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Stationary Out of Equilibrium Dynamics of Poly[2]Catenane
Afghahi Farimani, Reyhaneh | 2022
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- Type of Document: M.Sc. Thesis
- Language: Farsi
- Document No: 55830 (04)
- University: Sharif University of Technology
- Department: Physics
- Advisor(s): Ejtehadi, Mohammad Reza
- Abstract:
- Achievements in the synthesis of polycatenanes promise new opportunities for having and designing new smart materials. However, the out-of-equilibrium dynamic of polycate-nane is largely unstudied. This research studies the interplay of poly[2]catenane topology and hydrodynamic interactions in pure shear flow using the MPCD method. To question the effect of topological interaction, we simulated systems with bonded rings alongside systems with poly[2]catenane. In order to investigate the effect of hydrodynamic interaction, each system was examined using the random solvent method as well. Our study shows the poly[2]catenane structure can control the shear and stress by twist and rotation around the mechanical bond, this largely affects the dynamics of the polymer under shear
- Keywords:
- Entanglement ; Molecular Dynamic Simulation ; Shear Flow ; Multi Particle Collision Dynamics (MPCD) ; Polycatenane ; Polymers ; Bonded Ring
- محتواي کتاب
- view
- 6d2cb5dc62a81a98ca727aa77eb6994f0f328945f8be5e7ed7d41295b5997c0f.pdf
- 6d2cb5dc62a81a98ca727aa77eb6994f0f328945f8be5e7ed7d41295b5997c0f.pdf
- 6d2cb5dc62a81a98ca727aa77eb6994f0f328945f8be5e7ed7d41295b5997c0f.pdf
- مفاهیم اولیه
- بیان مسئله
- شبیهسازی
- رفتار بسپار در حالت تعادل
- رفتار بسپار در شاره برشی
- جمعبندی و چشم انداز
- مراجع