All-atomic and coarse-grained molecular dynamics investigation of deformation in semi-crystalline lamellar polyethylene

© 2018 Elsevier Ltd In the present work we have performed classical molecular dynamics modelling to investigate the effects of different types of force-fields on the stress-strain and yielding behaviours in semi-crystalline lamellar stacked linear polyethylene. To this end, specifically the all-atom...

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Bibliographic Details
Main Authors: Olsson, Pär A.T., in ’t Veld, Pieter J., Andreasson, Eskil, Bergvall, Erik, Persson Jutemar, Elin, Petersson, Viktor, Rutledge, Gregory C., Kroon, Martin
Other Authors: Massachusetts Institute of Technology. Department of Chemical Engineering
Format: Article
Language:English
Published: Elsevier BV 2022
Online Access:https://hdl.handle.net/1721.1/135837.2