Skip to main content
Top
Published in: Polymer Bulletin 10/2014

01-10-2014 | Original Paper

A combinatorial approach to evaluation of monomer conversion and particle size distribution in vinyl chloride emulsion polymerization

Authors: Amir Saeid Pakdel, Mohammad Reza Saeb, Hossein Abedini, Hossein Ali Khonakdar, Regine Boldt

Published in: Polymer Bulletin | Issue 10/2014

Log in

Activate our intelligent search to find suitable subject content or patents.

search-config
loading …

Abstract

This work is targeted to study emulsion polymerization of vinyl chloride monomer (VCM) using experimental and mathematical methods. To fulfill this goal, a computer code was developed on the basis of zero–one population balance by which the effects of initiator and emulsifier concentration on the evolution of VCM conversion were investigated in the course of polymerization. The model was also trained to capture the coagulation of the particles. This enabled to adopt a reliable way of evaluating the particle size distribution (PSD). In particular, the rates of homogeneous and micellar nucleation mechanisms were simulated and reasonably predicted alterations in the PSD and the number of polymer particles under the influence of aforementioned parameters. The results from modeling were satisfactorily consistent with the experimental outputs and obviously visualized the impact of initiator and surfactant concentration on the PSD of the prepared PVC latexes.

Dont have a licence yet? Then find out more about our products and how to get one now:

Springer Professional "Wirtschaft+Technik"

Online-Abonnement

Mit Springer Professional "Wirtschaft+Technik" erhalten Sie Zugriff auf:

  • über 102.000 Bücher
  • über 537 Zeitschriften

aus folgenden Fachgebieten:

  • Automobil + Motoren
  • Bauwesen + Immobilien
  • Business IT + Informatik
  • Elektrotechnik + Elektronik
  • Energie + Nachhaltigkeit
  • Finance + Banking
  • Management + Führung
  • Marketing + Vertrieb
  • Maschinenbau + Werkstoffe
  • Versicherung + Risiko

Jetzt Wissensvorsprung sichern!

Springer Professional "Technik"

Online-Abonnement

Mit Springer Professional "Technik" erhalten Sie Zugriff auf:

  • über 67.000 Bücher
  • über 390 Zeitschriften

aus folgenden Fachgebieten:

  • Automobil + Motoren
  • Bauwesen + Immobilien
  • Business IT + Informatik
  • Elektrotechnik + Elektronik
  • Energie + Nachhaltigkeit
  • Maschinenbau + Werkstoffe




 

Jetzt Wissensvorsprung sichern!

