European Symposium on Computer Aided Process Engineering - 11, 34 European Symposium of the Working Party on Computer Aided Process Engineering

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This book contains papers presented at the 11th Symposium of Computer Aided Process Engineering (ESCAPE-11), held in Kolding, Denmark, from May 27-30, 2001. The objective of ESCAPE-11 is to highlight the use of computers and information technology tools, that is, the traditional CAPE topics as well as the new CAPE topics of current and future interests.The main theme for ESCAPE-11 is process and tools integration with emphasis on hybrid processing, cleaner and efficient technologies (process integration), computer aided systems for modelling, design, synthesis, control (tools integration) and industrial case studies (application of integrated strategies). The papers are arranged in terms of the following themes: computer aided control/operations, computer aided manufacturing, process and tools integration, and new frontiers in CAPE. A total of 188 papers, consisting of 5 keynote and 183 contributed papers are included in this book.

Author(s): Rafiqul Gani and Sten Bay Jørgensen (Eds.)
Series: Computer Aided Chemical Engineering 9
Edition: 1
Publisher: Elsevier, Academic Press
Year: 2001

Language: English
Pages: 1-1186

Content:
Preface
Page v
Rafiqul Gani, Sten Bay Jørgensen

Autonomy in automation: trends, technologies, tools Original Research Article
Pages 1-13
Tariq Samad, Darren Cofer

New challenges and opportunities for process modelling Original Research Article
Pages 15-26
Constantinos C. Pantelides

Use of prediction and modelling in early evaluation of process options Original Research Article
Pages 27-40
J.L. Cordiner

A Multiscale-multifaceted approach to process synthesis and development Original Research Article
Pages 41-54
Ka M. Ng

Systems Biology: an emerging theme in biological research Original Research Article
Pages 55-68
Gregory Stephanopoulos, William A. Schmitt

Modelling of nonlinear process dynamics using Kohonen's neural networks, fuzzy systems and Chebyshev series Original Research Article
Pages 69-74
A.P. Alexandridis, C.I. Siettos, H.K. Sarimveis, A.G. Boudouvis, G.V Bafas

A systematic methodology for empirical modeling of non-linear state space systems Original Research Article
Pages 75-80
J.P. Barnard, C. Aldrich

Modelling of air pollution in an environmental system by use of non-linear independent component analysis Original Research Article
Pages 81-86
J.P. Barnard, C. Aldrich

A life-cycle approach for model reuse and exchange Original Research Article
Pages 87-92
Rafael Batres, Atsushi Aoyama, Yuji Naka

Dynamics of a reactive distillation column for TAME synthesis described by a nonequilibrium stage model Original Research Article
Pages 93-98
R. Baur, R. Taylor, R. Krishna

Dynamics of heat-integrated heterogeneous tubular reactors with axial heat conductivity in reactor wall Original Research Article
Pages 99-104
M. Berezowski, E.W. Jacobsen, R. Grzywacz

Simulation and experimental study of intermediate heat exchange in a sieve tray distillation column Original Research Article
Pages 105-110
Ingela Niklasson Björn, Urban Grén, Fredrik Svensson

On-line modelling in the petroleum industry: Successful applications and future perspectives Original Research Article
Pages 111-116
David B. Cameron, R. Jørgen Ødegaard, Erik Glende

Implementation of a failure model validation technique using a discrete-event batch simulator : Application to semiconductor manufacturing Original Research Article
Pages 117-122
A.S. Charles, C. Azzaro-Pantel, S. Domenech, L. Pibouleau, P. Floquet, D. Jaume, F. Tilhac

Automatic structural characterization of DAE systems Original Research Article
Pages 123-128
E.F Costa Jr., R.C. Vieira, A.R. Secchi, E.C. Biscaia Jr.

Steady state analysis of membrane processes for the treatment of industrial effluents Original Research Article
Pages 129-134
A.M. Eliceche, S.M. Corvalán, I. Ortiz

Bifurcation analysis of periodically forced systems via continuation of a discrete map Original Research Article
Pages 135-140
V. Faraoni, E. Mancusi, L. Russo, G. Continillo

Modelling and optimisation of a high density fermentation process using multi-linear models: An application to a bench scale bioreactor Original Research Article
Pages 141-146
Omar Galán, Ahmet Palazoglu, José A. Romagnoli

Simulation of the FGD in-duct injection technology using complex kinetic models Original Research Article
Pages 147-152
A. Garea, J.A. Marqués, T.L. Hechavarría, A. Irabien

