Molecular dynamics simulation of glass transition and thermal stability of novel silicone elastomer and its nanocomposites
Jiajun Qu, Ke Gao, Gunayi Hou, Liqun Zhang, Yonglai Lu, Jun Liu
Topics & Concepts
Materials scienceMolecular dynamicsGlass transitionReaxFFThermal stabilityElastomerPolymerComposite materialSiliconeNanocompositeThermodynamicsChemical physicsChemical engineeringPolymer chemistryComputational chemistryEngineeringInteratomic potentialChemistryPhysicsDielectric materials and actuatorsSilicone and Siloxane ChemistryAdvanced Sensor and Energy Harvesting Materials