<?xml version="1.0" encoding="utf-8"?>
<TEI xmlns="http://www.tei-c.org/ns/1.0" xmlns:xsi="http://www.w3.org/2001/XMLSchema-instance" xmlns:hal="http://hal.archives-ouvertes.fr/" xmlns:gml="http://www.opengis.net/gml/3.3/" xmlns:gmlce="http://www.opengis.net/gml/3.3/ce" version="1.1" xsi:schemaLocation="http://www.tei-c.org/ns/1.0 http://api.archives-ouvertes.fr/documents/aofr-sword.xsd">
  <teiHeader>
    <fileDesc>
      <titleStmt>
        <title>HAL TEI export of hal-00602156</title>
      </titleStmt>
      <publicationStmt>
        <distributor>CCSD</distributor>
        <availability status="restricted">
          <licence target="https://creativecommons.org/publicdomain/zero/1.0/">CC0 1.0 - Universal</licence>
        </availability>
        <date when="2026-05-01T22:51:52+02:00"/>
      </publicationStmt>
      <sourceDesc>
        <p part="N">HAL API Platform</p>
      </sourceDesc>
    </fileDesc>
  </teiHeader>
  <text>
    <body>
      <listBibl>
        <biblFull>
          <titleStmt>
            <title xml:lang="en">Detailed product analysis during the low temperature oxidation of n-butane</title>
            <author role="aut">
              <persName>
                <forename type="first">Olivier</forename>
                <surname>Herbinet</surname>
              </persName>
              <email type="md5">8533d67382130c442b38791fc0df554e</email>
              <email type="domain">univ-lorraine.fr</email>
              <idno type="idhal" notation="string">olivier-herbinet</idno>
              <idno type="idhal" notation="numeric">1973</idno>
              <idno type="halauthorid" notation="string">15711-1973</idno>
              <idno type="ORCID">https://orcid.org/0000-0002-2155-098X</idno>
              <idno type="IDREF">https://www.idref.fr/111202396</idno>
              <affiliation ref="#struct-211875"/>
            </author>
            <author role="crp">
              <persName>
                <forename type="first">Frédérique</forename>
                <surname>Battin-Leclerc</surname>
              </persName>
              <email type="md5">04e5832720b16e0effdaf1ce3024bb2e</email>
              <email type="domain">univ-lorraine.fr</email>
              <idno type="idhal" notation="string">frederique-battin-leclerc</idno>
              <idno type="idhal" notation="numeric">16635</idno>
              <idno type="halauthorid" notation="string">128300-16635</idno>
              <idno type="ORCID">https://orcid.org/0000-0001-8265-7492</idno>
              <idno type="IDREF">https://www.idref.fr/060800321</idno>
              <affiliation ref="#struct-211875"/>
            </author>
            <author role="aut">
              <persName>
                <forename type="first">Sarah</forename>
                <surname>Bax</surname>
              </persName>
              <idno type="halauthorid">654600-0</idno>
              <affiliation ref="#struct-211875"/>
            </author>
            <author role="aut">
              <persName>
                <forename type="first">Hervé</forename>
                <surname>Le Gall</surname>
              </persName>
              <idno type="halauthorid">200349-0</idno>
              <affiliation ref="#struct-211875"/>
            </author>
            <author role="aut">
              <persName>
                <forename type="first">Pierre Alexandre</forename>
                <surname>Glaude</surname>
              </persName>
              <email type="md5">787d836857fc3d21bbf38dba0a2e09e0</email>
              <email type="domain">univ-lorraine.fr</email>
              <idno type="idhal" notation="string">pierre-alexandre-glaude</idno>
              <idno type="idhal" notation="numeric">17695</idno>
              <idno type="halauthorid" notation="string">655597-17695</idno>
              <idno type="ORCID">https://orcid.org/0000-0001-9166-8388</idno>
              <idno type="IDREF">https://www.idref.fr/131935119</idno>
              <affiliation ref="#struct-211875"/>
            </author>
            <author role="aut">
              <persName>
                <forename type="first">René</forename>
                <surname>Fournet</surname>
              </persName>
              <email type="md5">06de4fa04c46e0c9d833d95c58f98fa8</email>
              <email type="domain">univ-lorraine.fr</email>
              <idno type="idhal" notation="string">rene-fournet</idno>
              <idno type="idhal" notation="numeric">10850</idno>
