Multiscale investigation on the physical properties of polycaprolactone and its composites by molecular dynamics and coarse grain simulation
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Yihan Nie Thesis.pdf. Available under License Creative Commons Attribution Non-commercial No Derivatives 4.0. |
Description
This thesis aimed to investigate the material properties of printable and biodegradable composites on the molecular level. Advanced molecular dynamics simulations are used to explore and predict their mechanical property and rheological properties. Different coarse grain models are also built to improve computation efficiency, while keeping accurate predictions on multiple physical properties. The findings in this thesis will help design the printable composite with better material properties.
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| ID Code: | 238822 |
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| Item Type: | QUT Thesis (PhD by Publication) |
| Supervisor: | Gu, YuanTong, Sauret, Emilie, & Kou, Liangzhi |
| Keywords: | Molecular Dynamics, Coarse Grain Simulation, Degradable Polymer, Mechanical Property, Rheology, Polycaprolactone, Polymer Nanocomposites |
| DOI: | 10.5204/thesis.eprints.238822 |
| Pure ID: | 128042635 |
| Divisions: | Current > QUT Faculties and Divisions > Faculty of Engineering Current > Schools > School of Mechanical, Medical & Process Engineering |
| Institution: | Queensland University of Technology |
| Deposited On: | 24 Mar 2023 05:32 |
| Last Modified: | 24 Mar 2023 05:32 |
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