Abstract
The combustion properties of a gasoline-like blend of pentene isomers were determined using multiple types of experimental measurements. The representative mixture (Mix A) is composed of 5.7% 1-pentene (1-C5H10), 39.4% 2-pentene (2-C5H10), 12.5% 2-methyl-1-butene (2M1B), and 42.4% 2-methyl-2-butene (2M2B) (% mol). Laminar flame speeds were measured at equivalence ratios of 0.7-1.5 in a constant-volume combustion chamber, and ignition delay times (including both OH* and CH* diagnostics) as well as CO time-history profiles were performed in shock tubes, in highly diluted mixtures (0.995 He/Ar), at a stoichiometric condition for temperatures ranging from 1350 to 1750 K, and at near-atmospheric pressure. Two additional unbalanced mixtures removing either 2M2B (Mix B) or 2-C5H10 (Mix C) were studied in a shock tube to collect CO time histories, representing the most stringent validation constraints, as these two pentenes constitute the biggest proportions in Mix A and exhibit opposite behaviors in terms of reactivity due to their chemical structure differences. Numerical predictions using a recent validated chemical kinetics mechanism encompassing all pentene isomers from Grégoire et al. ( Fuel 2022, 323, 124223 ) are presented. The use of a complex blend of four pentene isomers in the present paper provided a capstone test of the current mechanism’s ability to model pentene-isomer combustion chemistry, with very good results that reflect positively on the current state of the art in pentene isomer kinetics modeling.
| Original language | English |
|---|---|
| Pages (from-to) | 495-505 |
| Number of pages | 11 |
| Journal | Journal of Physical Chemistry A |
| Volume | 127 |
| Issue number | 2 |
| DOIs | |
| State | Published - 19 Jan 2023 |
| Externally published | Yes |
Bibliographical note
Publisher Copyright:© 2023 American Chemical Society.
ASJC Scopus subject areas
- Physical and Theoretical Chemistry
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