Abstract

PLA is one of the most promising bio-compostable and bio-degradable thermoplastic polymers made from renewable sources. PLA is generally produced by ring opening polymerization (ROP) of lactide using the metallic/bimetallic catalyst (Sn, Zn, and Al) or other organic catalysts in a suitable solvent. In this work, reactive extrusion experiments using stannous octoate Sn(Oct)2 and tri-phenyl phosphine (PPh)3 were considered to perform ROP of lactide. Ultrasound energy source was used for activating and/or boosting the polymerization as an alternative energy (AE) source. Ludovic® software, designed for simulation of the extrusion process, had to be modified in order to simulate the reactive extrusion of lactide and for the application of an AE source in an extruder. A mathematical model for the ROP of lactide reaction was developed to estimate the kinetics of the polymerization process. The isothermal curves generated through this model were then used by Ludovic software to simulate the “reactive” extrusion process of ROP of lactide. Results from the experiments and simulations were compared to validate the simulation methodology. It was observed that the application of an AE source boosts the polymerization of lactide monomers. However, it was also observed that the predicted residence time was shorter than the experimental one. There is potentially a case for reducing the residence time distribution (RTD) in Ludovic® due to the ‘liquid’ monomer flow in the extruder. Although this change in parameters resulted in validation of the simulation, it was concluded that further research is needed to validate this assumption.

Highlights

  • The production of large quantities of polymer waste is one of the major challenges of the present era, especially as polymers represent 20%–30% of global waste [1,2]

  • To conduct the mathematical simulation of ring opening polymerization (ROP) of poly-lactic acid (PLA) with the reaction mechanism suggested, initial reaction input details were adopted from the experiments on reactive extrusion

  • Reactive extrusion was carried out with and without the application of ultrasound at different temperatures, and it was found that the use of ultrasound increases the average number molecular weight

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Summary

Introduction

The production of large quantities of polymer waste is one of the major challenges of the present era, especially as polymers represent 20%–30% of global waste [1,2]. Attempts have been made to substitute tin-based catalysts by organic catalysts that exhibit less toxicity or eco-toxicity [17,18,19] It has been observed through initial experimental trials that alternative energy sources (LASER, Ultrasounds, microwaves) with the combination of a prominent catalyst source, could be an option to facilitate the ROP of lactide monomers [20,21,22,23,24,25,26,27]. The implementation of a metal-free catalyst and the suitable application of an alternative energy source in the ROP of the lactide process may result in the replacement of the metal catalysts completely, achieving non-toxic PLA production at industrially acceptable rates (30–40) kg/h.

Materials
Experimental
Characterisation Techniques
Mathematical Modelling of Reactive Extrusion
Reaction Kinetics Modelling and Mathematical Simulation of ROP of Lactide
Modelling of ROP Reaction Mechanism in Reactive Extrusion
Alternative
Thermo-Mechanical Modelling of Ludovic
Temperature
Experimental Results
Results of Batch Process Simulation
Results of Reactive
Results
Trial-1
Conclusions
Full Text
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