This work provides
the target-oriented fuel design concept for
efficient, clean combustion and identifies the functional configuration
of fuel components for the homogeneous charge autoignition (HCAI)
combustion mode. The n-heptane–PODE3–ethanol mixture is applied to exemplify the fuel design process.
The interaction among n-heptane, PODE3, and ethanol for the heat release process and the role of PODE3 and ethanol on the soot precursors (n-C4H3, C2H2, C3H3, CH3, C2H4, and C4H4) reduction are also discussed. The main conclusions
are summarized below: First, the 60% n-heptane–20%
PODE3–20% ethanol exhibits distinct low temperature
heat release, first high temperature heat release (HTHR) and second
HTHR which are contributed by PODE3/n-heptane, n-heptane/ethanol, and ethanol, respectively. The dominant
rate controlling
reactions for OH accumulation are H atom abstraction from n-heptane and ketohydroperoxide decomposition of n-heptane. Therefore, n-heptane is the
major ignition source, while PODE3 works as the auxiliary
ignition source because the ignition process is mainly controlled
by n-heptane. Second, both PODE3 and ethanol
are free of n-C4H3 emission,
and they can dramatically reduce the C2H2, C3H3, C2H4, and C4H4 emissions. Therein, PODE3 is more effective
in C2H2, C2H4, and C4H4 reduction than ethanol. But PODE3 and ethanol both increase the CH3 production. Third,
the functional configuration of fuel components for the HCAI combustion
mode is “chemical ignition source–PM inhibitor–homogeneous
charge” (PM = particulate matter). The n-heptane,
PODE3, and ethanol act as the chemical ignition source,
PM inhibitor, and homogeneous charge, respectively, due to the high
reactivity, the high oxygen mass content/lack of C–C bond,
and high volatility, respectively. The combustion temperature window
of the HCAI combustion mode is 1400–2200 K, which corresponds
to the CO/HC oxidation limit and NO
x
production
limit, respectively.