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Original Articles

A Comprehensive Simulator/Database Package for Reviewing Free-Radical Homopolymerizations

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Pages 199-404 | Published online: 23 Sep 2006

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Read on this site (13)

David Dorschner, Woosung Jung, Marzieh Riahinezhad, Thomas A. Duever & Alexander Penlidis. (2017) Case studies with mathematical modeling of free-radical multi-component bulk/solution polymerizations: Part 2. Journal of Macromolecular Science, Part A 54:6, pages 339-371.
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Woosung Jung, Marzieh Riahinezhad, Thomas A. Duever & Alexander Penlidis. (2015) Case Studies With Mathematical Modeling of Free-Radical Multi-Component Bulk/Solution Polymerizations: Part 1. Journal of Macromolecular Science, Part A 52:9, pages 659-698.
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Samaneh Khanlari & Marc A. Dubé. (2015) Effect of pH on Poly(acrylic acid) Solution Polymerization. Journal of Macromolecular Science, Part A 52:8, pages 587-592.
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Afsaneh Nabifar, NeilT. Mcmanus, Eduardo Vivaldo-Lima & Alexander Penlidis. (2010) Kinetic Aspects of Styrene Polymerization with an Acyloxyamine. Journal of Macromolecular Science, Part A 47:6, pages 496-502.
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Takuji Fujisawa & Alexander Penlidis. (2008) Copolymer Composition Control Policies: Characteristics and Applications. Journal of Macromolecular Science, Part A 45:2, pages 115-132.
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R. Khesareh, N. T. McManus & A. Penlidis. (2006) High-Temperature Bulk Copolymerization of Methyl Methacrylate and Acrylonitrile: III. Thermal Polymerization. Polymer-Plastics Technology and Engineering 45:6, pages 653-658.
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R. Khesareh, N. T. McManus & A. Penlidis. (2006) High Temperature Bulk Copolymerization of Methyl Methacrylate and Acrylonitrile: II. Full Conversion Range Experiments. Journal of Macromolecular Science, Part A 43:1, pages 23-37.
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B. R. Barclay, A. Penlidis & J. Gao. (2003) Modelling and Simulation of Complex Aspects of Multicomponent Emulsion Polymerization . Polymer Reaction Engineering 11:4, pages 737-814.
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Carlos Guerrero‐Sánchez, Enrique Saldívar, Martín Hernández & Arturo Jiménez. (2003) A Practical, Systematic Approach for the Scaling‐Up and Modeling of Industrial Copolymerization Reactors. Polymer Reaction Engineering 11:3, pages 457-506.
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C. Badeen & M. A. Dubé. (2003) Modeling the Copolymerization of Methyl Methacrylate/α‐Methyl Styrene at Elevated Temperatures Using Java™. Polymer Reaction Engineering 11:1, pages 53-77.
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Eduardo Vivaldo-Lima & Arturo de Jesús Mendoza-Fuentes. (2002) DEVELOPMENT OF A KINETIC MODEL FOR INIFERTER CONTROLLED/“LIVING” FREE-RADICAL POLYMERIZATION CONSIDERING DIFFUSION-CONTROLLED EFFECTS * . Polymer Reaction Engineering 10:4, pages 193-226.
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R. Dhib, J. Gao & A. Penlidis. (2000) Simulation of Free Radical Bulk/Solution Homopolymerization Using Mono- and Bi-functional Initiators. Polymer Reaction Engineering 8:4, pages 299-464.
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J. Gao & A. Penlidis. (1998) A Comprehensive Simulator/Database Package for Reviewing Free-Radical Copolymerizations. Journal of Macromolecular Science, Part C 38:4, pages 651-780.
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Articles from other publishers (66)

Junjie Wang, Lei Ni, Jiawei Cui, Juncheng Jiang & Kuibin Zhou. (2020) Thermal Hazard Analysis of Styrene Polymerization in Microreactor of Varying Diameter. Processes 8:12, pages 1650.
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Lei Ni, Jiawei Cui, Juncheng Jiang, Yong Pan, Hao Wu, Chi-Min Shu, Zhirong Wang, Shanjun Mou & Ning Shi. (2020) Runaway inhibition of styrene polymerization: A simulation study by chaos divergence theory. Process Safety and Environmental Protection 135, pages 294-300.
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Saeed Laki, Ahmad A. Shamsabadi, Hossein Riazi, Michael C. Grady, Andrew M. Rappe & Masoud Soroush. (2019) Experimental and Mechanistic Modeling Study of Self-Initiated High-Temperature Polymerization of Ethyl Acrylate. Industrial & Engineering Chemistry Research 59:6, pages 2621-2630.