EQUISTAR: Reliable software for design of nonideal and reactive systems Original Research Article
Pages 153-158
S.T. Harding, C.A. Floudas

CFD modeling of fast chemical reactions in turbulent liquid flows Original Research Article
Pages 159-164
L.K. Hjertager, B.H. Hjertager, T. Solberg

Symbolic discretization of distributed parameter process models on self-adaptive moving grids Original Research Article
Pages 165-170
R. K/:ohler, J. Rieber, M. Zeitz

Computational tools for nonlinear dynamical and bifurcation analysis of chemical engineering problems Original Research Article
Pages 171-176
M. Kohout, I. Schreiber, M. Kubíek

Multi-scale modelling of growing polymer particles in heterogeneous catalytic reactors Original Research Article
Pages 177-182
J. Kosek, F. Stepanek, A. Novak, Z. Grof, M. Marek

Semi-batch emulsion copolymerization: A general model for a copolymer formed from n monomer units Original Research Article
Pages 183-188
Stefan Krämer, Ralf Gesthuisena

Computer aided continuous time stochastic process modelling Original Research Article
Pages 189-194
Niels Rode Kristensen, Henrik Madsen, Sten Bay Jørgensen

Assumption retrieval from process models Original Research Article
Pages 195-200
R. Lakner, K.M. Hangos, I.T. Cameron

Dynamic simulation of batch crystallization process by using moving finite difference method Original Research Article
Pages 201-206
Y.I. Lim, J.M. Le Lann, X.M. Meyer, X. Joulia

Effective model reduction for analysis of distributed parameter systems Original Research Article
Pages 207-212
Yi Liu, Elling W. Jacobsen

Global Terrain methods for chemical process simulation Original Research Article
Pages 213-218
A. Lucia, F. Yang

Estimation of a deactivation model for the methanol synthesis catalyst from historic process data Original Research Article
Pages 219-224
Ingvild Løvik, Morten Rønnekleiv, Ola Olsvik, Terje Hertzberg

Nonlinear analysis of an industrial ammonia reactor with heterogeneous model Original Research Article
Pages 225-230
E. Mancusi, P.L. Maffettone, F. Gioia, S. Crescitelli

Mixed mode simulation - Adding equation oriented convergence to a sequential modular simulation tool Original Research Article
Pages 231-236
Marcelo Marchetti, Ashok Rao, David Vickery, the Aspen Plus Development Team

Adaptive optimal operation of the Fenton's batch process for industrial wastewater treatment Original Research Article
Pages 237-242
E.C. Martinez, G.D. López

Generalized reactor model: An object oriented approach to reactor modeling Original Research Article
Pages 243-248
Arun S. Moharir, Sunil S. Shah, Ravindra D. Gudi, Brian M. Devereux, Kurt Vanden Bussche, Ganesh Venimadhavan

Step restriction for a bounded Newton's method Original Research Article
Pages 249-254
W. Morton, L. Kozel, P.P.S. Lim, D. Douglas

Improving robustness using homotopy as an open solver in a dynamic simulation package Original Research Article
Pages 255-260
Jorge R. Paloschi

Using wavelets in process identification: A new link to the state space Original Research Article
Pages 261-266
Heinz A. Preisig

Evaluation of coupled reactive distillation performances by means of a rigorous simulation procedure Original Research Article
Pages 267-272
D. Rouzineau, M. Meyer, M. Prevost

An adjoint-based algorithm for mixed-integer dynamic optimization Original Research Article
Pages 273-278
V. Sakizlis, V. Bansal, R. Ross, J.D. Perkins, E.N. Pistikopoulos

A hybrid mathematical model for a three-phase industrial hydrogenation reactor Original Research Article
Pages 279-284
P.L. Santana, E.C. Vasco de Toledo, L.A.C. Meleiro, R. Scheffer, B.B. Freitas Jr., M.R.W. Maciel, R. Maciel Filho

Complex reactive absorption processes: model optimisation and dynamic column simulation Original Research Article
Pages 285-290
R. Schneider, E.Y. Kenig, A. Górak

A web-based library for testing performance of numerical software for solving nonlinear algebraic equations Original Research Article
Pages 291-296
M. Shacham, N. Brauner, M.B. Cutlip

Analysis and consistency of process models with application to ammonia production Original Research Article
Pages 297-302
V. Siepmann, T. Haug-Warberg, K.W. Mathisen