Literature
1.
go back to reference Chern CS (2006) Emulsion polymerization mechanisms and kinetics. Prog Polym Sci 31:443–486CrossRef Chern CS (2006) Emulsion polymerization mechanisms and kinetics. Prog Polym Sci 31:443–486CrossRef
2.
go back to reference Thickett SC, Gilbert RG (2007) Emulsion polymerization: state of the art in kinetics and mechanisms. Polymer 48:6965–6991CrossRef Thickett SC, Gilbert RG (2007) Emulsion polymerization: state of the art in kinetics and mechanisms. Polymer 48:6965–6991CrossRef
3.
go back to reference Braun D (2001) PVC—origin, growth, and future. J Vinyl Addit Technol 7:168–176CrossRef Braun D (2001) PVC—origin, growth, and future. J Vinyl Addit Technol 7:168–176CrossRef
4.
go back to reference Braun D (2004) Poly(vinyl chloride) on the way from the 19th century to the 21st century. J Polym Sci Part A Polym Chem 42:578–586CrossRef Braun D (2004) Poly(vinyl chloride) on the way from the 19th century to the 21st century. J Polym Sci Part A Polym Chem 42:578–586CrossRef
5.
go back to reference Garcia JC, Marcilla A (1998) Influence of the type of resin in the gelation and fusion processes of PVC plastisols. Polymer 39:431–435CrossRef Garcia JC, Marcilla A (1998) Influence of the type of resin in the gelation and fusion processes of PVC plastisols. Polymer 39:431–435CrossRef
6.
go back to reference Garcia JC, Marcilla A (1998) Rheological study of the influence of the plasticizer concentration in the gelation and fusion processes of PVC plastisols. Polymer 39:3507–3514CrossRef Garcia JC, Marcilla A (1998) Rheological study of the influence of the plasticizer concentration in the gelation and fusion processes of PVC plastisols. Polymer 39:3507–3514CrossRef
7.
go back to reference Vale HM, McKenna TFL (2008) Particle formation in vinyl chloride emulsion polymerization. Experimental study. Ind Eng Chem Res 47:8107–8118CrossRef Vale HM, McKenna TFL (2008) Particle formation in vinyl chloride emulsion polymerization. Experimental study. Ind Eng Chem Res 47:8107–8118CrossRef
8.
go back to reference Summers JW (1997) A review of vinyl technology. J Vinyl Addit Technol 3:130–139CrossRef Summers JW (1997) A review of vinyl technology. J Vinyl Addit Technol 3:130–139CrossRef
9.
go back to reference Krallis A, Kotoulas C, Kiparissides C, Papadopoulos S, Bousquet J, Bonardi C (2004) A comprehensive kinetic model for the free-radical polymerization of vinyl chloride in the presence of monofunctional and bifunctional initiators. Ind Eng Chem Res 43:6382–6399CrossRef Krallis A, Kotoulas C, Kiparissides C, Papadopoulos S, Bousquet J, Bonardi C (2004) A comprehensive kinetic model for the free-radical polymerization of vinyl chloride in the presence of monofunctional and bifunctional initiators. Ind Eng Chem Res 43:6382–6399CrossRef
10.
go back to reference Penlidis A, MacGregor JF, Hamielec AE (1986) Mathematical modeling of emulsion polymerization reactors. In: Computer applications in the polymer laboratory, ACS Symposium Series, pp 219–240 Penlidis A, MacGregor JF, Hamielec AE (1986) Mathematical modeling of emulsion polymerization reactors. In: Computer applications in the polymer laboratory, ACS Symposium Series, pp 219–240
11.
go back to reference Xie TY, Hamielec AE, Wood PE, Woods DR (1991) Suspension, bulk, and emulsion polymerization of vinyl chloride-mechanism, kinetics, and reactor modelling. J Vinyl Technol 13:2–25CrossRef Xie TY, Hamielec AE, Wood PE, Woods DR (1991) Suspension, bulk, and emulsion polymerization of vinyl chloride-mechanism, kinetics, and reactor modelling. J Vinyl Technol 13:2–25CrossRef
12.
go back to reference Abedini H, Shahrokhi M (2006) Dynamic simulation and open-loop control of particle size distribution of styrene emulsion polymerization. Iran Polym J 15:901–911 Abedini H, Shahrokhi M (2006) Dynamic simulation and open-loop control of particle size distribution of styrene emulsion polymerization. Iran Polym J 15:901–911
13.