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Jiawei Cui, Lei Ni, Juncheng Jiang, Yong Pan, Hao Wu & Qiang Chen. (2019) Computational Fluid Dynamics Simulation of Thermal Runaway Reaction of Styrene Polymerization. Organic Process Research & Development 23:3, pages 389-396.
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Hossein Riazi, Ahmad A. Shamsabadi, Michael C. Grady, Andrew M. Rappe & Masoud Soroush. (2018) Experimental and Theoretical Study of the Self-Initiation Reaction of Methyl Acrylate in Free-Radical Polymerization. Industrial & Engineering Chemistry Research 57:2, pages 532-539.
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Shidan Cummings, Yujie Zhang, Niousha Kazemi, Alexander Penlidis & Marc A. Dubé. (2016) Determination of reactivity ratios for the copolymerization of poly(acrylic acid- co -itaconic acid) . Journal of Applied Polymer Science 133:40.
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Dagmar R. D’hooge, Paul H.M. Van Steenberge, Marie-Françoise Reyniers & Guy B. Marin. (2016) The strength of multi-scale modeling to unveil the complexity of radical polymerization. Progress in Polymer Science 58, pages 59-89.
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Yujie Zhang, Marc A. Dubé & Eduardo Vivaldo-Lima. (2016) Modelling Degradative Chain Transfer in d -Limonene/2-Ethylhexyl Acrylate Free-Radical Copolymerization . Macromolecular Symposia 360:1, pages 185-191.
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Shanshan Ren, Eduardo Vivaldo-Lima & Marc Dubé. (2015) Modeling of the Copolymerization Kinetics of n-Butyl Acrylate and d-Limonene Using PREDICI ®. Processes 4:1, pages 1.
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Jonathan B. Mueller, Joachim Fischer, Frederik Mayer, Muamer Kadic & Martin Wegener. (2014) Polymerization Kinetics in Three-Dimensional Direct Laser Writing. Advanced Materials 26:38, pages 6566-6571.
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Abiola J. Kehinde, Mohammed A. Usman & Rasheed U. Owolabi. (2013) Solvent-initiator compatibility and sensitivity of conversion of styrene homo-polymerization. Journal of Polymer Engineering 33:9, pages 775-783.
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Carolina Toloza Porras, Dagmar R. D'hooge, Paul H. M. Van Steenberge, Marie-Françoise Reyniers & Guy B. Marin. (2013) A Theoretical Exploration of the Potential of ICAR ATRP for One- and Two-Pot Synthesis of Well-Defined Diblock Copolymers. Macromolecular Reaction Engineering 7:7, pages 311-326.
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John D. Woloszyn, Pascal Hesse, Klaus-Dieter Hungenberg & Kimberley B. McAuley. (2013) Parameter Selection and Estimation Techniques in a Styrene Polymerization Model. Macromolecular Reaction Engineering 7:7, pages 293-310.
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Phlipp Vana, Robson Storey, Yusuf Yagci, Peter Nesvadba, Bradford Wayland, Graeme Moad & Atsushi GotoF. Ehlers, J. Barth & P. Vana. 2013. Fundamentals of Controlled/Living Radical Polymerization. Fundamentals of Controlled/Living Radical Polymerization 1 59 .
S. Zhu & A. Hamielec. 2012. Polymer Science: A Comprehensive Reference. Polymer Science: A Comprehensive Reference 779 831 .
John D. Woloszyn & Kimberley B. McAuley. (2011) Application of Parameter Selection and Estimation Techniques in a Thermal Styrene Polymerization Model. Macromolecular Reaction Engineering 5:9-10, pages 453-466.
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Kiyumars Jalili, Farhang Abbasi & Morteza Nasiri. (2011) Copolymerization of styrene and methyl methacrylate. Part I: Experimental kinetics and mathematical modeling. Polymer 52:19, pages 4362-4376.
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Cui-Ping Li, Jia-Qiang Wang, Jun Lin, Yan Shi & Zhi-Feng Fu. (2011) Controlled synthesis of branched polystyrene via free radical polymerization of novel chain transfer monomer. Macromolecular Research 19:8, pages 770-777.
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Marc A. Dubé & Somaieh Salehpour. 2011. Green Polymerization Methods. Green Polymerization Methods 143 161 .
Bruno S. Amaro & Efstratios N. Pistikopoulos. 2010. Process Systems Engineering. Process Systems Engineering 67 104 .
Bruno S. Amaro & Efstratios N. Pistikopoulos. 2010. Process Systems Engineering. Process Systems Engineering 67 104 .
