Direct dynamics of a large complex hydrocarbon reaction system: The reaction of OH with exo-tricyclodecane (the main component of Jet Propellant-10)

J Wu, LG Gao, H Ning, W Ren, DG Truhlar - Combustion and Flame, 2020 - Elsevier
It remains a long-standing challenge to predict the reaction kinetics of large complex
hydrocarbon system from first principles. Exo-tricyclo [5.2. 1.0 2, 6] decane, which is further …

Determination of the JP10+ OH→ product reaction rate with measured fuel concentrations in shock tube experiments

LT Zaczek, DF Davidson… - The Journal of Physical …, 2020 - ACS Publications
The overall reaction rate for JP10+ OH→ products was measured directly via laser
absorption of OH in shock tube experiments from 931 to 1308 K and 0.94 to 1.44 atm. The …

[图书][B] Thermodynamics and Kinetics of Large Hydrocarbon Reaction Using Ab Initio Calculations

J Wu - 2020 - search.proquest.com
It remains a long-standing challenge to predict accurate thermodynamics and kinetics of
large hydrocarbons by first-principle calculations. This is mainly caused by the very high …