TY - JOUR
T1 - Real Gas Effects in High-Pressure Ignition of n-Dodecane/Air Mixtures
AU - Cao, Yuanxinxin
AU - Liang, Wenkai
AU - Law, Chung K.
N1 - Publisher Copyright:
© 2024 American Chemical Society.
PY - 2024/5/9
Y1 - 2024/5/9
N2 - This work studies the real gas effects on the autoignition of hydrocarbon fuels under high pressures, using normal dodecane (n-dodecane) as the representative fuel and the Redlich-Kwong equation of state (EoS) as the real gas description. It is demonstrated that the real gas description yields a shorter ignition delay time (IDT) compared with the ideal gas description, especially in low-temperature regimes which could encompass the negative temperature coefficient (NTC) phenomena and has a stronger dependence on the molecular volume than the attractive potential. The study further shows that high pressure facilitates low-temperature reaction pathways, where the compressibility factors of key reactants contribute to real gas effects. Moreover, the results suggest that accounting for real gas behavior leads to an increase in the formation of polycyclic aromatic hydrocarbons (PAHs), which, in turn, promotes soot generation.
AB - This work studies the real gas effects on the autoignition of hydrocarbon fuels under high pressures, using normal dodecane (n-dodecane) as the representative fuel and the Redlich-Kwong equation of state (EoS) as the real gas description. It is demonstrated that the real gas description yields a shorter ignition delay time (IDT) compared with the ideal gas description, especially in low-temperature regimes which could encompass the negative temperature coefficient (NTC) phenomena and has a stronger dependence on the molecular volume than the attractive potential. The study further shows that high pressure facilitates low-temperature reaction pathways, where the compressibility factors of key reactants contribute to real gas effects. Moreover, the results suggest that accounting for real gas behavior leads to an increase in the formation of polycyclic aromatic hydrocarbons (PAHs), which, in turn, promotes soot generation.
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U2 - 10.1021/acs.jpca.3c08395
DO - 10.1021/acs.jpca.3c08395
M3 - Article
C2 - 38573007
AN - SCOPUS:85189977683
SN - 1089-5639
VL - 128
SP - 3604
EP - 3612
JO - Journal of Physical Chemistry A
JF - Journal of Physical Chemistry A
IS - 18
ER -