Paula F. de M. P. B. Machado & Liliane M. F. Lona. (2010) Analyzing the real advantages of bifunctional initiator over monofunctional initiator in free radical polymerization. Journal of Applied Polymer Science 117:5, pages 2803-2816.
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Haresh Patel, Farhad Ein-Mozaffari & Ramdhane Dhib. (2010) CFD analysis of mixing in thermal polymerization of styrene. Computers & Chemical Engineering 34:4, pages 421-429.
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H. Patel, R. Dhib & F. Ein‐Mozaffari. (2010) Computational Fluid Dynamics Study of a Styrene Polymerization Reactor. Chemical Engineering & Technology 33:2, pages 258-266.
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Afsaneh Nabifar, Neil T. McManus, Eduardo Vivaldo-Lima, Liliane M.F. Lona & Alexander Penlidis. (2009) Thermal polymerization of styrene in the presence of TEMPO. Chemical Engineering Science 64:2, pages 304-312.
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Somaieh Salehpour & Marc A Dubé. (2008) The use of biodiesel as a green polymerization solvent at elevated temperatures. Polymer International 57:6, pages 854-862.
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Somaieh Salehpour & Marc A. Dubé. (2008) Biodiesel: a green polymerization solvent. Green Chemistry 10:3, pages 321.
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Dimitris S. Achilias. (2007) A Review of Modeling of Diffusion Controlled Polymerization Reactions. Macromolecular Theory and Simulations 16:4, pages 319-347.
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Matthew J. Scorah, Ramdhane Dhib & Alexander Penlidis. (2007) Recent Advances in the Study of Multifunctional Initiators in Free Radical Polymerizations. Macromolecular Reaction Engineering 1:2, pages 209-221.
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Robin A. Hutchinson & Alexander Penlidis. 2007. Polymer Reaction Engineering. Polymer Reaction Engineering 118 178 .
Wilson H. Hirota, Reinaldo Giudici & Cláudia Sayer. (2006) Initiation Efficiency Reduction in Semicontinuous Styrene and Butyl Acrylate Emulsion Copolymerization Reactions. Macromolecular Symposia 243:1, pages 200-214.
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M.J. Scorah, R. Dhib & A. Penlidis. (2006) Modelling of free radical polymerization of styrene and methyl methacrylate by a tetrafunctional initiator. Chemical Engineering Science 61:15, pages 4827-4859.
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Jian‐Yi Wu & Guo‐Rong Shan. (2006) Kinetic and molecular weight control for methyl methacrylate semi‐batch polymerization. I. Modelling. Journal of Applied Polymer Science 100:4, pages 2838-2846.
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Simant R. Upreti, Baranitharan S. Sundaram & Ali Lohi. (2005) Optimal control determination of MMA polymerization in non-isothermal batch reactor using bifunctional initiator. European Polymer Journal 41:12, pages 2893-2908.
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Jitendra S. Sangwai, Shrikant A. Bhat, Sanjay Gupta, Deoki N. Saraf & Santosh K. Gupta. (2005) Bulk free radical polymerizations of methyl methacrylateunder non-isothermal conditions and with intermediate additionof initiator: Experiments and modeling. Polymer 46:25, pages 11451-11462.
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Baranitharan S. Sundaram, Simant R. Upreti & Ali Lohi. (2005) Optimal Control of Batch MMA Polymerization with Specified Time, Monomer Conversion, and Average Polymer Molecular Weights. Macromolecular Theory and Simulations 14:6, pages 374-386.
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L. M. F. Lona & A. Penlidis. (2004) A Practical Approach To Simulate Polymerizations with Minimal Information. Industrial & Engineering Chemistry Research 44:8, pages 2634-2648.
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Paula F. de M.P.B. Machado & Liliane M.F. Lona. 2005. European Symposium on Computer-Aided Process Engineering-15, 38th European Symposium of the Working Party on Computer Aided Process Engineering. European Symposium on Computer-Aided Process Engineering-15, 38th European Symposium of the Working Party on Computer Aided Process Engineering 445 450 .
M. J. Scorah, R. Dhib & A. Penlidis. (2004) Free-radical polymerization of methyl methacrylate with a tetrafunctional peroxide initiator. Journal of Polymer Science Part A: Polymer Chemistry 42:22, pages 5647-5661.
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Wei‐Chen Sheng, Jian‐Yi Wu, Guo‐Rong Shan, Zhi‐Ming Huang & Zhi‐Xue Weng. (2004) Free‐radical bulk polymerization of styrene with a new trifunctional cyclic peroxide initiator. Journal of Applied Polymer Science 94:3, pages 1035-1042.
