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Development and Validation of Small-Size Mechanism for RP-3 Aviation Fuel with High Precision

[Image: see text] In this study, a kerosene surrogate model fuel containing 73% n-dodecane, 14.7% 1,3,5-trimethylcyclohexane, and 12.3% n-propylbenzene (percentage in mass) is developed by considering both the physical and chemical characteristics of practical aviation kerosene. By combining the sma...

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Autores principales: Xi, Shuanghui, Hou, Junxing, Yang, Shuai, Wang, Zhenghe, Li, Shu-Hao, Wang, Fan
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2023
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10433499/
https://www.ncbi.nlm.nih.gov/pubmed/37599952
http://dx.doi.org/10.1021/acsomega.3c02335
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author Xi, Shuanghui
Hou, Junxing
Yang, Shuai
Wang, Zhenghe
Li, Shu-Hao
Wang, Fan
author_facet Xi, Shuanghui
Hou, Junxing
Yang, Shuai
Wang, Zhenghe
Li, Shu-Hao
Wang, Fan
author_sort Xi, Shuanghui
collection PubMed
description [Image: see text] In this study, a kerosene surrogate model fuel containing 73% n-dodecane, 14.7% 1,3,5-trimethylcyclohexane, and 12.3% n-propylbenzene (percentage in mass) is developed by considering both the physical and chemical characteristics of practical aviation kerosene. By combining the small-size C(0)–C(4) (carbon number) core mechanism and the large hydrocarbon submechanisms, a low- and high-temperature chemical kinetic mechanism including 43 species and 136 reactions is constructed for the kerosene surrogate model fuel. The performance of the 43-species mechanism is validated by examining various experimental ignition delay times and laminar flame speeds of single component of n-dodecane and practical kerosene. The predicted main species concentrations during the oxidation process in the jet-stirred reactor by this small-size mechanism exhibit generally acceptable performance with the corresponding experimental data of RP-3 kerosene. The results of brute force sensitivity analysis indicate that the mechanism retains key reaction paths. This relatively small size can be applied to the simulation of computational fluid dynamics to further explore the practical problems of aviation fuel application in engine.
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spelling pubmed-104334992023-08-18 Development and Validation of Small-Size Mechanism for RP-3 Aviation Fuel with High Precision Xi, Shuanghui Hou, Junxing Yang, Shuai Wang, Zhenghe Li, Shu-Hao Wang, Fan ACS Omega [Image: see text] In this study, a kerosene surrogate model fuel containing 73% n-dodecane, 14.7% 1,3,5-trimethylcyclohexane, and 12.3% n-propylbenzene (percentage in mass) is developed by considering both the physical and chemical characteristics of practical aviation kerosene. By combining the small-size C(0)–C(4) (carbon number) core mechanism and the large hydrocarbon submechanisms, a low- and high-temperature chemical kinetic mechanism including 43 species and 136 reactions is constructed for the kerosene surrogate model fuel. The performance of the 43-species mechanism is validated by examining various experimental ignition delay times and laminar flame speeds of single component of n-dodecane and practical kerosene. The predicted main species concentrations during the oxidation process in the jet-stirred reactor by this small-size mechanism exhibit generally acceptable performance with the corresponding experimental data of RP-3 kerosene. The results of brute force sensitivity analysis indicate that the mechanism retains key reaction paths. This relatively small size can be applied to the simulation of computational fluid dynamics to further explore the practical problems of aviation fuel application in engine. American Chemical Society 2023-08-03 /pmc/articles/PMC10433499/ /pubmed/37599952 http://dx.doi.org/10.1021/acsomega.3c02335 Text en © 2023 The Authors. Published by American Chemical Society https://creativecommons.org/licenses/by-nc-nd/4.0/Permits non-commercial access and re-use, provided that author attribution and integrity are maintained; but does not permit creation of adaptations or other derivative works (https://creativecommons.org/licenses/by-nc-nd/4.0/).
spellingShingle Xi, Shuanghui
Hou, Junxing
Yang, Shuai
Wang, Zhenghe
Li, Shu-Hao
Wang, Fan
Development and Validation of Small-Size Mechanism for RP-3 Aviation Fuel with High Precision
title Development and Validation of Small-Size Mechanism for RP-3 Aviation Fuel with High Precision
title_full Development and Validation of Small-Size Mechanism for RP-3 Aviation Fuel with High Precision
title_fullStr Development and Validation of Small-Size Mechanism for RP-3 Aviation Fuel with High Precision
title_full_unstemmed Development and Validation of Small-Size Mechanism for RP-3 Aviation Fuel with High Precision
title_short Development and Validation of Small-Size Mechanism for RP-3 Aviation Fuel with High Precision
title_sort development and validation of small-size mechanism for rp-3 aviation fuel with high precision
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10433499/
https://www.ncbi.nlm.nih.gov/pubmed/37599952
http://dx.doi.org/10.1021/acsomega.3c02335
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