Molecular Dynamics simulation

Considering semi-crystallinity in molecular simulations of mechanical polymer properties –using nanoindentation of polyethylene as an example

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Considering semi-crystallinity in molecular simulations of mechanical polymer properties – using nanoindentation of polyethylene as an example Susanne Fritz FILK Freiberg Institute gGmbH, Meißner Ring 1-5, 09599 Freiberg, Germany. DOI: https://doi.org/10.7494/cmms.2021.1.0747 Abstract: Molecular dynamic (MD) simulations have been used to investigate the response of semi-crystalline polymers in nanoindentation tests, using polyethylene (PE) as an example. … Read more

Analysis of elastic deformation of amorphous polyethylene in uniaxial tensile test by using molecular dynamics simulation

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Analysis of elastic deformation of amorphous polyethylene in uniaxial tensile test by using molecular dynamics simulation Tien-Thinh Le Université Paris-Est, Laboratoire Modélisation et Simulation Multi Echelle, MSME UMR 8208 CNRS, Marne-la-Vallée, France. DOI: https://doi.org/10.7494/cmms.2020.2.0653 Abstract: In this paper, the linear elastic response to uniaxial tension of amorphous polyethylene was investigated by using Molecular Dynamics (MD) … Read more