. Puig, Ll. Corominas, J. Colomer, M. D. Balaguer and J. Colprim .................... 1291 On-Line Dynamic Monitoring of the SHARON Process for Sustainable Nitrogen Removal from Wastewater K. Villez, C. Rosen, S. Van Hulle, C. Yoo and P. A. Vanrolleghem ........................ 1297 Robust Controller Design for a Chemical Reactor M. Bako~ovd, D. Puna and A. Mdsz~ros ................................................................. 1303 A M1NLP/RCPSP Decomposition Approach for the Short-Term Planning of Batch Production N. Trautmann and C. Schwindt ............................................................................... 1309 A Framework for On-line Full Optimising Control of Chemical Processes P. A. Rolandi and J. A. Romagnoli .......................................................................... 1315 Wavelet-Based Nonlinear Multivariate Statistical Process Control A. H. S. Maulud, D. Wang and J. A. Romagnoli ..................................................... 1321 Anaerobic Digestion Process Parameter Identification and Marginal Confidence Intervals by Multivariate Steady State Analysis and Bootstrap G. Ruiz, M. Castellano, W. Gonzdlez, E. Roca and J. M. Lema .............................. 1327 An Efficient Real-Time Dynamic Optimisation Architecture for the Control of Non- Isothermal Tubular Reactors M. R. Garcia, E. Balsa-Canto, C. Vilas, J. R. Banga andA. A. Alonso ................. 1333 Model Based Control of Solidification B. Furenes and B. Lie .............................................................................................. 1339 h-Techsight: A Knowledge Management Platform for Technology Intensive Industries A. Kokossis, R. Ba~ares-Alc(mtara, L. Jimdnez Esteller and P. Linke ................... 1345 Modelling for Control of Industrial Fermentation J. K. Rasmussen, H. Madsen and S. B. Jorgensen .................................................. 1351 ix System-Dynamics Modelling to Improve Complex Inventory Management in a Batch-Wise Plant Z. I,'erwater-Lukszo and 7". S. Christina .................................................................. 1357 Dynamic Modeling and Nonlinear Model Predictive Control of a Fluid Catalytic Cracking Unit R. Roman, Z. K. Nag3,, F. AllgOwer and S. Agachi ................................................. 1363 Improving of Wavelets Filtering Approaches R. I. ~. Tona, .4. Espu~a ~lncl L. Pui~/aner . ................................................................ 1369 Supply Chain Monitoring: A Statistical Approach F. D. Me/e, E. Musulin and L. Pui~/aner. ............................................................... 1375 Closing the Intbrmation Loop in Recipe-Based Batch Production E. Mztsulin, M. d. Arbiza, A. Bon/il[ and L. Puigffaner ............................................ 1381 Agent-Based Intelligent System Development for Decision Support in Chemical Process Industry ): Oao and A. Kokossis ........................................................................................... 1387 Enhanced Modelling of an [industrial Fermentation Process through Data Fusion Techniques S. Triadaphillou, E. B. Martin, G. Montague, P. Je~jkins, S. Stimpson and A. Nordon ..................................................................................................................... 1393 Implementation of Multi-Kalman Filter to Detect Runaway Situations and Recover Control R. Nomen, d. Sem/gere, E. Serra and d. Cano .......................................................... 1399 Supply Chain Management through a Combined Simulation-Optimisation Approach F. D. Mele, A. Espu~a and L. Pui~janer ................................................................. 1405 Data-Based Internal Model Controller Design for a Class of Nonlinear Systems A. G. Kalnlukale and M.-S. Chiu ............................................................................. 1411 Measurement-Based Run-to-run Optimization of a Batch Reaction-Distillation System A. Marchetti, B. Srinivasan, D. Bonvin, S. Elgue, L. Prat and M. Cabassud ......... 1417 Nonlinear Behaviour of a Low-Density Polyethylene Tubular Reactor-Separator- Recycle System M. H~/ele, I. Disli-Uslu, A. Kienle, I': M. Krishna, S. Pushpavanam and C.-U. Schmidt .................................................................................................................... ! 423 Control and Optimal Operation of Simple Heat Pump Cycles J. B. Jensen and S. Skogestad .................................................................................. 1429 Advanced Process Control of Pantolactone Synthesis using Nonlinear Model Predictive Control (NMPC) ('. Cormos and S. A,~zachi ........................................................................................ 1435 Design and Analysis of a Classical Controller to the Residual Oil in a Small Scale Semibatch Extractor A. F. Cust6dio, D. F. Rezende, M. R. Wolj:Maciel and R. M. Filho ....................... 1441 Optimal Sensor Network Design and Upgrade using Tabu Search M. C. Carnero, ,1. L. Hern(mdez and M. C. Sdmchez ............................................... 1447