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R. Jovanović & M. A. Dubé. (2004) Solvent effects in butyl acrylate and vinyl acetate homopolymerizations in toluene. Journal of Applied Polymer Science 94:3, pages 871-876.
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Philipp Vana, Christopher Barner‐Kowollik, Thomas P. Davis & Krzysztof Matyjaszewski. 2002. Encyclopedia of Polymer Science and Technology. Encyclopedia of Polymer Science and Technology.
F. García, J. M. García, F. Rubio, J. L. de la Peña, J. Guzmán & E. Riande. (2003) Synthesis and radical polymerization of hydrophilic methacrylates with oxyethylene units in the pendant chain. Journal of Polymer Science Part A: Polymer Chemistry 41:11, pages 1567-1579.
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Marc A. Dubé, Malik Hakim, Neil T. McManus & Alexander Penlidis. (2003) Bulk and Solution Copolymerization of Butyl Acrylate/Methyl Methacrylate at Elevated Temperatures. Macromolecular Chemistry and Physics 203:17, pages 2446-2453.
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F. García, J. M. García, F. Rubio, J. L. de la Peña, J. Guzmán & E. Riande. (2002) Reaction kinetics and gel effect on the polymerization of 2‐ethoxyethyl methacrylate and 2(2‐ethoxyethoxy) ethyl methacrylate. Journal of Polymer Science Part A: Polymer Chemistry 40:22, pages 3987-4001.
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Omar Delgadillo-Velázquez, Eduardo Vivaldo-Lima, Iraís A. Quintero-Ortega & Shiping Zhu. (2002) Effects of diffusion-controlled reactions on atom-transfer radical polymerization. AIChE Journal 48:11, pages 2597-2608.
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J. Gao & A. Penlidis. (2002) Mathematical modeling and computer simulator/database for emulsion polymerizations. Progress in Polymer Science 27:3, pages 403-535.
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Michael D. Goodner & Christopher N. Bowman. (2002) Development of a comprehensive free radical photopolymerization model incorporating heat and mass transfer effects in thick films. Chemical Engineering Science 57:5, pages 887-900.
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Renata Jovanović & Marc A. Dubé. (2001) Off‐line monitoring of butyl acrylate and vinyl acetate homopolymerization and copolymerization in toluene. Journal of Applied Polymer Science 82:12, pages 2958-2977.
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Fangbin Zhou, Santosh K. Guptam & Ajay K. Ray. (2001) Modeling of the sheet‐molding process for poly(methyl methacrylate). Journal of Applied Polymer Science 81:8, pages 1951-1971.
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Hong Hua & Marc A. Dubé. (2001) Off-line monitoring of butyl acrylate, methyl methacrylate and vinyl acetate homo- and copolymerizations in toluene using ATR-FTIR spectroscopy. Polymer 42:14, pages 6009-6018.
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Hong Hua & Marc A. Dubé. (2001) Terpolymerization monitoring with ATR‐FTIR spectroscopy. Journal of Polymer Science Part A: Polymer Chemistry 39:11, pages 1860-1876.
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Odair Araujo, Reinaldo Giudici, Enrique Sald�var & W. Harmon Ray. (2001) Modeling and experimental studies of emulsion copolymerization systems. I. Experimental results. Journal of Applied Polymer Science 79:13, pages 2360-2379.
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Fangbin Zhou, Santosh K. Gupta & Ajay K. Ray. (2000) Multiobjective optimization of the continuous casting process for poly (methyl methacrylate) using adapted genetic algorithm. Journal of Applied Polymer Science 78:7, pages 1439-1458.
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D. E. Palmer, N. T. McManus & A. Penlidis. (2000) Copolymerization with depropagation: A study of ?-methyl styrene/methyl methacrylate in bulk at elevated temperatures. Journal of Polymer Science Part A: Polymer Chemistry 38:11, pages 1981-1990.
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Caterina Cristallini, Gianluca Ciardelli, Giovanni Polacco, Andrea Villani, Luigi Lazzeri & Paolo Giusti. (1999) Kinetics and reaction mechanism of template polymerization investigated by conductimetric measurements. 2. Radical polymerization of sodium methacrylate in the presence of poly(allylamine) hydrochloride. Polymer International 48:12, pages 1251-1256.
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Rajendra K. Mutha, William R. Cluett & Alexander Penlidis. (2004) On‐line nonlinear model‐based estimation and control of a polymer reactor. AIChE Journal 43:11, pages 3042-3058.
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Jun Gao, Neil T. McManus & Alexander Penlidis. (2003) Experimental and simulation studies on ethyl acrylate polymerization. Macromolecular Chemistry and Physics 198:3, pages 843-859.
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