Center for Molecular Modeling - M. Hinterstein https://molmod.ugent.be/publication-authors/m-hinterstein en Design of zeolite by inverse sigma transformation https://molmod.ugent.be/c1_c3_publications/design-zeolite-inverse-sigma-transformation <div class="field field-name-field-a1-authors field-type-taxonomy-term-reference field-label-hidden"> <span class="field-items"> <a href="/publication-authors/e-verheyen" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">E. Verheyen</a>, <a href="/publication-authors/l-joos" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">L. Joos</a>, <a href="/publication-authors/k-van-havenbergh" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">K. Van Havenbergh</a>, <a href="/publication-authors/e-breynaerts" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">E. Breynaerts</a>, <a href="/publication-authors/n-kasian" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">N. Kasian</a>, <a href="/publication-authors/e-gobechiya" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">E. Gobechiya</a>, <a href="/publication-authors/k-houthoofd" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">K. Houthoofd</a>, <a href="/publication-authors/c-martineau" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">C. Martineau</a>, <a href="/publication-authors/m-hinterstein" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">M. Hinterstein</a>, <a href="/publication-authors/f-taulelle" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">F. Taulelle</a>, <a href="/publication-authors/v-van-speybroeck" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">V. Van Speybroeck</a>, <a href="/publication-authors/m-waroquier" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">M. Waroquier</a>, <a href="/publication-authors/s-bals" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">S. Bals</a>, <a href="/publication-authors/g-van-tendeloo" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">G. Van Tendeloo</a>, <a href="/publication-authors/c-kirschhock" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">C. Kirschhock</a>, <a href="/publication-authors/ja-martens" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">J.A. Martens</a> </span> </div> <div class="field field-name-field-abstract-page field-type-text field-label-hidden"> <div class="field-items"> <div class="field-item even">p. 70</div> </div> </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">Talk</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">IZC17</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">Moscow, Russia</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="2013-07-07T00:00:00+02:00">Sunday, 7 July, 2013</span> to <span class="date-display-end" property="dc:date" datatype="xsd:dateTime" content="2013-07-12T00:00:00+02:00">Friday, 12 July, 2013</span></span></div> </div> </div> <div class="field field-name-field-conference-reference field-type-taxonomy-term-reference field-label-above"> <h3 class="field-label">Conference reference</h3> <span class="field-items"> <a href="/conferences/izc-17" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">IZC-17</a> </span> </div> Mon, 12 Aug 2013 14:09:45 +0000 wim 2498 at https://molmod.ugent.be https://molmod.ugent.be/c1_c3_publications/design-zeolite-inverse-sigma-transformation#comments Computational Approach of the Inverse Sigma Transformation of Zeolites https://molmod.ugent.be/c1_c3_publications/computational-approach-inverse-sigma-transformation-zeolites <div class="field field-name-field-a1-authors field-type-taxonomy-term-reference field-label-hidden"> <span class="field-items"> <a href="/publication-authors/e-verheyen" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">E. Verheyen</a>, <a href="/publication-authors/l-joos" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">L. Joos</a>, <a href="/publication-authors/k-van-havenbergh" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">K. Van Havenbergh</a>, <a href="/publication-authors/e-breynaerts" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">E. Breynaerts</a>, <a href="/publication-authors/n-kasian" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">N. Kasian</a>, <a href="/publication-authors/e-gobechiya" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">E. Gobechiya</a>, <a href="/publication-authors/k-houthoofd" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">K. Houthoofd</a>, <a href="/publication-authors/c-martineau" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">C. Martineau</a>, <a href="/publication-authors/m-hinterstein" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">M. Hinterstein</a>, <a href="/publication-authors/f-taulelle" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">F. Taulelle</a>, <a href="/publication-authors/v-van-speybroeck" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">V. Van Speybroeck</a>, <a href="/publication-authors/m-waroquier" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">M. Waroquier</a>, <a href="/publication-authors/s-bals" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">S. Bals</a>, <a href="/publication-authors/g-van-tendeloo" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">G. Van Tendeloo</a>, <a href="/publication-authors/c-kirschhock" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">C. Kirschhock</a>, <a href="/publication-authors/ja-martens" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">J.A. Martens</a> </span> </div> <div class="field field-name-field-abstract-page field-type-text field-label-hidden"> <div class="field-items"> <div class="field-item even">p. 219</div> </div> </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">IZC17</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">Moscow, Russia</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="2013-07-07T00:00:00+02:00">Sunday, 7 July, 2013</span> to <span class="date-display-end" property="dc:date" datatype="xsd:dateTime" content="2013-07-12T00:00:00+02:00">Friday, 12 July, 2013</span></span></div> </div> </div> <div class="field field-name-field-conference-reference field-type-taxonomy-term-reference field-label-above"> <h3 class="field-label">Conference reference</h3> <span class="field-items"> <a href="/conferences/izc-17" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">IZC-17</a> </span> </div> Mon, 12 Aug 2013 14:07:29 +0000 wim 2497 at https://molmod.ugent.be https://molmod.ugent.be/c1_c3_publications/computational-approach-inverse-sigma-transformation-zeolites#comments Design of zeolite by inverse sigma transformation https://molmod.ugent.be/publications/design-zeolite-inverse-sigma-transformation <div class="field field-name-field-a1-authors field-type-taxonomy-term-reference field-label-hidden"> <span class="field-items"> E. Verheyen, L. Joos, K. Van Havenbergh, N. Kasian, E. Gobechiya, K. Houthoofd, M. Hinterstein, E. Breynaerts, V. Van Speybroeck, M. Waroquier, S. Bals, G. Van Tendeloo, C. Kirschhock, J.A. Martens </span> </div> <div class="field field-name-field-journal-title field-type-taxonomy-term-reference field-label-hidden"> <span class="field-items"> Nature Materials </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">11 (12), 1059-1064</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="2012-01-01T00:00:00+01:00">2012</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>Zeolites are silicon materials, that have channels and pores on the nanoscale. This paper reports the synthesis of a new zeolite, in which the pores were widened using a revolutionary synthesis method. The final material has a series of unique and special properties, useful for industrial processes. Molecular modeling was used to determine the structure of the material.</p> <p>Zeolieten zijn materialen opgebouwd uit silicium, die op nanoschaal kanalen en poriën bevatten. Deze paper rapporteert de synthese van een nieuw type zeoliet, waarbij de kanalen op een revolutionaire manier werden vergroot. Het eindmateriaal heeft daarom een hele reeks aan unieke en bijzonder interessante eigenschappen voor een aantal industriële processen. Moleculaire modelering werd gebruikt om de structuur van het materiaal te bepalen.</p> <p>A graphical representation of COK14:</p> <p><img src="https://dl.dropbox.com/u/16792168/CMMwebsite/COK14.jpg" width="620px" height="auto" /></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/10.1038/nmat3455">http://dx.doi.org/10.1038/nmat3455</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/12_nat_mat_11%2812%291059_Verheyen.pdf" type="application/pdf; length=7744510">12_nat_mat_11(12)1059_Verheyen.pdf</a></span></div> <div class="field-item odd"><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/nmat3455-s1.pdf" type="application/pdf; length=7415865">nmat3455-s1.pdf</a></span></div> </div> </div> Mon, 03 Sep 2012 10:08:14 +0000 michel 1439 at https://molmod.ugent.be https://molmod.ugent.be/publications/design-zeolite-inverse-sigma-transformation#comments