This compilation updates and expands a previous evaluation of kinetic data on elementary, homogeneous, gas phase reactions of neutral species involved in combustion systems [J. Phys. Chem. Ref. Data 21, 411 (1992)]. The work has been carried out under the auspices of the European Community Energy Research and Development Program. Data sheets are presented for some 78 reactions and two tables in which preferred rate parameters are presented for reactions of ethyl, i‐propyl, t‐butyl, and allyl radicals are given. Each data sheet sets our relevant thermodynamic data, experimental kinetic data, references, and recommended rate parameters with their error limits. A table summarizing the recommended rate data is also given. The new reactions fall into two categories: first, to expand the previous compilation relating largely to the combustion in air of methane, ethane and aromatic compounds; and second, provide data for some of the key radicals involved in the combustion of higher alkanes.
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November 1994
Research Article|
November 01 1994
Evaluated Kinetic Data for Combustion Modeling. Supplement I
D. L. Baulch;
D. L. Baulch
School of Chemistry, University of Leeds, Leeds LS2 9JT United Kingdom
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C. J. Cobos;
C. J. Cobos
Institut für Physikalische Chemie, Universität Göttingen, D‐3400 Göttingen, Germany
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R. A. Cox;
R. A. Cox
NERC, Polaris House, Swindon, SN2 1EU, United Kingdom
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P. Frank;
P. Frank
DLR, Institut für Physikalische Chemie der Verbrennung, D‐7000 Stuttgart 80, Germany
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G. Hayman;
G. Hayman
AEA Technology Consultancy Services, Harwell, Didcot OX11 0RA, United Kingdom
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Th. Just;
Th. Just
DLR, Institut für Physikalische Chemie der Verbrennung, D‐7000 Stuttgart 80, Germany
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J. A. Kerr;
J. A. Kerr
EAWAG, CH‐8600 Dübendorf, Switzerland
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T. Murrells;
T. Murrells
AEA Technology Consultancy Services, Harwell, Didcot OX11 0RA, United Kingdom
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M. J. Pilling;
M. J. Pilling
School of Chemistry, University of Leeds, Leeds LS2 9JT, United Kingdom
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J. Troe;
J. Troe
Institut für Physikalische Chemie, Universität Göttingen, D‐3400 Göttingen, Germany
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R. W. Walker;
R. W. Walker
School of Chemistry, University of Hull, Hull HU6 7RX, United Kingdom
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J. Warnatz
J. Warnatz
Institut für Technische Verbrennung, Universität Stuttgart, D‐7000 Stuttgart 80, Germany
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J. Phys. Chem. Ref. Data 23, 847–848 (1994)
Article history
Received:
January 31 1994
Connected Content
A correction has been published:
Erratum: Evaluated Kinetic Data for Combustion Modeling. Supplement I [J. Phys. Chem. Ref. Data 23, 847 (1994)]
Citation
D. L. Baulch, C. J. Cobos, R. A. Cox, P. Frank, G. Hayman, Th. Just, J. A. Kerr, T. Murrells, M. J. Pilling, J. Troe, R. W. Walker, J. Warnatz; Evaluated Kinetic Data for Combustion Modeling. Supplement I. J. Phys. Chem. Ref. Data 1 November 1994; 23 (6): 847–848. https://doi.org/10.1063/1.555953
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