机译:Kinetic Mechanism for Simulating the Temperature and Pressure Effect on the Explosive Decomposition of Acetylene by ReaxFF Molecular Dynamics
Tianjin Univ;
Acetylene pyrolysis; Molecular dynamics simulation; ReaxFF; Free radical reaction; Kinetic model; POLYCYCLIC AROMATIC-HYDROCARBONS; HOMOGENEOUS THERMAL-DECOMPOSITION; SOOT FORMATION; PYROLYSIS; LINKAGES; MODEL;