Analysis of the nanostructure evolution of soot in n-heptane/iso-octane with 2,5-dimethylfuran addition: A combined experimental study and ReaxFF MD simulations
Wenlong Dong, Run Hong, Yuhang Yang, Dongyang Wang, Bingbing Qiu, Huaqiang Chu
Topics & Concepts
ReaxFFOctaneSootHeptaneNanostructureChemistryChemical engineeringOctane ratingThermodynamicsMaterials scienceCombustionAnalytical Chemistry (journal)Organic chemistryMolecular dynamicsComputational chemistryNanotechnologyPhysicsInteratomic potentialEngineeringAdvanced Combustion Engine TechnologiesCatalytic Processes in Materials ScienceCatalysis and Oxidation Reactions