<?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-05368451</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="2026-05-24T03:48:00+02:00"/>
      </publicationStmt>
      <sourceDesc>
        <p part="N">HAL API Platform</p>
      </sourceDesc>
    </fileDesc>
  </teiHeader>
  <text>
    <body>
      <listBibl>
        <biblFull>
          <titleStmt>
            <title xml:lang="en">Predicting energy-dependent transformation products of environmental contaminants: the case of ibuprofen</title>
            <author role="aut">
              <persName>
                <forename type="first">Grégoire</forename>
                <surname>Salomon</surname>
              </persName>
              <idno type="halauthorid">2899158-0</idno>
              <affiliation ref="#struct-40214"/>
            </author>
            <author role="aut">
              <persName>
                <forename type="first">Mathias</forename>
                <surname>Rapacioli</surname>
              </persName>
              <email type="md5">b7181be59929c37d30741943d0a41a2a</email>
              <email type="domain">irsamc.ups-tlse.fr</email>
              <idno type="idhal" notation="string">mathias-rapacioli</idno>
              <idno type="idhal" notation="numeric">171955</idno>
              <idno type="halauthorid" notation="string">18563-171955</idno>
              <idno type="ORCID">https://orcid.org/0000-0003-2394-6694</idno>
              <idno type="IDREF">https://www.idref.fr/103543368</idno>
              <affiliation ref="#struct-1612855"/>
              <affiliation ref="#struct-1612854"/>
            </author>
            <author role="aut">
              <persName>
                <forename type="first">J</forename>
                <forename type="middle">Christian</forename>
                <surname>Schön</surname>
              </persName>
              <idno type="idhal" notation="numeric">1609229</idno>
              <idno type="halauthorid" notation="string">3892829-1609229</idno>
              <idno type="ORCID">https://orcid.org/0000-0002-3143-3664</idno>
              <affiliation ref="#struct-1167425"/>
            </author>
            <author role="aut">
              <persName>
                <forename type="first">Nathalie</forename>
                <surname>Tarrat</surname>
              </persName>
              <email type="md5">bd3320e50e74b4f79424ed411bee6847</email>
              <email type="domain">cemes.fr</email>
              <idno type="idhal" notation="string">nathalie-tarrat</idno>
              <idno type="idhal" notation="numeric">18511</idno>
              <idno type="halauthorid" notation="string">39332-18511</idno>
              <idno type="ORCID">https://orcid.org/0000-0002-0909-0001</idno>
              <idno type="IDREF">https://www.idref.fr/103583890</idno>
              <affiliation ref="#struct-1612755"/>
            </author>
            <editor role="depositor">
              <persName>
                <forename>Nathalie</forename>
                <surname>TARRAT</surname>
              </persName>
              <email type="md5">bd3320e50e74b4f79424ed411bee6847</email>
              <email type="domain">cemes.fr</email>
            </editor>
          </titleStmt>
          <editionStmt>
            <edition n="v1" type="current">
              <date type="whenSubmitted">2025-11-17 11:22:03</date>
              <date type="whenModified">2026-02-10 14:43:06</date>
              <date type="whenReleased">2025-11-17 14:33:53</date>
              <date type="whenProduced">2026-01</date>
              <date type="whenEndEmbargoed">2025-11-17</date>
              <ref type="file" target="https://hal.science/hal-05368451v1/document">
                <date notBefore="2025-11-17"/>
              </ref>
              <ref type="file" subtype="author" n="1" target="https://hal.science/hal-05368451v1/file/Ibup_Physics_REVISED_VERSION.pdf" id="file-5368451-4592534">
                <date notBefore="2025-11-17"/>
              </ref>
            </edition>
            <respStmt>
              <resp>contributor</resp>
              <name key="20996">
                <persName>
                  <forename>Nathalie</forename>
                  <surname>TARRAT</surname>
                </persName>
                <email type="md5">bd3320e50e74b4f79424ed411bee6847</email>
                <email type="domain">cemes.fr</email>
              </name>
            </respStmt>
          </editionStmt>
          <publicationStmt>
            <distributor>CCSD</distributor>
            <idno type="halId">hal-05368451</idno>