go back to reference Abedini H, Shahrokhi M (2008) Inferential closed-loop control of particle size distribution for styrene emulsion polymerization. Chem Eng Sci 63:2378–2390CrossRef Abedini H, Shahrokhi M (2008) Inferential closed-loop control of particle size distribution for styrene emulsion polymerization. Chem Eng Sci 63:2378–2390CrossRef
14.
go back to reference Min KW, Ray WH (1974) On the mathematical modelling of emulsion polymerization reactors. J Macro Sci Rev Macro Chem C11:177–255CrossRef Min KW, Ray WH (1974) On the mathematical modelling of emulsion polymerization reactors. J Macro Sci Rev Macro Chem C11:177–255CrossRef
15.
go back to reference Min KW, Gostin HI (1979) Simulation of Semi-batch emulsion polymerization reactors for polyvinyl chloride (PVC) system. Ind Eng Chem Prod Res Dev 18:272–278CrossRef Min KW, Gostin HI (1979) Simulation of Semi-batch emulsion polymerization reactors for polyvinyl chloride (PVC) system. Ind Eng Chem Prod Res Dev 18:272–278CrossRef
16.
go back to reference Kiparissides C, Achilias DS, Frantzikinakis CE (2002) The effect of oxygen on the kinetics and particle size distribution in vinyl chloride emulsion polymerization. Ind Eng Chem Res 41:3097–3109CrossRef Kiparissides C, Achilias DS, Frantzikinakis CE (2002) The effect of oxygen on the kinetics and particle size distribution in vinyl chloride emulsion polymerization. Ind Eng Chem Res 41:3097–3109CrossRef
17.
go back to reference Tauer K, Reinisch G, Gajewski H, Müller I (1991) Modeling of emulsion polymerization of vinyl chloride. J Macromol Sci Part A Chem 28:431–460CrossRef Tauer K, Reinisch G, Gajewski H, Müller I (1991) Modeling of emulsion polymerization of vinyl chloride. J Macromol Sci Part A Chem 28:431–460CrossRef
18.
go back to reference Vale HM, McKenna TF (2009) Particle formation in vinyl chloride emulsion polymerization: reaction modeling. Ind Eng Chem Res 48:5193–5210CrossRef Vale HM, McKenna TF (2009) Particle formation in vinyl chloride emulsion polymerization: reaction modeling. Ind Eng Chem Res 48:5193–5210CrossRef
19.
go back to reference Vale HM, McKenna TF (2005) Modeling particle size distribution in emulsion polymerization reactors. Prog Polym Sci 30:1019–1048CrossRef Vale HM, McKenna TF (2005) Modeling particle size distribution in emulsion polymerization reactors. Prog Polym Sci 30:1019–1048CrossRef
20.
go back to reference Pakdel AS, Rezaei Behbahani M, Saeb MR, Khonakdar HA, Abedini H, Moghri M (2014) Evolution of vinyl chloride conversion below critical micelle concentration: a response surface analysis. J Vinyl Addit Technol. doi:10.1002/vnl.21352 Pakdel AS, Rezaei Behbahani M, Saeb MR, Khonakdar HA, Abedini H, Moghri M (2014) Evolution of vinyl chloride conversion below critical micelle concentration: a response surface analysis. J Vinyl Addit Technol. doi:10.​1002/​vnl.​21352
21.
go back to reference Edouard D, Othman SN, Hammouri H (2005) Observer design for particle size distribution in emulsion polymerization. AIChE J 51:3167–3185CrossRef Edouard D, Othman SN, Hammouri H (2005) Observer design for particle size distribution in emulsion polymerization. AIChE J 51:3167–3185CrossRef
22.
go back to reference Coen EM, Gilbert RG, Morrison BR, Leube H, Peach S (1998) Modeling particle size distribution and secondary particle formation in emulsion polymerization. Polymer 39:7099–7112CrossRef Coen EM, Gilbert RG, Morrison BR, Leube H, Peach S (1998) Modeling particle size distribution and secondary particle formation in emulsion polymerization. Polymer 39:7099–7112CrossRef
23.
go back to reference Zeaiter J, Romagnoli JA, Barton GW, Gomes VG, Hawkett BS, Gilbert RG (2002) Operating of semi-batch emulsion polymerization reactors: modeling, validation and effect of operating conditions. Chem Eng Sci 57:2955–2969CrossRef Zeaiter J, Romagnoli JA, Barton GW, Gomes VG, Hawkett BS, Gilbert RG (2002) Operating of semi-batch emulsion polymerization reactors: modeling, validation and effect of operating conditions. Chem Eng Sci 57:2955–2969CrossRef
24.
