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Volumn 113, Issue 2, 2009, Pages 442-455

Structure, dimensions, and entanglement statistics of long linear polyethylene chains

Author keywords

[No Author keywords available]

Indexed keywords

POLYDISPERSITY; THERMOPLASTICS;

EID: 61949087395     PISSN: 15206106     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp808287s     Document Type: Article
Times cited : (65)

References (103)
  • 6
    • 0037560562 scopus 로고    scopus 로고
    • Kotelyanskii, M, Theodorou, D. N, Eds, Marcel Dekker: New York
    • Kotelyanskii, M.; Theodorou, D. N., Eds. Simulation Methods for Polymers; Marcel Dekker: New York, 2004.
    • (2004) Simulation Methods for Polymers
  • 9
    • 35548967122 scopus 로고    scopus 로고
    • Molecular Simulation; Academic: London
    • Frenkel, D.; Smit, B. Understanding Molecular Simulation; Academic: London, 2001.
    • (2001) Understanding
    • Frenkel, D.1    Smit, B.2
  • 65
    • 31544448112 scopus 로고    scopus 로고
    • Models for Polymeric and Anisotropie Liquids
    • Springer: Berlin Germany
    • Kröger, M. Models for Polymeric and Anisotropie Liquids; Lecture Notes in Physics 675; Springer: Berlin Germany, 2005.
    • (2005) Lecture Notes in Physics , vol.675
    • Kröger, M.1
  • 76
    • 84906411221 scopus 로고    scopus 로고
    • In the intramolecular reptation, a randomly selected end-mer is excised from a randomly selected chain and is reconstructed as an end-mer in a randomly selected new chain different than the original one, By construction, it is applicable only in polydisperse chain systems
    • In the intramolecular reptation, a randomly selected end-mer is excised from a randomly selected chain and is reconstructed as an end-mer in a randomly selected new chain (different than the original one). By construction, it is applicable only in polydisperse chain systems.
  • 100
    • 84906382058 scopus 로고    scopus 로고
    • We should note that the new version of the Zl code does not necessitate the use of supercells in the case of systems polluted by size effects when chain dimensions exceed the box size. In the present work, for the three larger systems C400, C500, and C1000, chain dimensions exceed significantly the size of the simulation cell, but there is no effect on any static or volumetric property as revealed by simulations with a much larger simulation box size
    • 1000), chain dimensions exceed significantly the size of the simulation cell, but there is no effect on any static or volumetric property as revealed by simulations with a much larger simulation box size.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.