            <idno type="halUri">https://hal.science/hal-05368451</idno>
            <idno type="halBibtex">salomon:hal-05368451</idno>
            <idno type="halRefHtml">&lt;i&gt;Physics&lt;/i&gt;, 2026, 8, pp.4. &lt;a target="_blank" href="https://dx.doi.org/10.3390/physics8010004"&gt;&amp;#x27E8;10.3390/physics8010004&amp;#x27E9;&lt;/a&gt;</idno>
            <idno type="halRef">Physics, 2026, 8, pp.4. &amp;#x27E8;10.3390/physics8010004&amp;#x27E9;</idno>
            <availability status="restricted">
              <licence target="https://creativecommons.org/licenses/by/4.0/">CC BY 4.0 - Attribution<ref corresp="#file-5368451-4592534"/></licence>
            </availability>
          </publicationStmt>
          <seriesStmt>
            <idno type="stamp" n="IRD">IRD - Institut de recherche pour le développement</idno>
            <idno type="stamp" n="SDE">Sciences De l'Environnement</idno>
            <idno type="stamp" n="CEA">CEA - Commissariat à l'énergie atomique</idno>
            <idno type="stamp" n="UNIV-TLSE3">Université de Toulouse</idno>
            <idno type="stamp" n="LCPQ">Laboratoire de Chimie et Physique Quantiques</idno>
            <idno type="stamp" n="CNRS">CNRS - Centre national de la recherche scientifique</idno>
            <idno type="stamp" n="INSA-TOULOUSE">Institut National des Sciences Appliquées de Toulouse</idno>
            <idno type="stamp" n="LCPQ_MAD" corresp="LCPQ">Modélisation, Agrégats, Dynamique</idno>
            <idno type="stamp" n="GIP-BE">GIP Bretagne Environnement</idno>
            <idno type="stamp" n="DRT" corresp="CEA">Direction de la recherche technologique</idno>
            <idno type="stamp" n="INC-CNRS">Institut de Chimie du CNRS</idno>
            <idno type="stamp" n="CEMES">Centre d'élaboration de matériaux et d'études structurales</idno>
            <idno type="stamp" n="SINANO" corresp="CEMES">Surfaces, Interfaces et Nano-Objets</idno>
            <idno type="stamp" n="LETI" corresp="CEA">Laboratoire d'Electronique et des Technologies de l'Information</idno>
            <idno type="stamp" n="INSA-GROUPE">Groupe INSA</idno>
            <idno type="stamp" n="CEA-GRE" corresp="CEA">CEA Grenoble</idno>
            <idno type="stamp" n="FERMI" corresp="CNRS">Fédération de recherche « Matière et interactions »</idno>
            <idno type="stamp" n="TOULOUSE-INP">Toulouse - INP</idno>
            <idno type="stamp" n="UNIV-UT3">Université Toulouse 3</idno>
            <idno type="stamp" n="UT3-INP">Université de Toulouse / Toulouse INP</idno>
            <idno type="stamp" n="UT3-TOULOUSEINP">Université de Toulouse / Toulouse INP</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">Predicting energy-dependent transformation products of environmental contaminants: the case of ibuprofen</title>
                <author role="aut">
                  <persName>
                    <forename type="first">Grégoire</forename>
                    <surname>Salomon</surname>
                  </persName>
                  <idno type="halauthorid">2899158-0</idno>
                  <affiliation ref="#struct-40214"/>
                </author>
                <author role="aut">
                  <persName>
                    <forename type="first">Mathias</forename>
                    <surname>Rapacioli</surname>
                  </persName>
                  <email type="md5">b7181be59929c37d30741943d0a41a2a</email>
                  <email type="domain">irsamc.ups-tlse.fr</email>
                  <idno type="idhal" notation="string">mathias-rapacioli</idno>
                  <idno type="idhal" notation="numeric">171955</idno>
                  <idno type="halauthorid" notation="string">18563-171955</idno>
                  <idno type="ORCID">https://orcid.org/0000-0003-2394-6694</idno>
                  <idno type="IDREF">https://www.idref.fr/103543368</idno>
                  <affiliation ref="#struct-1612855"/>
                  <affiliation ref="#struct-1612854"/>
                </author>
                <author role="aut">
                  <persName>
                    <forename type="first">J</forename>
                    <forename type="middle">Christian</forename>
                    <surname>Schön</surname>
                  </persName>
                  <idno type="idhal" notation="numeric">1609229</idno>
                  <idno type="halauthorid" notation="string">3892829-1609229</idno>
                  <idno type="ORCID">https://orcid.org/0000-0002-3143-3664</idno>
                  <affiliation ref="#struct-1167425"/>
                </author>
                <author role="aut">
