Insight into C6F12O fire suppression mechanism on coaxial n-heptane flame: Combined experimental and ReaxFF molecular dynamics simulation
Haoran Xing, Song Lu, Jiulong Tao, Yanting Zhou, Junchao Zhao, Heping Zhang
Topics & Concepts
ReaxFFMolecular dynamicsCoaxialMechanism (biology)HeptaneMaterials scienceComputational chemistryEngineeringChemical physicsMechanicsChemistryPhysicsMechanical engineeringOrganic chemistryInteratomic potentialQuantum mechanicsFire dynamics and safety researchCombustion and Detonation ProcessesAdvanced Combustion Engine Technologies