Construction and derivation of a series of skeletal chemical mechanisms for n-alkanes with uniform and decoupling structure based on reaction rate rules
A reliable reduced chemical model is crucial for the design and optimization of advanced combustion systems. At present, reduced mechanisms are usually obtained by directly reducing detailed mechanisms. Due to the limitations of computational methods and measurement techniques, the construction of d...
Ausführliche Beschreibung
Autor*in: |
Chang, Yachao [verfasserIn] |
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Sprache: |
Englisch |
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2022transfer abstract |
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Übergeordnetes Werk: |
Enthalten in: Methods for detecting change in hydrochemical time series in response to targeted pollutant mitigation in river catchments - Lloyd, C.E.M. ELSEVIER, 2014, the journal of the Combustion Institute, Amsterdam [u.a.] |
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Übergeordnetes Werk: |
volume:236 ; year:2022 ; pages:0 |
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DOI / URN: |
10.1016/j.combustflame.2021.111785 |
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ELV056576862 |
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520 | |a A reliable reduced chemical model is crucial for the design and optimization of advanced combustion systems. At present, reduced mechanisms are usually obtained by directly reducing detailed mechanisms. Due to the limitations of computational methods and measurement techniques, the construction of detailed mechanisms for high-carbon fuels is still challenging, which hinders the development of the reduced mechanism for practical transportation fuels. To solve this problem, a systematic method is proposed in this work. The method includes two aspects. One is the construction of a skeletal mechanism for the reference fuel by integrating decoupling methodology, reaction class-based global sensitivity analysis method, and genetic algorithm. The other one is that a set of skeletal mechanisms with a uniform structure is extrapolated from the skeletal mechanism of the reference fuel through the reaction rate rules. In the present method, only the detailed mechanism of the reference fuel is required to construct a set of skeletal mechanisms for the fuels with a similar molecular structure but different size as that of the reference fuel. The performance of the present method is evaluated by building a set of skeletal mechanisms for normal alkanes of C5–C20 in this work. Based on extensive validations under wide operating conditions, satisfactory predictions are achieved by the skeletal mechanisms for n-alkanes, which illustrates the potential of the present method for the applications of other fuels. | ||
520 | |a A reliable reduced chemical model is crucial for the design and optimization of advanced combustion systems. At present, reduced mechanisms are usually obtained by directly reducing detailed mechanisms. Due to the limitations of computational methods and measurement techniques, the construction of detailed mechanisms for high-carbon fuels is still challenging, which hinders the development of the reduced mechanism for practical transportation fuels. To solve this problem, a systematic method is proposed in this work. The method includes two aspects. One is the construction of a skeletal mechanism for the reference fuel by integrating decoupling methodology, reaction class-based global sensitivity analysis method, and genetic algorithm. The other one is that a set of skeletal mechanisms with a uniform structure is extrapolated from the skeletal mechanism of the reference fuel through the reaction rate rules. In the present method, only the detailed mechanism of the reference fuel is required to construct a set of skeletal mechanisms for the fuels with a similar molecular structure but different size as that of the reference fuel. The performance of the present method is evaluated by building a set of skeletal mechanisms for normal alkanes of C5–C20 in this work. Based on extensive validations under wide operating conditions, satisfactory predictions are achieved by the skeletal mechanisms for n-alkanes, which illustrates the potential of the present method for the applications of other fuels. | ||
