Pyrolysis of vulcanized styrene-butadiene rubber via ReaxFF molecular dynamics simulation
Yinbin Wang, Senjun Yao, Wei Wang, Chenglong Qiu, Jing Zhang, Shengwei Deng, Hong Dong, Chuan Wu, Jianguo Wang
Topics & Concepts
VulcanizationReaxFFSulfurPyrolysisNatural rubberMolecular dynamicsStyrene-butadieneChemistryChemical engineeringFlue-gas desulfurizationHydrocarbonMaterials scienceOrganic chemistryCopolymerStyrenePolymerComputational chemistryEngineeringInteratomic potentialThermal and Kinetic AnalysisThermochemical Biomass Conversion ProcessesPolymer crystallization and properties