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Coarse-Grained Molecular Dynamics Simulation of Polycarbonate Deformation: Dependence of Mechanical Performance by the Effect of Spatial Distribution and Topological Constraints
Polycarbonate is an engineering plastic used in a wide range of applications due to its excellent mechanical properties, which are closely related to its molecular structure. We performed coarse-grained molecular dynamics (CGMD) calculations to investigate the effects of topological constraints and...
Autores principales: | , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
MDPI
2022
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9824171/ https://www.ncbi.nlm.nih.gov/pubmed/36616393 http://dx.doi.org/10.3390/polym15010043 |