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10.1016/j.combustflame.2021.111785 doi /cbs_pica/cbs_olc/import_discovery/elsevier/einzuspielen/GBV00000000001651.pica (DE-627)ELV056576862 (ELSEVIER)S0010-2180(21)00528-9 DE-627 ger DE-627 rakwb eng 690 VZ 610 VZ 74.00 bkl 44.73 bkl Chang, Yachao verfasserin aut Construction and derivation of a series of skeletal chemical mechanisms for n-alkanes with uniform and decoupling structure based on reaction rate rules 2022transfer abstract nicht spezifiziert zzz rdacontent nicht spezifiziert z rdamedia nicht spezifiziert zu rdacarrier A reliable reduced chemical model is crucial for the design and optimization of advanced combustion systems. At present, reduced mechanisms are usually obtained by directly reducing detailed mechanisms. Due to the limitations of computational methods and measurement techniques, the construction of detailed mechanisms for high-carbon fuels is still challenging, which hinders the development of the reduced mechanism for practical transportation fuels. To solve this problem, a systematic method is proposed in this work. The method includes two aspects. One is the construction of a skeletal mechanism for the reference fuel by integrating decoupling methodology, reaction class-based global sensitivity analysis method, and genetic algorithm. The other one is that a set of skeletal mechanisms with a uniform structure is extrapolated from the skeletal mechanism of the reference fuel through the reaction rate rules. In the present method, only the detailed mechanism of the reference fuel is required to construct a set of skeletal mechanisms for the fuels with a similar molecular structure but different size as that of the reference fuel. The performance of the present method is evaluated by building a set of skeletal mechanisms for normal alkanes of C5–C20 in this work. Based on extensive validations under wide operating conditions, satisfactory predictions are achieved by the skeletal mechanisms for n-alkanes, which illustrates the potential of the present method for the applications of other fuels. A reliable reduced chemical model is crucial for the design and optimization of advanced combustion systems. At present, reduced mechanisms are usually obtained by directly reducing detailed mechanisms. Due to the limitations of computational methods and measurement techniques, the construction of detailed mechanisms for high-carbon fuels is still challenging, which hinders the development of the reduced mechanism for practical transportation fuels. To solve this problem, a systematic method is proposed in this work. The method includes two aspects. One is the construction of a skeletal mechanism for the reference fuel by integrating decoupling methodology, reaction class-based global sensitivity analysis method, and genetic algorithm. The other one is that a set of skeletal mechanisms with a uniform structure is extrapolated from the skeletal mechanism of the reference fuel through the reaction rate rules. In the present method, only the detailed mechanism of the reference fuel is required to construct a set of skeletal mechanisms for the fuels with a similar molecular structure but different size as that of the reference fuel. The performance of the present method is evaluated by building a set of skeletal mechanisms for normal alkanes of C5–C20 in this work. Based on extensive validations under wide operating conditions, satisfactory predictions are achieved by the skeletal mechanisms for n-alkanes, which illustrates the potential of the present method for the applications of other fuels. Jia, Ming oth Wang, Pengzhi oth Niu, Bo oth Liu, Jiayue oth Enthalten in Elsevier Science Lloyd, C.E.M. ELSEVIER Methods for detecting change in hydrochemical time series in response to targeted pollutant mitigation in river catchments 2014 the journal of the Combustion Institute Amsterdam [u.a.] (DE-627)ELV018057144 volume:236 year:2022 pages:0 https://doi.org/10.1016/j.combustflame.2021.111785 Volltext GBV_USEFLAG_U GBV_ELV SYSFLAG_U SSG-OLC-PHA SSG-OPC-GGO GBV_ILN_70 74.00 Geographie Anthropogeographie: Allgemeines VZ 44.73 Geomedizin VZ AR 236 2022 0 |
