A novel hybrid machine learning model for predicting rate constants of the reactions between alkane and CH3 radical
Jinhui Yu, Dezun Shan, Hongwei Song, Minghui Yang
Topics & Concepts
Reaction rate constantArrhenius equationCombustionHydrogen atom abstractionAlkaneThermodynamicsArtificial neural networkChemistryRange (aeronautics)RadicalComputer scienceMaterials scienceArtificial intelligencePhysical chemistryOrganic chemistryPhysicsKineticsActivation energyHydrocarbonComposite materialQuantum mechanicsCatalytic Processes in Materials ScienceCatalysis and Oxidation ReactionsAdvanced Combustion Engine Technologies