Dissertation > Excellent graduate degree dissertation topics show

Molecular Simulation and Application of the Organic Silicone

Author: FangMing
Tutor: ShiTieJun
School: Hefei University of Technology
Course: Polymer chemistry and physics
Keywords: Organic silicon prepolymers molecular simulation build the model glass transition temperature repair coating
CLC: TQ324.21
Type: Master's thesis
Year: 2011
Downloads: 314
Quote: 0
Read: Download Dissertation


Molecular simulation is a new method that studies the structure and propertiesof polymer. When designing molecules, the cycle would be shorter and its costwould be lower. Organic silicone resin is one kind of half-inorganic cross-linkingpolymer. As the organic group are connected to the atom Silicon, the organicsilicon resin has many excellent physical and chemical properties that differ fromcarbon-based polymers. The coating material that based on silicone resin has beenwidely used in electrical and electronic industries。Based on the molecular simulation of synthesizing the silicone resinprepolymers, this paper studies the establishing of the model of organic siliconeresin crosslinking system, and confirms the validity of the model. Then the glasstransition temperature of the crosslinking system is forecasted by the way of themolecular dynamics simulation method. Finally, through the experiments, theorganic silicon resin is synthesized while its applications as wear-resisting coatingare also studied.The major results obtained in the study include as follows:1. Based on the two monomers of TEOS and METOS, the molecularsimulation model of organic silicone resin prepolymers crosslinking system isfounded. Because the research object is the crosslinking system, references are solimited that it is rather difficult to build a reasonable modle. In this paper, with themethod from monomer to single to crosslinking network, the author constructed thechemical bonds manually and finally formed the prepolymers crosslinking systemof organic silicon resin as the degree of polymerization was160, and then verifiedits validity.2. The select of the system size and the nonbonding force when constructing amodel have been analyzed. A proper key force and the right degree ofpolymerization have also been chosen. Then glass transition temperature of theconstructed system can be predicted by the change of its density and the specificvolume. Influence factors of the glass transition temperature have also beenanalyzed.3. According to the relevant simulation parameters and the predicted glasstransition temperature, organic silicone coating has been made by the hydrolysis and polycondensate of TEOS and MTEOS. The coating has better repairing effecton defects of the optical resins surface. Meanwhile, this paper also studies theinfluence of compound solvent on the coating and repair performance of thecoating.

Related Dissertations

  1. Study of Interaction between Epoxy Molecules and Carbon Fiber Surface with Molecular Simulation,TB332
  2. Research of the Mechanism for Weakening the Hydrogen Bond in Starch,TS231
  3. Synthesis and Bioactivities of Pyrazole-Heterocyclic Diamide,TQ450.1
  4. And frequency vibrational spectroscopy (SFG) Relaxation Behavior of Polymer Surfaces,O631.3
  5. Molecular Simulation of the Miscibility for Polymer Blends,O631.3
  6. Modifying Design of a Marine Air Purifier and its Purifying Materials’ Molecular Simulation Research of CO2 Adsorption Performance,U664.51
  7. The Molecular Dynamics Simulation Study of Influenza Virus B Proton Channel,R312
  8. 1. Improvement of tmTNF-α in Insulin Resistance of Adipocytes and Its Underlying Mechanism. 2. Construction of Conserved Sequence Deleted TNF-α Mutant and the Trimerization of Remodeled TNFRBP.,R587.1
  9. Research on Extraction Mechanism and Process of Lithium from Salt Lake Brine,TS396.1
  10. The Synergy and Industrial Application of Two Components Waterborne Polyurethane Coatings,TQ633
  11. The Study of Pyrolysis Mechanism of Biomass,TK6
  12. The Research of Chemical Synthesis Process of Fluorene Polycarbonate,TQ323.41
  13. Study on Relationship between Glass Transition Temperature of Copolymer and Conversion,O631.3
  14. A low glass transition temperature photorefractive polymer systems,TN204
  15. Preparation and Computer Simulation of Polylactide/Organomontmorillonite Nanocomposites,TB383.1
  16. The Synthesis and Performance of Thermoplastic Polyimide Film Materials,TQ323.7
  17. Selection and Molecular Simulation of Lead Peptides Dual-Targeting MMP14 and Metal Ions,R730.2
  18. The Structural and Functional Study of Atherothrombosis Related Protein Von Willebrand Factor A2 Domain,R543.5
  19. Study on Hygrothermal Ageing and Elevated Temperature Performances of Basalt Fiber Reinforced Epoxy Composites,TB332
  20. Study of Preparation and Performances of Basalt Fiber/Organo-Montmorillonite/Epoxy Nanocomposites,TB383.1
  21. The Investigantion of Transport Properties about the Water and Ion in the Nanotube,TB383.1

CLC: > Industrial Technology > Chemical Industry > Synthetic resins and plastics industry > Specialty plastics > Elements of organic polymer plastic > Silicone plastic
© 2012 www.DissertationTopic.Net  Mobile