Center for Molecular Modeling - W. Van Renterghem https://molmod.ugent.be/publication-authors/w-van-renterghem en Dislocations mediate hydrogen retention in tungsten https://molmod.ugent.be/publications/dislocations-mediate-hydrogen-retention-tungsten <div class="field field-name-field-a1-authors field-type-taxonomy-term-reference field-label-hidden"> <span class="field-items"> D. Terentyev, V. Dubinko, A. Bakaev, Y. Zayachuk, W. Van Renterghem, P. Grigorev </span> </div> <div class="field field-name-field-journal-title field-type-taxonomy-term-reference field-label-hidden"> <span class="field-items"> Nuclear Fusion </span> </div> <div class="field field-name-field-vol-iss field-type-text field-label-hidden"> <div class="field-items"> <div class="field-item even">54 (4), 042004</div> </div> </div> <div class="field field-name-field-a1year field-type-datestamp field-label-hidden"> <div class="field-items"> <div class="field-item even"><span class="date-display-single" property="dc:date" datatype="xsd:dateTime" content="2014-01-01T00:00:00+01:00">2014</span></div> </div> </div> <div class="field field-name-field-a1-type field-type-list-text field-label-hidden"> <div class="field-items"> <div class="field-item even">A1</div> </div> </div> <div class="field field-name-field-not-a-cmm-publication field-type-list-boolean field-label-hidden"> <div class="field-items"> <div class="field-item even"></div> </div> </div> <div class="field field-name-body field-type-text-with-summary field-label-above"> <h3><div class="field-label">Abstract&nbsp;</div></h3> <div class="field-items"> <div class="field-item even" property="content:encoded"><div class="tex2jax"><p>In this letter, a comprehensive mechanism for the nucleation and growth of bubbles on dislocations under plasma exposure of tungsten is proposed. The mechanism reconciles long-standing experimental observations of hydrogen isotopes retention, essentially defined by material microstructure, and so far not fully explained. Hence, this work provides an important link to unify material's modelling with experimental assessment of W and W-based alloys as candidates for plasma facing components.</p> </div></div> </div> </div> <div class="field field-name-field-open-access field-type-list-boolean field-label-hidden"> <div class="field-items"> <div class="field-item even"></div> </div> </div> <div class="field field-name-field-doi field-type-text field-label-above"> <h3><div class="field-label">DOI&nbsp;</div></h3> <div class="field-items"> <div class="field-item even"><div class="tex2jax"><p><a href="http://dx.doi.org/10.1088/0029-5515/54/4/042004">http://dx.doi.org/10.1088/0029-5515/54/4/042004</a></p> </div></div> </div> </div> <div class="field field-name-field-a1-file field-type-file field-label-above"> <h3><div class="field-label">Private attachment&nbsp;</div></h3> <div class="field-items"> <div class="field-item even"><span class="file"><img class="file-icon" alt="PDF icon" title="application/pdf" src="/modules/file/icons/application-pdf.png" /> <a href="https://molmod.ugent.be/system/files/14_NuclFusion_54%2C042004_Terentyev.pdf" type="application/pdf; length=435667">14_NuclFusion_54,042004_Terentyev.pdf</a></span></div> </div> </div> Fri, 13 Jun 2014 10:11:00 +0000 wim 3054 at https://molmod.ugent.be https://molmod.ugent.be/publications/dislocations-mediate-hydrogen-retention-tungsten#comments Ab initio modeling of fusion reactor materials: Unravelling the hydrogen retention mechanisms https://molmod.ugent.be/c1_c3_publications/ab-initio-modeling-fusion-reactor-materials-unravelling-hydrogen-retention <div class="field field-name-field-a1-authors field-type-taxonomy-term-reference field-label-hidden"> <span class="field-items"> <a href="/publication-authors/bakaev" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">A. Bakaev</a>, <a href="/publication-authors/p-grigorev" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">P. Grigorev</a>, <a href="/publication-authors/v-dubinko" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">V. Dubinko</a>, <a href="/publication-authors/d-terentyev" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">D. Terentyev</a>, <a href="/publication-authors/w-van-renterghem" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">W. Van