                  <persName>
                    <forename type="first">Nathalie</forename>
                    <surname>Tarrat</surname>
                  </persName>
                  <email type="md5">bd3320e50e74b4f79424ed411bee6847</email>
                  <email type="domain">cemes.fr</email>
                  <idno type="idhal" notation="string">nathalie-tarrat</idno>
                  <idno type="idhal" notation="numeric">18511</idno>
                  <idno type="halauthorid" notation="string">39332-18511</idno>
                  <idno type="ORCID">https://orcid.org/0000-0002-0909-0001</idno>
                  <idno type="IDREF">https://www.idref.fr/103583890</idno>
                  <affiliation ref="#struct-1612755"/>
                </author>
              </analytic>
              <monogr>
                <idno type="halJournalId" status="VALID">167490</idno>
                <idno type="issn">2624-8174</idno>
                <title level="j">Physics</title>
                <imprint>
                  <publisher>MDPI</publisher>
                  <biblScope unit="volume">8</biblScope>
                  <biblScope unit="pp">4</biblScope>
                  <date type="datePub">2026-01</date>
                </imprint>
              </monogr>
              <idno type="doi">10.3390/physics8010004</idno>
            </biblStruct>
          </sourceDesc>
          <profileDesc>
            <langUsage>
              <language ident="en">English</language>
            </langUsage>
            <textClass>
              <keywords scheme="author">
                <term xml:lang="en">Ibuprofen</term>
                <term xml:lang="en">Irradiation energy</term>
                <term xml:lang="en">Transformation Products</term>
                <term xml:lang="en">molecular fragmentation</term>
                <term xml:lang="en">threshold algorithm</term>
                <term xml:lang="en">DFTB</term>
                <term xml:lang="en">probability flows</term>
                <term xml:lang="en">mass spectra</term>
              </keywords>
              <classCode scheme="halDomain" n="chim.theo">Chemical Sciences/Theoretical and/or physical chemistry</classCode>
              <classCode scheme="halDomain" n="sde">Environmental Sciences</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 environmental pollution caused by emerging organic contaminants - such as ibuprofen - is becoming increasingly a cause for alarm. New treatments for their removal are currently being developed, but the nature and toxicity of the transformation products (TPs) formed during the processes cannot be easily assessed experimentally. Atomistic simulations are thus of great interest in predicting the chemical structure of these TPs. In this work, we have demonstrated that the transformation of a contaminant molecule under irradiation can be studied using the threshold algorithm combined with the density functional based tight-binding (DFTB) method. The fragmentation pathways of an ibuprofen molecule under irradiation have been studied as a function of the energy added to the system. Specifically, the chemical structures of ibuprofen's TPs, the paths between them, their stabilities, probabilities of occurrence, and the related mass spectra were obtained as a function of the amount of energy absorbed. We also simulated the evolution of the ibuprofen molecule as a function of the number of pulses, i.e., for a sequence of energy depositions. A dominant fragmentation scheme was identified, where first the OH group is released, followed by the loss of the CO group. The photon energy and the number of pulses were found to be key parameters for the selection of this degradation route among all identified fragmentation pathways.</p>
            </abstract>
          </profileDesc>
        </biblFull>
      </listBibl>
    </body>
    <back>
      <listOrg type="structures">
        <org type="laboratory" xml:id="struct-40214" status="VALID">
          <idno type="IdRef">026506351</idno>
          <idno type="ISNI">0000 0001 2184 7102</idno>
          <idno type="RNSR">196718590E</idno>
          <idno type="ROR">https://ror.org/04mf0wv34</idno>
          <idno type="Wikidata">Q1023249</idno>
          <orgName>Commissariat à l'énergie atomique et aux énergies alternatives - Laboratoire d'Electronique et de Technologie de l'Information</orgName>
          <orgName type="acronym">CEA-LETI</orgName>
          <date type="start">1967-01-01</date>
          <desc>
            <address>
              <addrLine>MINATEC 17, rue des Martyrs, 38054, Grenoble Cedex 9</addrLine>