              <idno type="halauthorid" notation="string">15760-10850</idno>
              <idno type="IDREF">https://www.idref.fr/131935003</idno>
              <idno type="ORCID">https://orcid.org/0000-0001-7226-7060</idno>
              <affiliation ref="#struct-211875"/>
            </author>
            <author role="aut">
              <persName>
                <forename type="first">Zhongyue</forename>
                <surname>Zhou</surname>
              </persName>
              <idno type="halauthorid">721504-0</idno>
              <affiliation ref="#struct-139461"/>
            </author>
            <author role="aut">
              <persName>
                <forename type="first">Liulin</forename>
                <surname>Deng</surname>
              </persName>
              <idno type="halauthorid">721505-0</idno>
              <affiliation ref="#struct-139461"/>
            </author>
            <author role="aut">
              <persName>
                <forename type="first">Huijun</forename>
                <surname>Guo</surname>
              </persName>
              <idno type="halauthorid">721506-0</idno>
              <affiliation ref="#struct-139461"/>
            </author>
            <author role="aut">
              <persName>
                <forename type="first">Mingfeng</forename>
                <surname>Xie</surname>
              </persName>
              <idno type="halauthorid">682744-0</idno>
              <affiliation ref="#struct-139461"/>
            </author>
            <author role="aut">
              <persName>
                <forename type="first">Fei</forename>
                <surname>Qi</surname>
              </persName>
              <idno type="halauthorid">682746-0</idno>
              <affiliation ref="#struct-139461"/>
            </author>
            <editor role="depositor">
              <persName>
                <forename>Olivier</forename>
                <surname>Herbinet</surname>
              </persName>
              <email type="md5">8533d67382130c442b38791fc0df554e</email>
              <email type="domain">univ-lorraine.fr</email>
            </editor>
            <funder ref="#projeurop-13713"/>
          </titleStmt>
          <editionStmt>
            <edition n="v1" type="current">
              <date type="whenSubmitted">2013-07-09 17:27:04</date>
              <date type="whenModified">2023-09-12 10:22:03</date>
              <date type="whenReleased">2013-07-10 08:39:12</date>
              <date type="whenProduced">2011</date>
              <date type="whenEndEmbargoed">2013-07-09</date>
              <ref type="file" target="https://hal.science/hal-00602156v1/document">
                <date notBefore="2013-07-09"/>
              </ref>
              <ref type="file" subtype="author" n="1" target="https://hal.science/hal-00602156v1/file/2011_butane_PCCP.pdf" id="file-602156-36926">
                <date notBefore="2013-07-09"/>
              </ref>
              <ref type="annex" subtype="other" n="0" target="https://hal.science/hal-00602156v1/file/Supplemental_Material.pdf" id="file-602156-36925">
                <date notBefore="2013-07-09"/>
              </ref>
              <ref type="externalLink" target="http://europepmc.org/articles/pmc3616266?pdf=render"/>
            </edition>
            <respStmt>
              <resp>contributor</resp>
              <name key="175071">
                <persName>
                  <forename>Olivier</forename>
                  <surname>Herbinet</surname>
                </persName>
                <email type="md5">8533d67382130c442b38791fc0df554e</email>
                <email type="domain">univ-lorraine.fr</email>
              </name>
            </respStmt>
          </editionStmt>
          <publicationStmt>
            <distributor>CCSD</distributor>
            <idno type="halId">hal-00602156</idno>
            <idno type="halUri">https://hal.science/hal-00602156</idno>
            <idno type="halBibtex">herbinet:hal-00602156</idno>
            <idno type="halRefHtml">&lt;i&gt;Physical Chemistry Chemical Physics&lt;/i&gt;, 2011, 13, pp. 296-308. &lt;a target="_blank" href="https://dx.doi.org/10.1039/C0CP00539H"&gt;&amp;#x27E8;10.1039/C0CP00539H&amp;#x27E9;&lt;/a&gt;</idno>
            <idno type="halRef">Physical Chemistry Chemical Physics, 2011, 13, pp. 296-308. &amp;#x27E8;10.1039/C0CP00539H&amp;#x27E9;</idno>
            <availability status="restricted">