Dynamic modelling of chromatographic processes: A systematic procedure for isotherms determination Original Research Article
Pages 303-308
H.K. Teoh, E. Sørensen, M. Turner, N. Titchener-Hooker

Process simulation and analysis with heterogeneous models Original Research Article
Pages 309-314
John E. Tolsma, Paul I. Barton

A structured and selective framework for hybrid mechanistic-empirical model building Original Research Article
Pages 315-320
Pedro Vale Lima, Pedro M. Saraiva

Validations of the nonequilibrium stage model and of a new efficiency correlation for non ideal distillation process through simulated and experimental data Original Research Article
Pages 321-326
M.R. Wolf-Maciel, C. Soares, A.A.C. Barros

Simulation of an industrial olefin polymerization FBR operating under condensed mode Original Research Article
Pages 327-332
A. Yiagopoulos, H. Yiannoulakis, J. Morris, C. Kiparissides

An extended self-organizing map with application to the modeling of pulse jet fabric filters Original Research Article
Pages 333-338
Hualiang Zhuang, Min-Sen Chiu

Feed pretreatment for binary distillation efficiency improvement Original Research Article
Pages 339-344
Rakesh Agrawal, D. Michael Herron

A Flowsheet-centered architecture for conceptual design Original Research Article
Pages 345-350
B. Bayer, K. Weidenhaupt, M. Jarke, W. Marquardt

Systematic generation of the optimal and alternative flowsheets for azeotropic-distillation systems Original Research Article
Pages 351-356
B. Bertok, F. Friedler, G. Feng, L.T. Fan

Reactor selection and design for heterogeneous reaction systems Original Research Article
Pages 357-362
Christian Bühner, Gerhard Schembecker

Generalized disjunctive programming model for the synthesis of thermally linked distillation systems Original Research Article
Pages 363-368
J.A Caballero, I.E. Grossmann

An optimization approach to the design of value-added soybean oil products Original Research Article
Pages 369-374
K.V. Camarda, P. Sunderesan, S. Siddhaye, G.J. Suppes, J. Heppert

ECOFAC - Computer aided solvent design and evaluation in environmental problems, based on group contribution methods with association Original Research Article
Pages 375-380
M. Cismondi, E.A. Brignole

Evolutionary synthesis of almost closed conservational processes Original Research Article
Pages 381-386
B. Csukas, S. Balogh

Analysis of azeotropic distillation columns combined with pervaporation membranes Original Research Article
Pages 387-392
A.M. Eliceche, P.M. Hoch, I. Ortiz

Nonlinear bilevel programming: A deterministic global optimization framework Original Research Article
Pages 393-400
Z.H. Gümüş, C.A. Floudas

Systematic methodologies for chemical reaction analysis Original Research Article
Pages 401-406
M. Hostrup, S. Balakrishna

An efficient approach to quantify process feasibility based on convex hull Original Research Article
Pages 407-412
Marianthi G. Ierapetritou

Design, sizing and modeling of a reactive extractive distillation unit and solvent recovery system Original Research Article
Pages 413-418
L. Jiménez, J. Costa

Modeling a multi-step protein synthesis and purification process: A case study of a CAPE application in the pharmaceutical industry Original Research Article
Pages 419-426
David Kahn, Richard Plapp, Ajay Modi

New designed TSA bed with cooling jacket for purification and regeneration of benzene and toluene Original Research Article
Pages 427-432
Daeho Ko, Mikyung Kim, I1 Moon, Dae-Ki Choi

Dynamic optimization for air separation plants Original Research Article
Pages 433-438
A. Kröner, Th. Kronseder, G. Engl, O.V. Stryk

TRIZ-based creative retrofitting of complex distillation processes —An industrial case study Original Research Article
Pages 439-444
Xiao-Ning Li, Ben-Guang Rong, Andrzej Kraslawski

Retrofit of Refinery Hydrogen Systems Original Research Article
Pages 445-450
F. Liu, N. Hallale

Computer — Aided synthesis of molecular mixtures and process streams Original Research Article
Pages 451-456
E.C. Marcoulaki, A.C. Kokossis, F.A. Batzias

A tool for optimal synthesis of industrial refrigeration systems Original Research Article
Pages 457-462
F. Marechal, B. Kalitventzeff

Design of reactive distillation process for fatty acid esterification Original Research Article
Pages 463-468
Florin Omota, Alexandra C. Dimian, Alfred Bliek

Selection of separation sequences by case-based reasoning Original Research Article
Pages 469-474
E. Pajula, T. Seuranen, M. Hurme