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10.1016/j.combustflame.2021.111785 doi /cbs_pica/cbs_olc/import_discovery/elsevier/einzuspielen/GBV00000000001651.pica (DE-627)ELV056576862 (ELSEVIER)S0010-2180(21)00528-9 DE-627 ger DE-627 rakwb eng 690 VZ 610 VZ 74.00 bkl 44.73 bkl Chang, Yachao verfasserin aut Construction and derivation of a series of skeletal chemical mechanisms for n-alkanes with uniform and decoupling structure based on reaction rate rules 2022transfer abstract nicht spezifiziert zzz rdacontent nicht spezifiziert z rdamedia nicht spezifiziert zu rdacarrier A reliable reduced chemical model is crucial for the design and optimization of advanced combustion systems. At present, reduced mechanisms are usually obtained by directly reducing detailed mechanisms. Due to the limitations of computational methods and measurement techniques, the construction of detailed mechanisms for high-carbon fuels is still challenging, which hinders the development of the reduced mechanism for practical transportation fuels. To solve this problem, a systematic method is proposed in this work. The method includes two aspects. One is the construction of a skeletal mechanism for the reference fuel by integrating decoupling methodology, reaction class-based global sensitivity analysis method, and genetic algorithm. The other one is that a set of skeletal mechanisms with a uniform structure is extrapolated from the skeletal mechanism of the reference fuel through the reaction rate rules. In the present method, only the detailed mechanism of the reference fuel is required to construct a set of skeletal mechanisms for the fuels with a similar molecular structure but different size as that of the reference fuel. The performance of the present method is evaluated by building a set of skeletal mechanisms for normal alkanes of C5–C20 in this work. Based on extensive validations under wide operating conditions, satisfactory predictions are achieved by the skeletal mechanisms for n-alkanes, which illustrates the potential of the present method for the applications of other fuels. A reliable reduced chemical model is crucial for the design and optimization of advanced combustion systems. At present, reduced mechanisms are usually obtained by directly reducing detailed mechanisms. Due to the limitations of computational methods and measurement techniques, the construction of detailed mechanisms for high-carbon fuels is still challenging, which hinders the development of the reduced mechanism for practical transportation fuels. To solve this problem, a systematic method is proposed in this work. The method includes two aspects. One is the construction of a skeletal mechanism for the reference fuel by integrating decoupling methodology, reaction class-based global sensitivity analysis method, and genetic algorithm. The other one is that a set of skeletal mechanisms with a uniform structure is extrapolated from the skeletal mechanism of the reference fuel through the reaction rate rules. In the present method, only the detailed mechanism of the reference fuel is required to construct a set of skeletal mechanisms for the fuels with a similar molecular structure but different size as that of the reference fuel. The performance of the present method is evaluated by building a set of skeletal mechanisms for normal alkanes of C5–C20 in this work. Based on extensive validations under wide operating conditions, satisfactory predictions are achieved by the skeletal mechanisms for n-alkanes, which illustrates the potential of the present method for the applications of other fuels. Jia, Ming oth Wang, Pengzhi oth Niu, Bo oth Liu, Jiayue oth Enthalten in Elsevier Science Lloyd, C.E.M. ELSEVIER Methods for detecting change in hydrochemical time series in response to targeted pollutant mitigation in river catchments 2014 the journal of the Combustion Institute Amsterdam [u.a.] (DE-627)ELV018057144 volume:236 year:2022 pages:0 https://doi.org/10.1016/j.combustflame.2021.111785 Volltext GBV_USEFLAG_U GBV_ELV SYSFLAG_U SSG-OLC-PHA SSG-OPC-GGO GBV_ILN_70 74.00 Geographie Anthropogeographie: Allgemeines VZ 44.73 Geomedizin VZ AR 236 2022 0 |
allfields_unstemmed |
10.1016/j.combustflame.2021.111785 doi /cbs_pica/cbs_olc/import_discovery/elsevier/einzuspielen/GBV00000000001651.pica (DE-627)ELV056576862 (ELSEVIER)S0010-2180(21)00528-9 DE-627 ger DE-627 rakwb eng 690 VZ 610 VZ 74.00 bkl 44.73 bkl Chang, Yachao verfasserin aut Construction and derivation of a series of skeletal chemical mechanisms for n-alkanes with uniform and decoupling structure based on reaction rate rules 2022transfer abstract nicht spezifiziert zzz rdacontent nicht spezifiziert z rdamedia nicht spezifiziert zu rdacarrier A reliable reduced chemical model is crucial for the design and optimization of advanced combustion systems. At present, reduced mechanisms are usually obtained by directly reducing detailed mechanisms. Due to the limitations of computational methods and measurement techniques, the construction of detailed mechanisms for high-carbon fuels is still challenging, which hinders the development of the reduced mechanism for practical transportation fuels. To solve this problem, a systematic method is proposed in this work. The method includes two aspects. One is the