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Published in 2017 at "Polymer"
DOI: 10.1016/j.polymer.2017.06.008
Abstract: We study the stability of twin boundaries and slip in crystalline orthorhombic polyethylene by means of density functional theory (DFT), using a nonempirical, truly nonlocal density function, and by means of classical molecular dynamics (MD).…
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Keywords:
slip;
energy;
boundaries slip;
crystalline orthorhombic ... See more keywords