Renterghem</a>, <a href="/publication-authors/g-van-oost" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">G. Van Oost</a> </span> </div> <div class="field field-name-field-isbn-issn field-type-text field-label-hidden"> <div class="field-items"> <div class="field-item even">ISBN/ISSN:</div> </div> </div> <div class="field field-name-field-poster-or-talk field-type-list-text field-label-hidden"> <div class="field-items"> <div class="field-item even">Poster</div> </div> </div> <div class="field field-name-field-conference-name field-type-text field-label-above"> <h3><div class="field-label">Conference / event / venue&nbsp;</div></h3> <div class="field-items"> <div class="field-item even">International Conference on Scientific Computing 2013</div> </div> </div> <div class="field field-name-field-conference-location field-type-text field-label-hidden"> <div class="field-items"> <div class="field-item even">Paphos, Cyprus</div> </div> </div> <div class="field field-name-field-conference-dates field-type-date field-label-hidden"> <div class="field-items"> <div class="field-item even"><span class="date-display-range"><span class="date-display-start" property="dc:date" datatype="xsd:dateTime" content="2013-12-03T00:00:00+01:00">Tuesday, 3 December, 2013</span> to <span class="date-display-end" property="dc:date" datatype="xsd:dateTime" content="2013-12-06T00:00:00+01:00">Friday, 6 December, 2013</span></span></div> </div> </div> Tue, 19 Aug 2014 12:27:38 +0000 alex 3164 at https://molmod.ugent.be https://molmod.ugent.be/c1_c3_publications/ab-initio-modeling-fusion-reactor-materials-unravelling-hydrogen-retention#comments Trapping of H on dislocations and grain boundaries in W alloys: an atomistic study https://molmod.ugent.be/c1_c3_publications/trapping-h-dislocations-and-grain-boundaries-w-alloys-atomistic-study <div class="field field-name-field-a1-authors field-type-taxonomy-term-reference field-label-hidden"> <span class="field-items"> <a href="/publication-authors/bakaev" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">A. Bakaev</a>, <a href="/publication-authors/p-grigorev" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">P. Grigorev</a>, <a href="/publication-authors/v-dubinko" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">V. Dubinko</a>, <a href="/publication-authors/d-terentyev" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">D. Terentyev</a>, <a href="/publication-authors/w-van-renterghem" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">W. Van Renterghem</a>, <a href="/publication-authors/g-van-oost" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">G. Van Oost</a> </span> </div> <div class="field field-name-field-isbn-issn field-type-text field-label-hidden"> <div class="field-items"> <div class="field-item even">ISBN/ISSN:</div> </div> </div> <div class="field field-name-field-poster-or-talk field-type-list-text field-label-hidden"> <div class="field-items"> <div class="field-item even">Poster</div> </div> </div> <div class="field field-name-field-conference-name field-type-text field-label-above"> <h3><div class="field-label">Conference / event / venue&nbsp;</div></h3> <div class="field-items"> <div class="field-item even">14th International Conference on Plasma-Facing Materials and Components for Fusion Applications</div> </div> </div> <div class="field field-name-field-conference-location field-type-text field-label-hidden"> <div class="field-items"> <div class="field-item even">Julich, Germany</div> </div> </div> <div class="field field-name-field-conference-dates field-type-date field-label-hidden"> <div class="field-items"> <div class="field-item even"><span class="date-display-range"><span class="date-display-start" property="dc:date" datatype="xsd:dateTime" content="2013-05-13T00:00:00+02:00">Monday, 13 May, 2013</span> to <span class="date-display-end" property="dc:date" datatype="xsd:dateTime" content="2013-05-17T00:00:00+02:00">Friday, 17 May, 2013</span></span></div> </div> </div> Tue, 19 Aug 2014 12:22:32 +0000 alex 3161 at https://molmod.ugent.be https://molmod.ugent.be/c1_c3_publications/trapping-h-dislocations-and-grain-boundaries-w-alloys-atomistic-study#comments