              <licence target="https://about.hal.science/hal-authorisation-v1/">HAL Authorization<ref corresp="#file-602156-36926"/><ref corresp="#file-602156-36925"/></licence>
            </availability>
          </publicationStmt>
          <seriesStmt>
            <idno type="stamp" n="CNRS">CNRS - Centre national de la recherche scientifique</idno>
            <idno type="stamp" n="OPENAIRE">OpenAIRE</idno>
            <idno type="stamp" n="UNIV-LORRAINE">Université de Lorraine</idno>
            <idno type="stamp" n="LRGP-UL">LRGP</idno>
            <idno type="stamp" n="LRGP-CITHERE">LRGP- CInétique – THERmodynamique – Énergie (CITHERE)</idno>
            <idno type="stamp" n="EMPP-UL">Pôle scientifique Energie, Mécanique, Procédés, Produits de l'Université de Lorraine</idno>
          </seriesStmt>
          <notesStmt>
            <note type="audience" n="2">International</note>
            <note type="popular" n="0">No</note>
            <note type="peer" n="1">Yes</note>
          </notesStmt>
          <sourceDesc>
            <biblStruct>
              <analytic>
                <title xml:lang="en">Detailed product analysis during the low temperature oxidation of n-butane</title>
                <author role="aut">
                  <persName>
                    <forename type="first">Olivier</forename>
                    <surname>Herbinet</surname>
                  </persName>
                  <email type="md5">8533d67382130c442b38791fc0df554e</email>
                  <email type="domain">univ-lorraine.fr</email>
                  <idno type="idhal" notation="string">olivier-herbinet</idno>
                  <idno type="idhal" notation="numeric">1973</idno>
                  <idno type="halauthorid" notation="string">15711-1973</idno>
                  <idno type="ORCID">https://orcid.org/0000-0002-2155-098X</idno>
                  <idno type="IDREF">https://www.idref.fr/111202396</idno>
                  <affiliation ref="#struct-211875"/>
                </author>
                <author role="crp">
                  <persName>
                    <forename type="first">Frédérique</forename>
                    <surname>Battin-Leclerc</surname>
                  </persName>
                  <email type="md5">04e5832720b16e0effdaf1ce3024bb2e</email>
                  <email type="domain">univ-lorraine.fr</email>
                  <idno type="idhal" notation="string">frederique-battin-leclerc</idno>
                  <idno type="idhal" notation="numeric">16635</idno>
                  <idno type="halauthorid" notation="string">128300-16635</idno>
                  <idno type="ORCID">https://orcid.org/0000-0001-8265-7492</idno>
                  <idno type="IDREF">https://www.idref.fr/060800321</idno>
                  <affiliation ref="#struct-211875"/>
                </author>
                <author role="aut">
                  <persName>
                    <forename type="first">Sarah</forename>
                    <surname>Bax</surname>
                  </persName>
                  <idno type="halauthorid">654600-0</idno>
                  <affiliation ref="#struct-211875"/>
                </author>
                <author role="aut">
                  <persName>
                    <forename type="first">Hervé</forename>
                    <surname>Le Gall</surname>
                  </persName>
                  <idno type="halauthorid">200349-0</idno>
                  <affiliation ref="#struct-211875"/>
                </author>
                <author role="aut">
                  <persName>
                    <forename type="first">Pierre Alexandre</forename>
                    <surname>Glaude</surname>
                  </persName>
                  <email type="md5">787d836857fc3d21bbf38dba0a2e09e0</email>
                  <email type="domain">univ-lorraine.fr</email>
                  <idno type="idhal" notation="string">pierre-alexandre-glaude</idno>
                  <idno type="idhal" notation="numeric">17695</idno>
                  <idno type="halauthorid" notation="string">655597-17695</idno>
                  <idno type="ORCID">https://orcid.org/0000-0001-9166-8388</idno>
                  <idno type="IDREF">https://www.idref.fr/131935119</idno>
                  <affiliation ref="#struct-211875"/>
                </author>
                <author role="aut">
                  <persName>
                    <forename type="first">René</forename>