              <country key="FR"/>
            </address>
            <ref type="url">http://www-leti.cea.fr/</ref>
          </desc>
          <listRelation>
            <relation name="DRT" active="#struct-440043" type="direct"/>
            <relation name="DRT" active="#struct-300016" type="indirect"/>
          </listRelation>
        </org>
        <org type="researchteam" xml:id="struct-1612855" status="VALID">
          <orgName>Modélisation, Agrégats, Dynamique (LCPQ)</orgName>
          <orgName type="acronym">MAD</orgName>
          <date type="start">2025-01-01</date>
          <desc>
            <address>
              <addrLine>Laboratoire de Chimie et Physique Quantiques - UMR5626Université Paul SabatierBat. 3R1b4118 route de Narbonne31062 Toulouse Cedex 09</addrLine>
              <country key="FR"/>
            </address>
            <ref type="url">http://www.lcpq.ups-tlse.fr/spip.php?rubrique35</ref>
          </desc>
          <listRelation>
            <relation active="#struct-1612854" type="direct"/>
            <relation name="UMR5626" active="#struct-341038" type="indirect"/>
            <relation name="UMR5626" active="#struct-441569" type="indirect"/>
            <relation active="#struct-1574795" type="indirect"/>
            <relation active="#struct-443875" type="indirect"/>
            <relation active="#struct-1612839" type="indirect"/>
            <relation active="#struct-116255" type="indirect"/>
            <relation active="#struct-301232" type="indirect"/>
            <relation name="FR2051" active="#struct-441569" type="indirect"/>
          </listRelation>
        </org>
        <org type="laboratory" xml:id="struct-1612854" status="VALID">
          <idno type="IdRef">232929580</idno>
          <idno type="RNSR">199512055E</idno>
          <idno type="ROR">https://ror.org/056g7f250</idno>
          <orgName>Laboratoire de Chimie et Physique Quantiques</orgName>
          <orgName type="acronym">LCPQ</orgName>
          <date type="start">2025-01-01</date>
          <desc>
            <address>
              <addrLine>LCPQ118 Route de NarbonneBât. 3R1 b431062 Toulouse cedex 9</addrLine>
              <country key="FR"/>
            </address>
            <ref type="url">http://www.lcpq.ups-tlse.fr/</ref>
          </desc>
          <listRelation>
            <relation name="UMR5626" active="#struct-341038" type="direct"/>
            <relation name="UMR5626" active="#struct-441569" type="direct"/>
            <relation active="#struct-1574795" type="direct"/>
            <relation active="#struct-443875" type="indirect"/>
            <relation active="#struct-1612839" type="direct"/>
            <relation active="#struct-116255" type="indirect"/>
            <relation active="#struct-301232" type="indirect"/>
            <relation name="FR2051" active="#struct-441569" type="direct"/>
          </listRelation>
        </org>
        <org type="institution" xml:id="struct-1167425" status="INCOMING">
          <orgName>Max Planck Institute für Festkörperforschung Physics</orgName>
          <desc>
            <address>
              <country key="DE"/>
            </address>
          </desc>
        </org>
        <org type="researchteam" xml:id="struct-1612755" status="VALID">
          <orgName>Surfaces, Interfaces et Nano-Objets</orgName>
          <orgName type="acronym">CEMES-SINanO</orgName>
          <date type="start">2025-01-01</date>
          <desc>
            <address>
              <addrLine>CEMES 29 rue Jeanne Marvig, BP 94347, F-31055 Toulouse Cedex 4</addrLine>
              <country key="FR"/>
            </address>
            <ref type="url">http://www.cemes.fr/SINanO-Surfaces-Interfaces-et-Nano-Objets</ref>
          </desc>
          <listRelation>
            <relation active="#struct-1612749" type="direct"/>
            <relation active="#struct-116255" type="indirect"/>
            <relation active="#struct-301232" type="indirect"/>
            <relation active="#struct-443875" type="indirect"/>
            <relation name="UPR8011" active="#struct-441569" type="indirect"/>
            <relation active="#struct-1574795" type="indirect"/>
            <relation active="#struct-1612774" type="indirect"/>
            <relation active="#struct-67872" type="indirect"/>
            <relation active="#struct-341038" type="indirect"/>
            <relation name="UAR2599" active="#struct-441569" type="indirect"/>
            <relation active="#struct-448187" type="indirect"/>
          </listRelation>
        </org>
        <org type="regrouplaboratory" xml:id="struct-440043" status="VALID">