go back to reference Meadows ES, Crowley TJ, Immanuel CD, Doyle FJ III (2003) Nonisothermal modeling and sensitivity studies for batch and semibatch emulsion polymerization of styrene. Ind Eng Chem Res 42:555–567CrossRef Meadows ES, Crowley TJ, Immanuel CD, Doyle FJ III (2003) Nonisothermal modeling and sensitivity studies for batch and semibatch emulsion polymerization of styrene. Ind Eng Chem Res 42:555–567CrossRef
25.
go back to reference Immanuel CD, Cordeiro CF, Sandaram SS, Meadows ES, Crowley TJ, Doyle FJ III (2002) Modeling of particle size distribution in emulsion copolymerization: comparison with experimental data and parametric sensitivity studies. Comput Chem Eng 26:1133–1152CrossRef Immanuel CD, Cordeiro CF, Sandaram SS, Meadows ES, Crowley TJ, Doyle FJ III (2002) Modeling of particle size distribution in emulsion copolymerization: comparison with experimental data and parametric sensitivity studies. Comput Chem Eng 26:1133–1152CrossRef
26.
go back to reference Fortuny M, Grilla C, Mckenna TF (2004) Coagulation of anionically stabilized polymer particle. Ind Eng Chem Res 43:7210–7219CrossRef Fortuny M, Grilla C, Mckenna TF (2004) Coagulation of anionically stabilized polymer particle. Ind Eng Chem Res 43:7210–7219CrossRef
27.
go back to reference Herrera-Ordonez J, Olayo R (2000) On the kinetics of styrene emulsion polymerization above CMC. II. Comparison with experimental results. J Polym Sci Part A Polym Chem 38:2219–2231CrossRef Herrera-Ordonez J, Olayo R (2000) On the kinetics of styrene emulsion polymerization above CMC. II. Comparison with experimental results. J Polym Sci Part A Polym Chem 38:2219–2231CrossRef
28.
go back to reference Immanuel CD, Doyle FJ III (2003) Computationally efficient solution of population balance models incorporating nucleation, growth and coagulation: application to emulsion polymerization. Chem Eng Sci 58:3681–3698CrossRef Immanuel CD, Doyle FJ III (2003) Computationally efficient solution of population balance models incorporating nucleation, growth and coagulation: application to emulsion polymerization. Chem Eng Sci 58:3681–3698CrossRef
29.
go back to reference Kumaar S, Ramkarishna D (1996) On the Solution of population balance equations by discretization—I a fixed pivot technique. Chem Eng Sci 51:1311–1332CrossRef Kumaar S, Ramkarishna D (1996) On the Solution of population balance equations by discretization—I a fixed pivot technique. Chem Eng Sci 51:1311–1332CrossRef
30.
go back to reference Park MJ, Dokucu MT, Doyle FJ III (2005) Modeling and sensitivity analysis of particle size distribution and chain length distribution in a semi batch emulsion copolymerization reactor. Macromol Theory Simul 14:474–490CrossRef Park MJ, Dokucu MT, Doyle FJ III (2005) Modeling and sensitivity analysis of particle size distribution and chain length distribution in a semi batch emulsion copolymerization reactor. Macromol Theory Simul 14:474–490CrossRef
31.
go back to reference Vale HM, McKenna TF (2007) Solution of population balance equations for emulsion polymerization: zero-one and zero-one-two systems. Ind Eng Chem Res 46:643–654CrossRef Vale HM, McKenna TF (2007) Solution of population balance equations for emulsion polymerization: zero-one and zero-one-two systems. Ind Eng Chem Res 46:643–654CrossRef
32.
go back to reference Gilbert RG (1995) Emulsion polymerization: a mechanistic approach. Academic Press, London Gilbert RG (1995) Emulsion polymerization: a mechanistic approach. Academic Press, London
33.
go back to reference Lovell P, El-Aasser MS (1997) Emulsion polymerization and emulsion polymers. Wiley, Chichester Lovell P, El-Aasser MS (1997) Emulsion polymerization and emulsion polymers. Wiley, Chichester
Metadata
Title
A combinatorial approach to evaluation of monomer conversion and particle size distribution in vinyl chloride emulsion polymerization
Authors
Amir Saeid Pakdel
Mohammad Reza Saeb
Hossein Abedini
Hossein Ali Khonakdar
Regine Boldt
Publication date
01-10-2014
Publisher
Springer Berlin Heidelberg
Published in
Polymer Bulletin / Issue 10/2014
Print ISSN: 0170-0839
Electronic ISSN: 1436-2449
DOI
https://doi.org/10.1007/s00289-014-1203-5

Other articles of this Issue 10/2014

Polymer Bulletin 10/2014 Go to the issue

Premium Partners