                    <surname>Fournet</surname>
                  </persName>
                  <email type="md5">06de4fa04c46e0c9d833d95c58f98fa8</email>
                  <email type="domain">univ-lorraine.fr</email>
                  <idno type="idhal" notation="string">rene-fournet</idno>
                  <idno type="idhal" notation="numeric">10850</idno>
                  <idno type="halauthorid" notation="string">15760-10850</idno>
                  <idno type="IDREF">https://www.idref.fr/131935003</idno>
                  <idno type="ORCID">https://orcid.org/0000-0001-7226-7060</idno>
                  <affiliation ref="#struct-211875"/>
                </author>
                <author role="aut">
                  <persName>
                    <forename type="first">Zhongyue</forename>
                    <surname>Zhou</surname>
                  </persName>
                  <idno type="halauthorid">721504-0</idno>
                  <affiliation ref="#struct-139461"/>
                </author>
                <author role="aut">
                  <persName>
                    <forename type="first">Liulin</forename>
                    <surname>Deng</surname>
                  </persName>
                  <idno type="halauthorid">721505-0</idno>
                  <affiliation ref="#struct-139461"/>
                </author>
                <author role="aut">
                  <persName>
                    <forename type="first">Huijun</forename>
                    <surname>Guo</surname>
                  </persName>
                  <idno type="halauthorid">721506-0</idno>
                  <affiliation ref="#struct-139461"/>
                </author>
                <author role="aut">
                  <persName>
                    <forename type="first">Mingfeng</forename>
                    <surname>Xie</surname>
                  </persName>
                  <idno type="halauthorid">682744-0</idno>
                  <affiliation ref="#struct-139461"/>
                </author>
                <author role="aut">
                  <persName>
                    <forename type="first">Fei</forename>
                    <surname>Qi</surname>
                  </persName>
                  <idno type="halauthorid">682746-0</idno>
                  <affiliation ref="#struct-139461"/>
                </author>
              </analytic>
              <monogr>
                <idno type="localRef">Equipe Cinétique et Combustion (KinCom)</idno>
                <idno type="halJournalId" status="VALID">17971</idno>
                <idno type="issn">1463-9076</idno>
                <idno type="eissn">1463-9084</idno>
                <title level="j">Physical Chemistry Chemical Physics</title>
                <imprint>
                  <publisher>Royal Society of Chemistry</publisher>
                  <biblScope unit="volume">13</biblScope>
                  <biblScope unit="pp">pp. 296-308</biblScope>
                  <date type="datePub">2011</date>
                </imprint>
              </monogr>
              <idno type="doi">10.1039/C0CP00539H</idno>
            </biblStruct>
          </sourceDesc>
          <profileDesc>
            <langUsage>
              <language ident="en">English</language>
            </langUsage>
            <textClass>
              <classCode scheme="halDomain" n="phys.phys.phys-chem-ph">Physics [physics]/Physics [physics]/Chemical Physics [physics.chem-ph]</classCode>
              <classCode scheme="halTypology" n="ART">Journal articles</classCode>
              <classCode scheme="halOldTypology" n="ART">Journal articles</classCode>
              <classCode scheme="halTreeTypology" n="ART">Journal articles</classCode>
            </textClass>
            <abstract xml:lang="en">
              <p>The products obtained from the low-temperature oxidation of n-butane in a jet-stirred reactor (JSR) have been analysed using two methods: gas chromatography analysis of the outlet gas and reflectron time-of-flight mass spectrometry. The mass spectrometer was combined with tunable synchrotron vacuum ultraviolet photoionization and coupled with a JSR via a molecular-beam sampling system. Experiments were performed under quasi-atmospheric pressure, for temperatures between 550 and 800 K, at a mean residence time of 6 s and with a stoichiometric n-butane/oxygen/argon mixture (composition = 4/26/70 in mol%). 36 reaction products have been quantified, including in addition to the usual oxidation products, acetic acid, hydrogen peroxide, C1, C2 and C4 alkylhydroperoxides and C4 ketohydroperoxides. Evidence of the possible formation of products (dihydrofuranes, furanones) derived from cyclic ethers has also been found. The performance of a detailed kinetic model of the literature has been assessed with the simulation of the formation of this extended range of species. These simulations have also allowed the analysis of possible pathways for the formation of some obtained products.</p>
