Molecular dynamics simulation of converting waste polyethylene (PE) to chemicals and fuels under non-isothermal and isothermal conditions
Zhiheng Xu, Qiyuan Xie, Cheng Chen, Xi Jiang
Topics & Concepts
PyrolysisIsothermal processMaterials scienceReaxFFPolyethyleneCrackingYield (engineering)Chemical engineeringPyrolysis oilWaste managementOrganic chemistryChemistryThermodynamicsComposite materialEngineeringHydrogen bondMoleculePhysicsThermochemical Biomass Conversion ProcessesPolymer crystallization and propertiesMicroplastics and Plastic Pollution