construction of a skeletal mechanism for the reference fuel by integrating decoupling methodology, reaction class-based global sensitivity analysis method, and genetic algorithm. The other one is that a set of skeletal mechanisms with a uniform structure is extrapolated from the skeletal mechanism of the reference fuel through the reaction rate rules. In the present method, only the detailed mechanism of the reference fuel is required to construct a set of skeletal mechanisms for the fuels with a similar molecular structure but different size as that of the reference fuel. The performance of the present method is evaluated by building a set of skeletal mechanisms for normal alkanes of C5–C20 in this work. Based on extensive validations under wide operating conditions, satisfactory predictions are achieved by the skeletal mechanisms for n-alkanes, which illustrates the potential of the present method for the applications of other fuels. A reliable reduced chemical model is crucial for the design and optimization of advanced combustion systems. At present, reduced mechanisms are usually obtained by directly reducing detailed mechanisms. Due to the limitations of computational methods and measurement techniques, the construction of detailed mechanisms for high-carbon fuels is still challenging, which hinders the development of the reduced mechanism for practical transportation fuels. To solve this problem, a systematic method is proposed in this work. The method includes two aspects. One is the construction of a skeletal mechanism for the reference fuel by integrating decoupling methodology, reaction class-based global sensitivity analysis method, and genetic algorithm. The other one is that a set of skeletal mechanisms with a uniform structure is extrapolated from the skeletal mechanism of the reference fuel through the reaction rate rules. In the present method, only the detailed mechanism of the reference fuel is required to construct a set of skeletal mechanisms for the fuels with a similar molecular structure but different size as that of the reference fuel. The performance of the present method is evaluated by building a set of skeletal mechanisms for normal alkanes of C5–C20 in this work. Based on extensive validations under wide operating conditions, satisfactory predictions are achieved by the skeletal mechanisms for n-alkanes, which illustrates the potential of the present method for the applications of other fuels. Jia, Ming oth Wang, Pengzhi oth Niu, Bo oth Liu, Jiayue oth Enthalten in Elsevier Science Lloyd, C.E.M. ELSEVIER Methods for detecting change in hydrochemical time series in response to targeted pollutant mitigation in river catchments 2014 the journal of the Combustion Institute Amsterdam [u.a.] (DE-627)ELV018057144 volume:236 year:2022 pages:0 https://doi.org/10.1016/j.combustflame.2021.111785 Volltext GBV_USEFLAG_U GBV_ELV SYSFLAG_U SSG-OLC-PHA SSG-OPC-GGO GBV_ILN_70 74.00 Geographie Anthropogeographie: Allgemeines VZ 44.73 Geomedizin VZ AR 236 2022 0 |
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10.1016/j.combustflame.2021.111785 doi /cbs_pica/cbs_olc/import_discovery/elsevier/einzuspielen/GBV00000000001651.pica (DE-627)ELV056576862 (ELSEVIER)S0010-2180(21)00528-9 DE-627 ger DE-627 rakwb eng 690 VZ 610 VZ 74.00 bkl 44.73 bkl Chang, Yachao verfasserin aut Construction and derivation of a series of skeletal chemical mechanisms for n-alkanes with uniform and decoupling structure based on reaction rate rules 2022transfer abstract nicht spezifiziert zzz rdacontent nicht spezifiziert z rdamedia nicht spezifiziert zu rdacarrier A reliable reduced chemical model is crucial for the design and optimization of advanced combustion systems. At present, reduced mechanisms are usually obtained by directly reducing detailed mechanisms. Due to the limitations of computational methods and measurement techniques, the construction of detailed mechanisms for high-carbon fuels is still challenging, which hinders the development of the reduced mechanism for practical transportation fuels. To solve this problem, a systematic method is proposed in this work. The method includes two aspects. One is the construction of a skeletal mechanism for the reference fuel by integrating decoupling methodology, reaction class-based global sensitivity analysis method, and genetic algorithm. The other one is that a set of skeletal mechanisms with a uniform structure is extrapolated from the skeletal mechanism of the reference fuel through the reaction rate rules. In the present method, only the detailed mechanism of the reference fuel is required