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Comparative study of hybrid multi-timescale and g-scheme methods for MARCS with detailed chemical kinetics

Comparative study of hybrid multi-timescale and g-scheme methods for MARCS with detailed chemical kinetics
Comparative study of hybrid multi-timescale and g-scheme methods for MARCS with detailed chemical kinetics

To develop a multiscale adaptive reduced chemistry solver (MARCS) for computationally efficient modeling of a reactive flow, the Hybrid Multi-Timescale (HMTS) method and the G-Scheme have been evaluated and compared for both homogeneous auto-ignition and 1-D premixed spherical propagating flame calculations with detailed chemical kinetics of hydrogen, methane, dimethyl ether, and n-heptane. It is demonstrated that the dependence of CPU time on the number of species is linear and third-order, respectively, for HMTS and G-Scheme method. The CPU Time of G-Scheme increases dramatically when the number of species of the detailed mechanisms is increased due to the huge computation cost of matrix inversion and reaction mode decomposition. Specifically, the G-Scheme method is faster at the induction stage of ignition and the near-equilibrium condition due to the large integration time step determined by the method adaptively. The HMTS method is faster near the ignition point and for a large kinetic mechanism due to the fast integration at a small base time step. Therefore, the present results suggest that it is possible to develop an MARCS for computationally efficient modeling of combustion by adaptively selecting the HMTS method and the G-Scheme according to local combustion regimes and mechanism sizes and integrating with the co-related dynamic adaptive chemistry and transport method (CO-DACT).

Detailed chemical kinetics, G-Scheme method, Hybrid Multi-Timescale modeling
Sun, Weiqi
6eb672f0-726a-4dde-9d04-a6db31774c74
Wang, Liang
09b9a7f4-7732-43cb-aec0-ab671d309f93
Grenga, Temistocle
be0eba30-74b5-4134-87e7-3a2d6dd3836f
Ju, Yiguang
9fe7f327-5d4e-459a-b024-67ddbd57d9c1
Sun, Weiqi
6eb672f0-726a-4dde-9d04-a6db31774c74
Wang, Liang
09b9a7f4-7732-43cb-aec0-ab671d309f93
Grenga, Temistocle
be0eba30-74b5-4134-87e7-3a2d6dd3836f
Ju, Yiguang
9fe7f327-5d4e-459a-b024-67ddbd57d9c1

Sun, Weiqi, Wang, Liang, Grenga, Temistocle and Ju, Yiguang (2017) Comparative study of hybrid multi-timescale and g-scheme methods for MARCS with detailed chemical kinetics. 10th U.S. National Combustion Meeting, , College Park, United States. 23 - 26 Apr 2017.

Record type: Conference or Workshop Item (Paper)

Abstract

To develop a multiscale adaptive reduced chemistry solver (MARCS) for computationally efficient modeling of a reactive flow, the Hybrid Multi-Timescale (HMTS) method and the G-Scheme have been evaluated and compared for both homogeneous auto-ignition and 1-D premixed spherical propagating flame calculations with detailed chemical kinetics of hydrogen, methane, dimethyl ether, and n-heptane. It is demonstrated that the dependence of CPU time on the number of species is linear and third-order, respectively, for HMTS and G-Scheme method. The CPU Time of G-Scheme increases dramatically when the number of species of the detailed mechanisms is increased due to the huge computation cost of matrix inversion and reaction mode decomposition. Specifically, the G-Scheme method is faster at the induction stage of ignition and the near-equilibrium condition due to the large integration time step determined by the method adaptively. The HMTS method is faster near the ignition point and for a large kinetic mechanism due to the fast integration at a small base time step. Therefore, the present results suggest that it is possible to develop an MARCS for computationally efficient modeling of combustion by adaptively selecting the HMTS method and the G-Scheme according to local combustion regimes and mechanism sizes and integrating with the co-related dynamic adaptive chemistry and transport method (CO-DACT).

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More information

Published date: 2017
Additional Information: Funding Information: This research was funded by the Army Research Office with grant number W911NF-16-1-0076. Publisher Copyright: © 2017 Eastern States Section of the Combustion Institute. All rights reserved.
Venue - Dates: 10th U.S. National Combustion Meeting, , College Park, United States, 2017-04-23 - 2017-04-26
Keywords: Detailed chemical kinetics, G-Scheme method, Hybrid Multi-Timescale modeling

Identifiers

Local EPrints ID: 480917
URI: http://eprints.soton.ac.uk/id/eprint/480917
PURE UUID: 3b04c5cb-e50e-4ff8-80db-b6cf3b264b02
ORCID for Temistocle Grenga: ORCID iD orcid.org/0000-0002-9465-9505

Catalogue record

Date deposited: 10 Aug 2023 16:57
Last modified: 06 Jun 2024 02:16

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Contributors

Author: Weiqi Sun
Author: Liang Wang
Author: Temistocle Grenga ORCID iD
Author: Yiguang Ju

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