Molecular dynamics simulations of deformation mechanisms of amorphous polyethylene

By D. Hossain, Mark A. Tschopp, D. Ward, J. Bouvard, Paul T. Wang, Mark F. Horstemeyer. 2010

440 citations recorded by the source corpus.

Subfields: Fluid Flow and Transfer Processes, Polymers and Plastics

View Paper: https://www.semanticscholar.org/paper/058984a416afa90defbdaab7e9b4cc2e4c158e8d

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In Polymers and Plastics

1. Timon Rabczuk
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3. R. Moon

Citations in the corpus

• Stochastic predictions of interfacial characteristic of polymeric nanocomposites (PNCs) (2014, background): “Interaction Form Bond Ebond 1⁄4 2 kbðl leqÞ 2 Angle Eangle 1⁄4 2 khðcosðhÞ cosðheqÞÞ 2 Torsional Etorsional 1⁄4 2 P3 i1⁄40kncos nð/Þ Non-bonded Enon-bond 1⁄4 4 r 12 ðr Þ h i r 6 rc 0 r > rc ( and the parameters of the intra-polymer potential [28] are outlined in Table 1.”
• Stochastic predictions of bulk properties of amorphous polyethylene based on molecular dynamics simulations (2014, methodology): “[4] showed the higher the chain length, the more entanglement the structure and hence the structure has a higher stiffness and yield stress.”
• Tensile strength of Iβ crystalline cellulose predicted by molecular dynamics simulation (2014, methodology): “2005) and composites (Tomar and Zhou 2007), and amorphous polymers (Hossain et al. 2010).”