Molecular dynamics simulation of H2 in amorphous polyethylene system: H2 diffusion in various PE matrices and bubbling during rapid depressurization
J. W. Zhao, Xingguo Wang, Qingquan Yang, Hua Yin, Bo Zhao, Shijun Zhang, Changjiang Wu
Topics & Concepts
Materials scienceGlass transitionDiffusionPolyethyleneAmorphous solidMolecular dynamicsPolymerVolume (thermodynamics)Composite materialMolecular diffusionUltimate tensile strengthHigh-density polyethyleneChemical engineeringThermodynamicsChemical physicsChemistryOrganic chemistryComputational chemistryEconomicsPhysicsMetric (unit)Operations managementEngineeringPolymer Foaming and CompositesAdvanced Sensor and Energy Harvesting MaterialsPolymer crystallization and properties