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Development of a combined reduced primary reference fuel-alcohols (methanol/ethanol/propanols/butanols/n-pentanol) mechanism for engine applications

Author

Listed:
  • Liu, Xinlei
  • Wang, Hu
  • Zheng, Zunqing
  • Liu, Jialin
  • Reitz, Rolf D.
  • Yao, Mingfa

Abstract

A combined reduced primary reference fuel (PRF)-alcohols (methanol/ethanol/propanols/butanols/n-pentanol) combustion kinetic mechanism composed of 161 species and 622 reactions was developed for engine combustion simulations. The obtained reduced PRF-alcohols mechanism was constructed with a hierarchical structure. Minor adjustments were performed to ensure the predictive performance against experimental results. The reduced PRF-alcohols mechanism adequately predicted experimental ignition delays, laminar flame speeds, and species mole fraction profiles. New homogeneous charge compression ignition experiments fueled with 75% (mol.) n-propanol/25% n-heptane, 75% i-propanol/25% n-heptane, and 75% n-pentanol/25% n-heptane blends were also collected and served as further mechanism validations. By coupled with the toluene-polycyclic aromatic hydrocarbons sub-mechanism, the reduced PRF-alcohols mechanism was used for the three dimensional modeling studies to investigate the direct injection compression ignition (DICI) combustion fueled with diesel/alcohol blends at the 5% fuel oxygen content. Zero-dimensional modeling studies were also conducted. The modeling results indicated that in DICI combustion, it was the different physical mixing qualities incurred by the different fuel reactivity dominated the soot formation but not the different carbon chain chemical structures. The O atom of the fuel molecule was more efficient than the O2 molecule for the soot oxidation.

Suggested Citation

  • Liu, Xinlei & Wang, Hu & Zheng, Zunqing & Liu, Jialin & Reitz, Rolf D. & Yao, Mingfa, 2016. "Development of a combined reduced primary reference fuel-alcohols (methanol/ethanol/propanols/butanols/n-pentanol) mechanism for engine applications," Energy, Elsevier, vol. 114(C), pages 542-558.
    • Handle: RePEc:eee:energy:v:114:y:2016:i:c:p:542-558
    DOI: 10.1016/j.energy.2016.08.001
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    1. Bergthorson, Jeffrey M. & Thomson, Murray J., 2015. "A review of the combustion and emissions properties of advanced transportation biofuels and their impact on existing and future engines," Renewable and Sustainable Energy Reviews, Elsevier, vol. 42(C), pages 1393-1417.
    2. Wei, Liangjie & Cheung, C.S. & Huang, Zuohua, 2014. "Effect of n-pentanol addition on the combustion, performance and emission characteristics of a direct-injection diesel engine," Energy, Elsevier, vol. 70(C), pages 172-180.
    3. Jin, Chao & Yao, Mingfa & Liu, Haifeng & Lee, Chia-fon F. & Ji, Jing, 2011. "Progress in the production and application of n-butanol as a biofuel," Renewable and Sustainable Energy Reviews, Elsevier, vol. 15(8), pages 4080-4106.
    4. Liu, Haifeng & Wang, Xin & Zheng, Zunqing & Gu, Jingbo & Wang, Hu & Yao, Mingfa, 2014. "Experimental and simulation investigation of the combustion characteristics and emissions using n-butanol/biodiesel dual-fuel injection on a diesel engine," Energy, Elsevier, vol. 74(C), pages 741-752.
    5. Benajes, Jesús & Molina, Santiago & García, Antonio & Monsalve-Serrano, Javier, 2015. "Effects of low reactivity fuel characteristics and blending ratio on low load RCCI (reactivity controlled compression ignition) performance and emissions in a heavy-duty diesel engine," Energy, Elsevier, vol. 90(P2), pages 1261-1271.
    6. Li, Yaopeng & Jia, Ming & Chang, Yachao & Liu, Yaodong & Xie, Maozhao & Wang, Tianyou & Zhou, Lei, 2014. "Parametric study and optimization of a RCCI (reactivity controlled compression ignition) engine fueled with methanol and diesel," Energy, Elsevier, vol. 65(C), pages 319-332.
    7. Balamurugan, T. & Nalini, R., 2014. "Experimental investigation on performance, combustion and emission characteristics of four stroke diesel engine using diesel blended with alcohol as fuel," Energy, Elsevier, vol. 78(C), pages 356-363.
    8. Li, Li & Wang, Jianxin & Wang, Zhi & Liu, Haoye, 2015. "Combustion and emissions of compression ignition in a direct injection diesel engine fueled with pentanol," Energy, Elsevier, vol. 80(C), pages 575-581.
    9. Gravalos, I. & Moshou, D. & Gialamas, Th. & Xyradakis, P. & Kateris, D. & Tsiropoulos, Z., 2013. "Emissions characteristics of spark ignition engine operating on lower–higher molecular mass alcohol blended gasoline fuels," Renewable Energy, Elsevier, vol. 50(C), pages 27-32.
    10. Campos-Fernández, Javier & Arnal, Juan M. & Gómez, Jose & Dorado, M. Pilar, 2012. "A comparison of performance of higher alcohols/diesel fuel blends in a diesel engine," Applied Energy, Elsevier, vol. 95(C), pages 267-275.
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