          <idno type="IdRef">067087930</idno>
          <idno type="ISNI">0000000121157881</idno>
          <idno type="RNSR">199018589D</idno>
          <idno type="ROR">https://ror.org/02ggzyd20</idno>
          <idno type="Wikidata">Q30299418</idno>
          <orgName>Direction de Recherche Technologique (CEA)</orgName>
          <orgName type="acronym">DRT (CEA)</orgName>
          <desc>
            <address>
              <country key="FR"/>
            </address>
            <ref type="url">http://www.drt-cea.com/</ref>
          </desc>
          <listRelation>
            <relation name="DRT" active="#struct-300016" type="direct"/>
          </listRelation>
        </org>
        <org type="institution" xml:id="struct-300016" status="VALID">
          <idno type="IdRef">026372061</idno>
          <idno type="ISNI">0000000122998025</idno>
          <idno type="ROR">https://ror.org/00jjx8s55</idno>
          <idno type="Wikidata">Q868550</idno>
          <orgName>Commissariat à l'énergie atomique et aux énergies alternatives</orgName>
          <orgName type="acronym">CEA</orgName>
          <desc>
            <address>
              <addrLine>Centre de SaclayCentre de GrenobleCentre de Cadaracheetc</addrLine>
              <country key="FR"/>
            </address>
            <ref type="url">http://www.cea.fr/</ref>
          </desc>
        </org>
        <org type="institution" xml:id="struct-341038" status="VALID">
          <idno type="IdRef">232435103</idno>
          <idno type="ISNI">000000010626358X</idno>
          <idno type="ROR">https://ror.org/02cte4b68</idno>
          <orgName>Institut de Chimie - CNRS Chimie</orgName>
          <orgName type="acronym">INC-CNRS</orgName>
          <date type="start">2009-10-01</date>
          <desc>
            <address>
              <addrLine>CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE3 rue Michel-Ange75794 PARIS CEDEX 16 - France</addrLine>
              <country key="FR"/>
            </address>
            <ref type="url">http://www.cnrs.fr/inc</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-1574795" status="VALID">
          <orgName>Université de Toulouse</orgName>
          <orgName type="acronym">EPE UT</orgName>
          <date type="start">2025-01-01</date>
          <desc>
            <address>
              <addrLine>118 toute de Narbonne, 31062 Toulouse cedex 9</addrLine>
              <country key="FR"/>
            </address>
            <ref type="url">https://www.univ-tlse3.fr/</ref>
          </desc>
          <listRelation>
            <relation active="#struct-443875" type="direct"/>
          </listRelation>
        </org>
        <org type="regroupinstitution" xml:id="struct-443875" status="VALID">
          <idno type="ROR">https://ror.org/017tgbk05</idno>
          <orgName>Communauté d'universités et établissements de Toulouse</orgName>
          <orgName type="acronym">Comue de Toulouse</orgName>
          <desc>
            <address>
              <addrLine>41 Allée Jules Guesde, 31000 Toulouse</addrLine>
              <country key="FR"/>
            </address>
            <ref type="url">https://www.univ-toulouse.fr/</ref>
          </desc>
        </org>
        <org type="regrouplaboratory" xml:id="struct-1612839" status="VALID">
          <idno type="RNSR">202123707G</idno>
          <idno type="ROR">02wq1s711</idno>
          <orgName>Fédération de recherche « Matière et interactions »</orgName>
          <orgName type="acronym">FeRMI</orgName>
          <date type="start">2025-01-01</date>
          <desc>
            <address>
              <addrLine>29 rue Jeanne Marvig BP94 31055 TOULOUSE</addrLine>
              <country key="FR"/>
            </address>
            <ref type="url">https://fermi.univ-tlse3.fr/fr/home/</ref>
          </desc>
          <listRelation>
            <relation active="#struct-116255" type="direct"/>
            <relation active="#struct-301232" type="indirect"/>
            <relation active="#struct-443875" type="indirect"/>
            <relation name="FR2051" active="#struct-441569" type="direct"/>
            <relation active="#struct-1574795" type="direct"/>
          </listRelation>
        </org>
        <org type="institution" xml:id="struct-116255" status="VALID">
          <idno type="IdRef">026388766</idno>
          <idno type="ISNI">0000 0001 2286 8343</idno>
          <idno type="ROR">https://ror.org/01h8pf755</idno>
          <idno type="Wikidata">Q858979</idno>
          <orgName>Institut National des Sciences Appliquées - Toulouse</orgName>
          <orgName type="acronym">INSA Toulouse</orgName>
