A comprehensive modeling study of hydrogen oxidation
A detailed kinetic mechanism has been developed to simulate the combustion of H2/O2 mixtures, over a wide range of temperatures, pressures, and equivalence ratios. Over the series of experiments numerically investigated, the temperature ranged from 298 to 2700 K, the pressure from 0.05 to 87 atm, an...
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| Veröffentlicht in: | International journal of chemical kinetics 2004-11, Vol.36 (11), p.603-622 |
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| container_end_page | 622 |
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| container_issue | 11 |
| container_start_page | 603 |
| container_title | International journal of chemical kinetics |
| container_volume | 36 |
| creator | Ó Conaire, Marcus Curran, Henry J. Simmie, John M. Pitz, William J. Westbrook, Charles K. |
| description | A detailed kinetic mechanism has been developed to simulate the combustion of H2/O2 mixtures, over a wide range of temperatures, pressures, and equivalence ratios. Over the series of experiments numerically investigated, the temperature ranged from 298 to 2700 K, the pressure from 0.05 to 87 atm, and the equivalence ratios from 0.2 to 6.
Ignition delay times, flame speeds, and species composition data provide for a stringent test of the chemical kinetic mechanism, all of which are simulated in the current study with varying success. A sensitivity analysis was carried out to determine which reactions were dominating the H2/O2 system at particular conditions of pressure, temperature, and fuel/oxygen/diluent ratios. Overall, good agreement was observed between the model and the wide range of experiments simulated. © 2004 Wiley Periodicals, Inc. Int J Chem Kinet 36: 603–622, 2004 |
| doi_str_mv | 10.1002/kin.20036 |
| format | Article |
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Ignition delay times, flame speeds, and species composition data provide for a stringent test of the chemical kinetic mechanism, all of which are simulated in the current study with varying success. A sensitivity analysis was carried out to determine which reactions were dominating the H2/O2 system at particular conditions of pressure, temperature, and fuel/oxygen/diluent ratios. Overall, good agreement was observed between the model and the wide range of experiments simulated. © 2004 Wiley Periodicals, Inc. Int J Chem Kinet 36: 603–622, 2004</description><identifier>ISSN: 0538-8066</identifier><identifier>EISSN: 1097-4601</identifier><identifier>DOI: 10.1002/kin.20036</identifier><language>eng</language><publisher>New York: John Wiley & Sons, Inc</publisher><ispartof>International journal of chemical kinetics, 2004-11, Vol.36 (11), p.603-622</ispartof><rights>Copyright © 2004 Wiley Periodicals, Inc.</rights><lds50>peer_reviewed</lds50><woscitedreferencessubscribed>false</woscitedreferencessubscribed><citedby>FETCH-LOGICAL-c3716-6ad1cf016acae50010e6671fb3059bcceb1c0f0b52565db33e66d524e712df7c3</citedby><cites>FETCH-LOGICAL-c3716-6ad1cf016acae50010e6671fb3059bcceb1c0f0b52565db33e66d524e712df7c3</cites></display><links><openurl>$$Topenurl_article</openurl><openurlfulltext>$$Topenurlfull_article</openurlfulltext><thumbnail>$$Tsyndetics_thumb_exl</thumbnail><linktopdf>$$Uhttps://onlinelibrary.wiley.com/doi/pdf/10.1002%2Fkin.20036$$EPDF$$P50$$Gwiley$$H</linktopdf><linktohtml>$$Uhttps://onlinelibrary.wiley.com/doi/full/10.1002%2Fkin.20036$$EHTML$$P50$$Gwiley$$H</linktohtml><link.rule.ids>314,780,784,1417,27924,27925,45574,45575</link.rule.ids></links><search><creatorcontrib>Ó Conaire, Marcus</creatorcontrib><creatorcontrib>Curran, Henry J.</creatorcontrib><creatorcontrib>Simmie, John M.</creatorcontrib><creatorcontrib>Pitz, William J.</creatorcontrib><creatorcontrib>Westbrook, Charles K.</creatorcontrib><title>A comprehensive modeling study of hydrogen oxidation</title><title>International journal of chemical kinetics</title><addtitle>Int. J. Chem. Kinet</addtitle><description>A detailed kinetic mechanism has been developed to simulate the combustion of H2/O2 mixtures, over a wide range of temperatures, pressures, and equivalence ratios. Over the series of experiments numerically investigated, the temperature ranged from 298 to 2700 K, the pressure from 0.05 to 87 atm, and the equivalence ratios from 0.2 to 6.