            </abstract>
          </profileDesc>
        </biblFull>
      </listBibl>
    </body>
    <back>
      <listOrg type="structures">
        <org type="laboratory" xml:id="struct-211875" status="VALID">
          <idno type="IdRef">153068876</idno>
          <idno type="ISNI">0000000095630857</idno>
          <idno type="RNSR">201320573K</idno>
          <idno type="IdUnivLorraine">[UL]RQC--</idno>
          <idno type="ROR">https://ror.org/00p6sn362</idno>
          <orgName>Laboratoire Réactions et Génie des Procédés</orgName>
          <orgName type="acronym">LRGP</orgName>
          <date type="start">2010-01-01</date>
          <desc>
            <address>
              <addrLine>Université de Lorraine - ENSIC, 1 rue de Grandville BP 20451, 54001 Nancy Cedex</addrLine>
              <country key="FR"/>
            </address>
            <ref type="url">http://lrgp.univ-lorraine.fr/</ref>
          </desc>
          <listRelation>
            <relation active="#struct-413289" type="direct"/>
            <relation name="UMR7274 / UPR3349" active="#struct-441569" type="direct"/>
          </listRelation>
        </org>
        <org type="laboratory" xml:id="struct-139461" status="INCOMING">
          <orgName>National Synchrotron Radiation Laboratory</orgName>
          <desc>
            <address>
              <addrLine>Hefei, Anhui 230029, PR China</addrLine>
              <country key="CN"/>
            </address>
          </desc>
          <listRelation>
            <relation active="#struct-303062" type="direct"/>
          </listRelation>
        </org>
        <org type="institution" xml:id="struct-413289" status="VALID">
          <idno type="IdRef">157040569</idno>
          <idno type="IdUnivLorraine">[UL]100--</idno>
          <idno type="ROR">https://ror.org/04vfs2w97</idno>
          <orgName>Université de Lorraine</orgName>
          <orgName type="acronym">UL</orgName>
          <date type="start">2012-01-01</date>
          <desc>
            <address>
              <addrLine>34 cours Léopold - CS 25233 - 54052 Nancy cedex</addrLine>
              <country key="FR"/>
            </address>
            <ref type="url">http://www.univ-lorraine.fr/</ref>
          </desc>
        </org>
        <org type="regroupinstitution" xml:id="struct-441569" status="VALID">
          <idno type="IdRef">02636817X</idno>
          <idno type="ISNI">0000000122597504</idno>
          <idno type="ROR">https://ror.org/02feahw73</idno>
          <orgName>Centre National de la Recherche Scientifique</orgName>
          <orgName type="acronym">CNRS</orgName>
          <date type="start">1939-10-19</date>
          <desc>
            <address>
              <country key="FR"/>
            </address>
            <ref type="url">https://www.cnrs.fr/</ref>
          </desc>
        </org>
        <org type="institution" xml:id="struct-303062" status="VALID">
          <idno type="ROR">https://ror.org/04c4dkn09</idno>
          <orgName>University of Science and Technology of China [Hefei]</orgName>
          <orgName type="acronym">USTC</orgName>
          <date type="start">1958</date>
          <desc>
            <address>
              <addrLine>Hefei, Anhui</addrLine>
              <country key="CN"/>
            </address>
            <ref type="url">http://en.ustc.edu.cn/</ref>
          </desc>
        </org>
      </listOrg>
      <listOrg type="projects">
        <org type="europeanProject" xml:id="projeurop-13713" status="VALID">
          <idno type="number">227669</idno>
          <idno type="program">ERC-2008-AdG</idno>
          <idno type="call">ERC-2008-AdG</idno>
          <orgName>CLEAN-ICE</orgName>
          <desc>Detailed chemical kinetic models for cleaner internal combustion engines</desc>
          <date type="start">2008-01-12</date>
          <date type="end">2013-11-30</date>
        </org>
      </listOrg>
    </back>
  </text>
</TEI>