          <date type="start">1963-10-21</date>
          <desc>
            <address>
              <addrLine>135, avenue de Rangueil - 31077 Toulouse cedex 4</addrLine>
              <country key="FR"/>
            </address>
            <ref type="url">http://www.insa-toulouse.fr</ref>
          </desc>
          <listRelation>
            <relation active="#struct-301232" type="direct"/>
            <relation active="#struct-443875" type="direct"/>
          </listRelation>
        </org>
        <org type="regroupinstitution" xml:id="struct-301232" status="VALID">
          <idno type="IdRef">162105150</idno>
          <orgName>Institut National des Sciences Appliquées</orgName>
          <orgName type="acronym">INSA</orgName>
          <desc>
            <address>
              <country key="FR"/>
            </address>
          </desc>
        </org>
        <org type="laboratory" xml:id="struct-1612749" status="VALID">
          <idno type="IdRef">157408132</idno>
          <idno type="ISNI">0000 0000 9254 7345</idno>
          <idno type="RNSR">199117683P</idno>
          <idno type="ROR">https://ror.org/03kwnqq69</idno>
          <orgName>Centre d'élaboration de matériaux et d'études structurales</orgName>
          <orgName type="acronym">CEMES</orgName>
          <date type="start">2025-01-01</date>
          <desc>
            <address>
              <addrLine>29 Rue Jeanne Marvig - BP 94347 31055 TOULOUSE CEDEX 4</addrLine>
              <country key="FR"/>
            </address>
            <ref type="url">http://www.cemes.fr/</ref>
          </desc>
          <listRelation>
            <relation active="#struct-116255" type="direct"/>
            <relation active="#struct-301232" type="indirect"/>
            <relation active="#struct-443875" type="indirect"/>
            <relation name="UPR8011" active="#struct-441569" type="direct"/>
            <relation active="#struct-1574795" type="direct"/>
            <relation active="#struct-1612774" type="direct"/>
            <relation active="#struct-67872" type="indirect"/>
            <relation active="#struct-341038" type="indirect"/>
            <relation name="UAR2599" active="#struct-441569" type="direct"/>
            <relation active="#struct-448187" type="indirect"/>
          </listRelation>
        </org>
        <org type="regrouplaboratory" xml:id="struct-1612774" status="VALID">
          <idno type="IdRef">240309472</idno>
          <idno type="ISNI">0000 0004 4686 8315</idno>
          <idno type="RNSR">200310667L</idno>
          <orgName>Institut de Chimie de Toulouse</orgName>
          <orgName type="acronym">ICT</orgName>
          <date type="start">2025-01-01</date>
          <desc>
            <address>
              <addrLine>118 Route de Narbonne 31062 Toulouse cédex 9</addrLine>
              <country key="FR"/>
            </address>
          </desc>
          <listRelation>
            <relation active="#struct-67872" type="direct"/>
            <relation active="#struct-341038" type="direct"/>
            <relation name="UAR2599" active="#struct-441569" type="direct"/>
            <relation active="#struct-448187" type="direct"/>
            <relation active="#struct-443875" type="indirect"/>
            <relation active="#struct-1574795" type="direct"/>
          </listRelation>
        </org>
        <org type="institution" xml:id="struct-67872" status="VALID">
          <idno type="IdRef">050165224</idno>
          <idno type="ROR">https://ror.org/05q3vnk25</idno>
          <orgName>Institut de Recherche pour le Développement</orgName>
          <orgName type="acronym">IRD</orgName>
          <desc>
            <address>
              <addrLine>SiègeLe Sextant 44, bd de DunkerqueCS 9000913572 Marseille cedex 02</addrLine>
              <country key="FR"/>
            </address>
            <ref type="url">http://www.ird.fr/</ref>
          </desc>
        </org>
        <org type="institution" xml:id="struct-448187" status="VALID">
          <idno type="IdRef">026388820</idno>
          <idno type="ISNI">0000000121766169</idno>
          <idno type="ROR">https://ror.org/033p9g875</idno>
          <orgName>Institut National Polytechnique (Toulouse)</orgName>
          <orgName type="acronym">Toulouse INP</orgName>
          <desc>
            <address>
              <country key="FR"/>
            </address>
            <ref type="url">https://www.inp-toulouse.fr/</ref>
          </desc>
          <listRelation>
            <relation active="#struct-443875" type="direct"/>
          </listRelation>
        </org>
      </listOrg>
    </back>
  </text>
</TEI>