to construct a set of skeletal mechanisms for the fuels with a similar molecular structure but different size as that of the reference fuel. The performance of the present method is evaluated by building a set of skeletal mechanisms for normal alkanes of C5–C20 in this work. Based on extensive validations under wide operating conditions, satisfactory predictions are achieved by the skeletal mechanisms for n-alkanes, which illustrates the potential of the present method for the applications of other fuels. A reliable reduced chemical model is crucial for the design and optimization of advanced combustion systems. At present, reduced mechanisms are usually obtained by directly reducing detailed mechanisms. Due to the limitations of computational methods and measurement techniques, the construction of detailed mechanisms for high-carbon fuels is still challenging, which hinders the development of the reduced mechanism for practical transportation fuels. To solve this problem, a systematic method is proposed in this work. The method includes two aspects. One is the construction of a skeletal mechanism for the reference fuel by integrating decoupling methodology, reaction class-based global sensitivity analysis method, and genetic algorithm. The other one is that a set of skeletal mechanisms with a uniform structure is extrapolated from the skeletal mechanism of the reference fuel through the reaction rate rules. In the present method, only the detailed mechanism of the reference fuel is required to construct a set of skeletal mechanisms for the fuels with a similar molecular structure but different size as that of the reference fuel. The performance of the present method is evaluated by building a set of skeletal mechanisms for normal alkanes of C5–C20 in this work. Based on extensive validations under wide operating conditions, satisfactory predictions are achieved by the skeletal mechanisms for n-alkanes, which illustrates the potential of the present method for the applications of other fuels. Jia, Ming oth Wang, Pengzhi oth Niu, Bo oth Liu, Jiayue oth Enthalten in Elsevier Science Lloyd, C.E.M. ELSEVIER Methods for detecting change in hydrochemical time series in response to targeted pollutant mitigation in river catchments 2014 the journal of the Combustion Institute Amsterdam [u.a.] (DE-627)ELV018057144 volume:236 year:2022 pages:0 https://doi.org/10.1016/j.combustflame.2021.111785 Volltext GBV_USEFLAG_U GBV_ELV SYSFLAG_U SSG-OLC-PHA SSG-OPC-GGO GBV_ILN_70 74.00 Geographie Anthropogeographie: Allgemeines VZ 44.73 Geomedizin VZ AR 236 2022 0 |
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10.1016/j.combustflame.2021.111785 doi /cbs_pica/cbs_olc/import_discovery/elsevier/einzuspielen/GBV00000000001651.pica (DE-627)ELV056576862 (ELSEVIER)S0010-2180(21)00528-9 DE-627 ger DE-627 rakwb eng 690 VZ 610 VZ 74.00 bkl 44.73 bkl Chang, Yachao verfasserin aut Construction and derivation of a series of skeletal chemical mechanisms for n-alkanes with uniform and decoupling structure based on reaction rate rules 2022transfer abstract nicht spezifiziert zzz rdacontent nicht spezifiziert z rdamedia nicht spezifiziert zu rdacarrier A reliable reduced chemical model is crucial for the design and optimization of advanced combustion systems. At present, reduced mechanisms are usually obtained by directly reducing detailed mechanisms. Due to the limitations of computational methods and measurement techniques, the construction of detailed mechanisms for high-carbon fuels is still challenging, which hinders the development of the reduced mechanism for practical transportation fuels. To solve this problem, a systematic method is proposed in this work. The method includes two aspects. One is the construction of a skeletal mechanism for the reference fuel by integrating decoupling methodology, reaction class-based global sensitivity analysis method, and genetic algorithm. The other one is that a set of skeletal mechanisms with a uniform structure is extrapolated from the skeletal mechanism of the reference fuel through the reaction rate rules. In the present method, only the detailed mechanism of the reference fuel is required to construct a set of skeletal mechanisms for the fuels with a similar molecular structure but different size as that of the reference fuel. The performance of the present method is evaluated by building a set of skeletal mechanisms for normal alkanes of C5–C20 in this work. Based on extensive validations under wide operating conditions, satisfactory predictions are achieved by the skeletal mechanisms for n-alkanes, which illustrates