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Molecular Dynamics Simulations for Resolving Scaling Laws of Polyethylene Melts
Long-timescale molecular dynamics simulations were performed to estimate the actual physical nature of a united-atom model of polyethylene (PE). Several scaling laws for representative polymer properties are compared to theoretical predictions. Internal structure results indicate a clear departure f...
Autores principales: | , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
MDPI
2017
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6432190/ https://www.ncbi.nlm.nih.gov/pubmed/30970700 http://dx.doi.org/10.3390/polym9010024 |