Thermal degradation kinetics, mechanism, thermodynamics, shape memory properties and artificial neural network application study of polycaprolactone (PCL)/polyvinyl chloride (PVC) blends

The thermal degradation dynamics of different composition of polycaprolactone (PCL) /polyvinyl chloride (PVC) blends was studied in detail. The thermal degradation kinetics of PCL/PVC blends in different compositions (coded as PCL/PVC:70/30, P1; PCL/PVC:50/50, P2; PCL/PVC:30/70, P3) at four heating...

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Veröffentlicht in:Polymer bulletin (Berlin, Germany) Germany), 2023-09, Vol.80 (9), p.9685-9708
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description The thermal degradation dynamics of different composition of polycaprolactone (PCL) /polyvinyl chloride (PVC) blends was studied in detail. The thermal degradation kinetics of PCL/PVC blends in different compositions (coded as PCL/PVC:70/30, P1; PCL/PVC:50/50, P2; PCL/PVC:30/70, P3) at four heating rates (10, 15, 20 and 25 °C/min) were investigated. Flynn–Wall–Qzawa, Kissinger and Tang isoconversional methods, which do not depend on the reaction order, were used to calculate the activation energy (Ea) of PCL/PVC blends and Coats-Redfern method which is an non-isoconversional model was used to characterization the solid-state reaction mechanisms. For all blends, it was observed that the Ea values obtained with isoconversional models and the values obtained with non-isoconversional models were very near to each other and the average values were, for P1, Ea = 113.45 kJ/mol; for P2, Ea = 95.28 kJ/mol, and for P3, Ea: 87.79 kJ/mol. In addition, the D3, F2, A2 mechanisms were suggested for the P1, P2 and P3 blends, respectively. DSC results showed the transition attributed to the melting point for P1 and glass transition temperature for P2 and P3. DSC results revealed that blends with a high PCL ratio have a crystal structure, while blends with a higher PVC ratio have an amorphous structure. Shape memory recovery test results for the blends revealed that the PCL/PVC (70/30) (P1) blend exibited great strain recovery. Furthermore, in this study, decomposition temperature, heating rate and percentage of PVC in blends were taken as input data to improved an efficient artificial neural network (ANN) model, and the percentage of weight remaining during degradation of PCL/PVC mixtures was taken as output data. The 3-10-10-1 topology with LOGSIG-TANSIG transfer function and feedforward backpropagation was used as the artificial neural network model. Then, an effective ANN model was developed by taking the degradation temperature, heating rate, %pvc and %weight left data as input data, and calculated activation energy values as output data. 4-10-10-1 topology with LOGSİG-LOGSİG transfer function and feedforward backpropagation was used as ANN model.
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Bull</addtitle><description>The thermal degradation dynamics of different composition of polycaprolactone (PCL) /polyvinyl chloride (PVC) blends was studied in detail. The thermal degradation kinetics of PCL/PVC blends in different compositions (coded as PCL/PVC:70/30, P1; PCL/PVC:50/50, P2; PCL/PVC:30/70, P3) at four heating rates (10, 15, 20 and 25 °C/min) were investigated. Flynn–Wall–Qzawa, Kissinger and Tang isoconversional methods, which do not depend on the reaction order, were used to calculate the activation energy (Ea) of PCL/PVC blends and Coats-Redfern method which is an non-isoconversional model was used to characterization the solid-state reaction mechanisms. For all blends, it was observed that the Ea values obtained with isoconversional models and the values obtained with non-isoconversional models were very near to each other and the average values were, for P1, Ea = 113.45 kJ/mol; for P2, Ea = 95.28 kJ/mol, and for P3, Ea: 87.79 kJ/mol. 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Bull</stitle><date>2023-09-01</date><risdate>2023</risdate><volume>80</volume><issue>9</issue><spage>9685</spage><epage>9708</epage><pages>9685-9708</pages><issn>0170-0839</issn><eissn>1436-2449</eissn><abstract>The thermal degradation dynamics of different composition of polycaprolactone (PCL) /polyvinyl chloride (PVC) blends was studied in detail. The thermal degradation kinetics of PCL/PVC blends in different compositions (coded as PCL/PVC:70/30, P1; PCL/PVC:50/50, P2; PCL/PVC:30/70, P3) at four heating rates (10, 15, 20 and 25 °C/min) were investigated. Flynn–Wall–Qzawa, Kissinger and Tang isoconversional methods, which do not depend on the reaction order, were used to calculate the activation energy (Ea) of PCL/PVC blends and Coats-Redfern method which is an non-isoconversional model was used to characterization the solid-state reaction mechanisms. For all blends, it was observed that the Ea values obtained with isoconversional models and the values obtained with non-isoconversional models were very near to each other and the average values were, for P1, Ea = 113.45 kJ/mol; for P2, Ea = 95.28 kJ/mol, and for P3, Ea: 87.79 kJ/mol. In addition, the D3, F2, A2 mechanisms were suggested for the P1, P2 and P3 blends, respectively. DSC results showed the transition attributed to the melting point for P1 and glass transition temperature for P2 and P3. DSC results revealed that blends with a high PCL ratio have a crystal structure, while blends with a higher PVC ratio have an amorphous structure. Shape memory recovery test results for the blends revealed that the PCL/PVC (70/30) (P1) blend exibited great strain recovery. Furthermore, in this study, decomposition temperature, heating rate and percentage of PVC in blends were taken as input data to improved an efficient artificial neural network (ANN) model, and the percentage of weight remaining during degradation of PCL/PVC mixtures was taken as output data. The 3-10-10-1 topology with LOGSIG-TANSIG transfer function and feedforward backpropagation was used as the artificial neural network model. Then, an effective ANN model was developed by taking the degradation temperature, heating rate, %pvc and %weight left data as input data, and calculated activation energy values as output data. 4-10-10-1 topology with LOGSİG-LOGSİG transfer function and feedforward backpropagation was used as ANN model.</abstract><cop>Berlin/Heidelberg</cop><pub>Springer Berlin Heidelberg</pub><doi>10.1007/s00289-022-04522-6</doi><tpages>24</tpages><orcidid>https://orcid.org/0000-0001-6074-3410</orcidid></addata></record>
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subjects Activation energy
Artificial neural networks
Back propagation networks
Characterization and Evaluation of Materials
Chemistry
Chemistry and Materials Science
Complex Fluids and Microfluidics
Composition
Crystal structure
Energy
Energy value
Glass transition temperature
Heating rate
Kinetics
Mechanical properties
Melting points
Mixtures
Neural networks
Organic Chemistry
Original Paper
Physical Chemistry
Polycaprolactone
Polymer Sciences
Polymers
Polyvinyl chloride
Reaction mechanisms
Recovery
Shape memory
Soft and Granular Matter
Thermal degradation
Topology
Transfer functions
title Thermal degradation kinetics, mechanism, thermodynamics, shape memory properties and artificial neural network application study of polycaprolactone (PCL)/polyvinyl chloride (PVC) blends
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