the potential of the present method for the applications of other fuels. A reliable reduced chemical model is crucial for the design and optimization of advanced combustion systems. At present, reduced mechanisms are usually obtained by directly reducing detailed mechanisms. Due to the limitations of computational methods and measurement techniques, the construction of detailed mechanisms for high-carbon fuels is still challenging, which hinders the development of the reduced mechanism for practical transportation fuels. To solve this problem, a systematic method is proposed in this work. The method includes two aspects. One is the construction of a skeletal mechanism for the reference fuel by integrating decoupling methodology, reaction class-based global sensitivity analysis method, and genetic algorithm. The other one is that a set of skeletal mechanisms with a uniform structure is extrapolated from the skeletal mechanism of the reference fuel through the reaction rate rules. In the present method, only the detailed mechanism of the reference fuel is required to construct a set of skeletal mechanisms for the fuels with a similar molecular structure but different size as that of the reference fuel. The performance of the present method is evaluated by building a set of skeletal mechanisms for normal alkanes of C5–C20 in this work. Based on extensive validations under wide operating conditions, satisfactory predictions are achieved by the skeletal mechanisms for n-alkanes, which illustrates the potential of the present method for the applications of other fuels. Jia, Ming oth Wang, Pengzhi oth Niu, Bo oth Liu, Jiayue oth Enthalten in Elsevier Science Lloyd, C.E.M. ELSEVIER Methods for detecting change in hydrochemical time series in response to targeted pollutant mitigation in river catchments 2014 the journal of the Combustion Institute Amsterdam [u.a.] (DE-627)ELV018057144 volume:236 year:2022 pages:0 https://doi.org/10.1016/j.combustflame.2021.111785 Volltext GBV_USEFLAG_U GBV_ELV SYSFLAG_U SSG-OLC-PHA SSG-OPC-GGO GBV_ILN_70 74.00 Geographie Anthropogeographie: Allgemeines VZ 44.73 Geomedizin VZ AR 236 2022 0 |
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Methods for detecting change in hydrochemical time series in response to targeted pollutant mitigation in river catchments |
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Due to the limitations of computational methods and measurement techniques, the construction of detailed mechanisms for high-carbon fuels is still challenging, which hinders the development of the reduced mechanism for practical transportation fuels. To solve this problem, a systematic method is proposed in this work. The method includes two aspects. One is the construction of a skeletal mechanism for the reference fuel by integrating decoupling methodology, reaction class-based global sensitivity analysis method, and genetic algorithm. The other one is that a set of skeletal mechanisms with a uniform structure is extrapolated from the skeletal mechanism of the reference fuel through the reaction rate rules. In the present method, only the detailed mechanism of the reference fuel is required to construct a set of skeletal mechanisms for the fuels with a similar molecular structure but different size as that of the reference fuel. The performance of the present method is evaluated by building a set of skeletal mechanisms for normal alkanes of C5–C20 in this work. 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Construction and derivation of a series of skeletal chemical mechanisms for n-alkanes with uniform and decoupling structure based on reaction rate rules |
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Methods for detecting change in hydrochemical time series in response to targeted pollutant mitigation in river catchments |
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construction and derivation of a series of skeletal chemical mechanisms for n-alkanes with uniform and decoupling structure based on reaction rate rules |
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Construction and derivation of a series of skeletal chemical mechanisms for n-alkanes with uniform and decoupling structure based on reaction rate rules |
abstract |
