Simulations of decane-ammonia autoignition in two mixture fractions

This paper presents a zero-dimensional Doubly Conditional Moment Closure (0D-DCMC) methodology for investigating dual-fuel combustion involving ammonia and diesel. The approach uses two mixture fractions as conditioning variables, one for each fuel, to effectively model ignition and reveal the flame...

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Main Authors: Angelos Kylikas, Epaminondas Mastorakos
Format: Article
Language:English
Published: Frontiers Media S.A. 2025-01-01
Series:Frontiers in Mechanical Engineering
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Online Access:https://www.frontiersin.org/articles/10.3389/fmech.2024.1498820/full
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author Angelos Kylikas
Epaminondas Mastorakos
Epaminondas Mastorakos
author_facet Angelos Kylikas
Epaminondas Mastorakos
Epaminondas Mastorakos
author_sort Angelos Kylikas
collection DOAJ
description This paper presents a zero-dimensional Doubly Conditional Moment Closure (0D-DCMC) methodology for investigating dual-fuel combustion involving ammonia and diesel. The approach uses two mixture fractions as conditioning variables, one for each fuel, to effectively model ignition and reveal the flame structure in mixture fraction space. Initially, 0D reactor calculations are performed using Cantera, exploring the chemical mechanism, identifying the most reactive mixture fractions, and determining key species involved in the ignition process. Following that, the 0D-DCMC simulations carried out provide understanding into the effects of the scalar and cross-scalar dissipation rates on autoignition. The results show that higher scalar dissipation rates delay ignition, while a negative cross-scalar dissipation rate reduces ignition delay compared to a positive rate. The ignition is shown to occur near the most reactive mixture fraction of the most reactive fuel, at lower conditional values of the less reactive fuel’s mixture fraction. The species fronts formed are observed to follow a trajectory between the stoichiometric mixture fractions of the fuels. The results establish a robust computational framework for modeling dual-fuel combustion.
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institution Kabale University
issn 2297-3079
language English
publishDate 2025-01-01
publisher Frontiers Media S.A.
record_format Article
series Frontiers in Mechanical Engineering
spelling doaj-art-6b2d64d393284b2abbda24e3373cdf3b2025-01-30T06:22:52ZengFrontiers Media S.A.Frontiers in Mechanical Engineering2297-30792025-01-011010.3389/fmech.2024.14988201498820Simulations of decane-ammonia autoignition in two mixture fractionsAngelos Kylikas0Epaminondas Mastorakos1Epaminondas Mastorakos2Department of Engineering, University of Cambridge, Cambridge, United KingdomDepartment of Engineering, University of Cambridge, Cambridge, United KingdomCambridge Centre for Advanced Research and Education in Singapore (CARES), Singapore, SingaporeThis paper presents a zero-dimensional Doubly Conditional Moment Closure (0D-DCMC) methodology for investigating dual-fuel combustion involving ammonia and diesel. The approach uses two mixture fractions as conditioning variables, one for each fuel, to effectively model ignition and reveal the flame structure in mixture fraction space. Initially, 0D reactor calculations are performed using Cantera, exploring the chemical mechanism, identifying the most reactive mixture fractions, and determining key species involved in the ignition process. Following that, the 0D-DCMC simulations carried out provide understanding into the effects of the scalar and cross-scalar dissipation rates on autoignition. The results show that higher scalar dissipation rates delay ignition, while a negative cross-scalar dissipation rate reduces ignition delay compared to a positive rate. The ignition is shown to occur near the most reactive mixture fraction of the most reactive fuel, at lower conditional values of the less reactive fuel’s mixture fraction. The species fronts formed are observed to follow a trajectory between the stoichiometric mixture fractions of the fuels. The results establish a robust computational framework for modeling dual-fuel combustion.https://www.frontiersin.org/articles/10.3389/fmech.2024.1498820/fullammoniaconditional moment closurenon-premixeddecanedual-fuel
spellingShingle Angelos Kylikas
Epaminondas Mastorakos
Epaminondas Mastorakos
Simulations of decane-ammonia autoignition in two mixture fractions
Frontiers in Mechanical Engineering
ammonia
conditional moment closure
non-premixed
decane
dual-fuel
title Simulations of decane-ammonia autoignition in two mixture fractions
title_full Simulations of decane-ammonia autoignition in two mixture fractions
title_fullStr Simulations of decane-ammonia autoignition in two mixture fractions
title_full_unstemmed Simulations of decane-ammonia autoignition in two mixture fractions
title_short Simulations of decane-ammonia autoignition in two mixture fractions
title_sort simulations of decane ammonia autoignition in two mixture fractions
topic ammonia
conditional moment closure
non-premixed
decane
dual-fuel
url https://www.frontiersin.org/articles/10.3389/fmech.2024.1498820/full
work_keys_str_mv AT angeloskylikas simulationsofdecaneammoniaautoignitionintwomixturefractions
AT epaminondasmastorakos simulationsofdecaneammoniaautoignitionintwomixturefractions
AT epaminondasmastorakos simulationsofdecaneammoniaautoignitionintwomixturefractions