Ignition delay times, flame speeds, and species composition data provide for a stringent test of the chemical kinetic mechanism, all of which are simulated in the current study with varying success. A sensitivity analysis was carried out to determine which reactions were dominating the H2/O2 system at particular conditions of pressure, temperature, and fuel/oxygen/diluent ratios. Overall, good agreement was observed between the model and the wide range of experiments simulated. © 2004 Wiley Periodicals, Inc. Int J Chem Kinet 36: 603–622, 2004</description><issn>0538-8066</issn><issn>1097-4601</issn><fulltext>true</fulltext><rsrctype>article</rsrctype><creationdate>2004</creationdate><recordtype>article</recordtype><recordid>eNp1j81OAjEURhujiYgufIPZuhi4dzptmSUhikTEhRqXTac_UIEpaVGZtxdF3bm6i3vOlxxCLhF6CFD0l77pFQCUH5EOQiXykgMekw4wOsgHwPkpOUvpFQCqClmHlMNMh_Um2oVtkn-32ToYu_LNPEvbN9NmwWWL1sQwt00Wdt6orQ_NOTlxapXsxc_tkueb66fRbT59GE9Gw2muqUCec2VQO0CutLIMAMFyLtDVFFhVa21r1OCgZgXjzNSU7t-GFaUVWBgnNO2Sq8OujiGlaJ3cRL9WsZUI8itX7nPld-6e7R_YD7-y7f-gvJvMfo38YPi0tbs_Q8Wl5IIKJl9mYwnl4JFhOZX39BMu2WWr</recordid><startdate>200411</startdate><enddate>200411</enddate><creator>Ó Conaire, Marcus</creator><creator>Curran, Henry J.</creator><creator>Simmie, John M.</creator><creator>Pitz, William J.</creator><creator>Westbrook, Charles K.</creator><general>John Wiley & Sons, Inc</general><scope>BSCLL</scope><scope>AAYXX</scope><scope>CITATION</scope></search><sort><creationdate>200411</creationdate><title>A comprehensive modeling study of hydrogen oxidation</title><author>Ó Conaire, Marcus ; Curran, Henry J. ; Simmie, John M. ; Pitz, William J. ; Westbrook, Charles K.</author></sort><facets><frbrtype>5</frbrtype><frbrgroupid>cdi_FETCH-LOGICAL-c3716-6ad1cf016acae50010e6671fb3059bcceb1c0f0b52565db33e66d524e712df7c3</frbrgroupid><rsrctype>articles</rsrctype><prefilter>articles</prefilter><language>eng</language><creationdate>2004</creationdate><toplevel>peer_reviewed</toplevel><toplevel>online_resources</toplevel><creatorcontrib>Ó Conaire, Marcus</creatorcontrib><creatorcontrib>Curran, Henry J.</creatorcontrib><creatorcontrib>Simmie, John M.</creatorcontrib><creatorcontrib>Pitz, William J.</creatorcontrib><creatorcontrib>Westbrook, Charles K.</creatorcontrib><collection>Istex</collection><collection>CrossRef</collection><jtitle>International journal of chemical kinetics</jtitle></facets><delivery><delcategory>Remote Search Resource</delcategory><fulltext>fulltext</fulltext></delivery><addata><au>Ó Conaire, Marcus</au><au>Curran, Henry J.</au><au>Simmie, John M.</au><au>Pitz, William J.</au><au>Westbrook, Charles K.</au><format>journal</format><genre>article</genre><ristype>JOUR</ristype><atitle>A comprehensive modeling study of hydrogen oxidation</atitle><jtitle>International journal of chemical kinetics</jtitle><addtitle>Int. J. Chem. Kinet</addtitle><date>2004-11</date><risdate>2004</risdate><volume>36</volume><issue>11</issue><spage>603</spage><epage>622</epage><pages>603-622</pages><issn>0538-8066</issn><eissn>1097-4601</eissn><abstract>A detailed kinetic mechanism has been developed to simulate the combustion of H2/O2 mixtures, over a wide range of temperatures, pressures, and equivalence ratios. Over the series of experiments numerically investigated, the temperature ranged from 298 to 2700 K, the pressure from 0.05 to 87 atm, and the equivalence ratios from 0.2 to 6.
Ignition delay times, flame speeds, and species composition data provide for a stringent test of the chemical kinetic mechanism, all of which are simulated in the current study with varying success. A sensitivity analysis was carried out to determine which reactions were dominating the H2/O2 system at particular conditions of pressure, temperature, and fuel/oxygen/diluent ratios. Overall, good agreement was observed between the model and the wide range of experiments simulated. © 2004 Wiley Periodicals, Inc. Int J Chem Kinet 36: 603–622, 2004</abstract><cop>New York</cop><pub>John Wiley & Sons, Inc</pub><doi>10.1002/kin.20036</doi><tpages>20</tpages></addata></record> |
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| title | A comprehensive modeling study of hydrogen oxidation |
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