A comprehensive study of pyrolysis characteristics of silicone-modified phenolic aerogel matrix Nanocomposites: Kinetic Analysis, ReaxFF MD Simulations, and ANN prediction
Jie Xiao, Guodong Fang, Xiangyu Jin, Bing Wang, Songhe Meng
Topics & Concepts
NanocompositeReaxFFMaterials scienceChemical engineeringPyrolysisMethanolMolecular dynamicsAerogelThermal decompositionActivation energyChemistryComposite materialOrganic chemistryComputational chemistryEngineeringInteratomic potentialAerogels and thermal insulationCatalytic Processes in Materials ScienceFlame retardant materials and properties