Optimal multi-floor process plant layout Original Research Article
Pages 475-480
Dimitrios I. Patsiatzis, Lazaros G. Papageorgiou

Plate fin heat exchanger design using simulated annealing Original Research Article
Pages 481-486
J.-M. Reneaume, N. Niclout

Optimal synthesis of liquid-liquid multistage extractors Original Research Article
Pages 487-492
Juan A. Reyes-Labarta, Ignacio E. Grossmann

Development of novel process designs for simultaneous oxidation and denitrification of wastewaters Original Research Article
Pages 493-498
S. Rigopoulos, P. Linke, A. Kokossisb

Middle vessel heterogeneous batch distillation of an azeotropic mixture Original Research Article
Pages 499-504
I. Rodriguez-Donis, V. Gerbaud, X. Joulia

Optimisation of heat integrated distillation sequences in the context of background process Original Research Article
Pages 505-510
Anupam Samanta, Megan Jobson

A new heat integration model for streams of variable temperature and constrained matches Original Research Article
Pages 511-516
Anupam Samanta, Megan Jobson

Tools for reactive distillation column design: Graphical and stage-to-stage computation methods Original Research Article
Pages 517-522
Sanchez Daza Oscar, Pérez-Cisneros Eduardo, Erik Bek-Pedersen, Martin Hostrup

Development of software tools for crystallization system synthesis Original Research Article
Pages 523-528
Joseph W. Schroer, Christianto Wibowo, Ka M. Ng, Lionel O'Young

Optimization of ethylene process design Original Research Article
Pages 529-534
G. Sobočan, P. Glavič

Optimization of an acidic chlorine scrubber with a rate-based simulation engine Original Research Article
Pages 535-540
W. Steinbach, A. Friedl, H. Hofbauer

An accelerated branch-and-bound algorithm for assignment problems of utility systems Original Research Article
Pages 541-546
Alexandros M. Strouvalis, Istvan Heckl, Ferenc Friedler, Antonis C. Kokossis

Retrofit design of chemical processing networks under uncertainties: Application to petrochemical industry Original Research Article
Pages 547-552
Min-ho Suh, Ferenc Friedler, Sunwon Park, Tai-yong Lee

Optimisation of an industrial scale ethanol dehydration plant: A case study Original Research Article
Pages 553-558
Z. Szitkai, Z. Lelkes, E. Rev, Z. Fonyo

Computer aided design and analysis of separation processes with electrolyte systems Original Research Article
Pages 559-566
Kiyoteru Takano, Rafiqul Gani, Petr Kolar, Takeshi Ishikawa

Characterization and simulation of the pervaporation process for separating azeotropic mixtures Original Research Article
Pages 567-572
M. E. Torres Alvarez, R.F. Martini, M.R. Wolf-Maciel

A screening method for identifying economic improvement potentials in retrofit design Original Research Article
Pages 573-578
E. Uerdingen, U. Fischer, K. Hungerbühler

MILP models for the synthesis of protein purification processes Original Research Article
Pages 579-584
E. Vasquez-Alvarez, J.M. Pinto

A CAPD approach for reaction solvent design Original Research Article
Pages 585-590
Y.P. Wang, L.E.K. Achenie

Automatic synthesis of complex separation sequences with recycles Original Research Article
Pages 591-596
Stanislaw K. Wasylkiewicz, Francisco J.L. Castillo

Model based temperature control of an exothermic semi-batch reactor Original Research Article
Pages 597-602
M. Aartovaara

Adaptive general predictive controller for a nonlinear bioreactor Original Research Article
Pages 603-608
B. Akay, S. ErtunÇ, N. Bursah, H. Hapolu, M. Alpbaz

Optimal control of semi-batch reactors Original Research Article
Pages 609-614
N. Aziz, I.M. Mujtaba

Feedback control design by Lyapunov's direct method Original Research Article
Pages 615-620
Anibal M. Blanco, Jose L. Figueroa, J. Alberto Bandoni

Batch to Batch Improving Control of Yeast Fermentation Original Research Article
Pages 621-626
D. Bonné, S. Bay Jørgensen

Distillation control using passivity Original Research Article
Pages 627-632
Duncan P. Coffey, B. Erik Ydstie, Torben R. Andersen, Sten Bay Jørgensen

A novel adaptive multivariable DMC controller. Application to an industrial reactor Original Research Article
Pages 633-638
E.C. Dechechi, L.A.C. Meleiro, R. Maciel Filho