A reliable reduced chemical model is crucial for the design and optimization of advanced combustion systems. At present, reduced mechanisms are usually obtained by directly reducing detailed mechanisms. Due to the limitations of computational methods and measurement techniques, the construction of detailed mechanisms for high-carbon fuels is still challenging, which hinders the development of the reduced mechanism for practical transportation fuels. To solve this problem, a systematic method is proposed in this work. The method includes two aspects. One is the construction of a skeletal mechanism for the reference fuel by integrating decoupling methodology, reaction class-based global sensitivity analysis method, and genetic algorithm. The other one is that a set of skeletal mechanisms with a uniform structure is extrapolated from the skeletal mechanism of the reference fuel through the reaction rate rules. In the present method, only the detailed mechanism of the reference fuel is required to construct a set of skeletal mechanisms for the fuels with a similar molecular structure but different size as that of the reference fuel. The performance of the present method is evaluated by building a set of skeletal mechanisms for normal alkanes of C5–C20 in this work. Based on extensive validations under wide operating conditions, satisfactory predictions are achieved by the skeletal mechanisms for n-alkanes, which illustrates the potential of the present method for the applications of other fuels. |
abstractGer |
A reliable reduced chemical model is crucial for the design and optimization of advanced combustion systems. At present, reduced mechanisms are usually obtained by directly reducing detailed mechanisms. Due to the limitations of computational methods and measurement techniques, the construction of detailed mechanisms for high-carbon fuels is still challenging, which hinders the development of the reduced mechanism for practical transportation fuels. To solve this problem, a systematic method is proposed in this work. The method includes two aspects. One is the construction of a skeletal mechanism for the reference fuel by integrating decoupling methodology, reaction class-based global sensitivity analysis method, and genetic algorithm. The other one is that a set of skeletal mechanisms with a uniform structure is extrapolated from the skeletal mechanism of the reference fuel through the reaction rate rules. In the present method, only the detailed mechanism of the reference fuel is required to construct a set of skeletal mechanisms for the fuels with a similar molecular structure but different size as that of the reference fuel. The performance of the present method is evaluated by building a set of skeletal mechanisms for normal alkanes of C5–C20 in this work. Based on extensive validations under wide operating conditions, satisfactory predictions are achieved by the skeletal mechanisms for n-alkanes, which illustrates the potential of the present method for the applications of other fuels. |
abstract_unstemmed |
A reliable reduced chemical model is crucial for the design and optimization of advanced combustion systems. At present, reduced mechanisms are usually obtained by directly reducing detailed mechanisms. Due to the limitations of computational methods and measurement techniques, the construction of detailed mechanisms for high-carbon fuels is still challenging, which hinders the development of the reduced mechanism for practical transportation fuels. To solve this problem, a systematic method is proposed in this work. The method includes two aspects. One is the construction of a skeletal mechanism for the reference fuel by integrating decoupling methodology, reaction class-based global sensitivity analysis method, and genetic algorithm. The other one is that a set of skeletal mechanisms with a uniform structure is extrapolated from the skeletal mechanism of the reference fuel through the reaction rate rules. In the present method, only the detailed mechanism of the reference fuel is required to construct a set of skeletal mechanisms for the fuels with a similar molecular structure but different size as that of the reference fuel. The performance of the present method is evaluated by building a set of skeletal mechanisms for normal alkanes of C5–C20 in this work. Based on extensive validations under wide operating conditions, satisfactory predictions are achieved by the skeletal mechanisms for n-alkanes, which illustrates the potential of the present method for the applications of other fuels. |
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title_short |
Construction and derivation of a series of skeletal chemical mechanisms for n-alkanes with uniform and decoupling structure based on reaction rate rules |
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https://doi.org/10.1016/j.combustflame.2021.111785 |
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