View Item 
      •   Home
      • 1. Schools
      • College of Engineering
      • School of Mechanical and Aerospace Engineering (MAE)
      • MAE Journal Articles
      • View Item
      •   Home
      • 1. Schools
      • College of Engineering
      • School of Mechanical and Aerospace Engineering (MAE)
      • MAE Journal Articles
      • View Item
      JavaScript is disabled for your browser. Some features of this site may not work without it.
      Subject Lookup

      Browse

      All of DR-NTUCommunities & CollectionsTitlesAuthorsBy DateSubjectsThis CollectionTitlesAuthorsBy DateSubjects

      My Account

      Login

      Statistics

      Most Popular ItemsStatistics by CountryMost Popular Authors

      About DR-NTU

      Superior thermal conductivity and extremely high mechanical strength in polyethylene chains from ab initio calculation

      Thumbnail
      10. Superior thermal conductivity and extremely.pdf (578.2Kb)
      Author
      Jiang, Jin-Wu
      Zhao, Junhua
      Zhou, Kun
      Rabczuk, Timon
      Date of Issue
      2012
      School
      School of Mechanical and Aerospace Engineering
      Version
      Published version
      Abstract
      The upper limit of the thermal conductivity and the mechanical strength are predicted for the polyethylene chain, by performing the ab initio calculation and applying the quantum mechanical non-equilibrium Green’s function approach. Specially, there are two main findings from our calculation: (1) the thermal conductivity can reach a high value of 310 Wm−1 K−1 in a 100 nm polyethylene chain at room temperature and the thermal conductivity increases with the length of the chain; (2) the Young’s modulus in the polyethylene chain is as high as 374.5 GPa, and the polyethylene chain can sustain 32.85%±0.05% (ultimate) strain before undergoing structural phase transition into gaseous ethylene.
      Type
      Journal Article
      Series/Journal Title
      Journal of Applied Physics
      Rights
      © 2012 American Institute of Physics. This paper was published in Journal of Applied Physics and is made available as an electronic reprint (preprint) with permission of American Institute of Physics. The paper can be found at the following official DOI: [http://dx.doi.org/10.1063/1.4729489]. One print or electronic copy may be made for personal use only. Systematic or multiple reproduction, distribution to multiple locations via electronic or other means, duplication of any material in this paper for a fee or for commercial purposes, or modification of the content of the paper is prohibited and is subject to penalties under law.
      Collections
      • MAE Journal Articles
      http://dx.doi.org/10.1063/1.4729489
      Get published version (via Digital Object Identifier)

      Show full item record


      NTU Library, Nanyang Avenue, Singapore 639798 © 2011 Nanyang Technological University. All rights reserved.
      DSpace software copyright © 2002-2015  DuraSpace
      Contact Us | Send Feedback
      Share |    
      Theme by 
      Atmire NV
       

       


      NTU Library, Nanyang Avenue, Singapore 639798 © 2011 Nanyang Technological University. All rights reserved.
      DSpace software copyright © 2002-2015  DuraSpace
      Contact Us | Send Feedback
      Share |    
      Theme by 
      Atmire NV
       

       

      DCSIMG