Center for Molecular Modeling - MOF2012 https://molmod.ugent.be/conferences/mof2012-0 en Empty host breathing profiles of MIL-53 type frameworks with various cations at the nodal points https://molmod.ugent.be/c1_c3_publications/empty-host-breathing-profiles-mil-53-type-frameworks-various-cations-nodal-points <div class="field field-name-field-a1-authors field-type-taxonomy-term-reference field-label-hidden"> <span class="field-items"> <a href="/publication-authors/l-vanduyfhuys" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">L. Vanduyfhuys</a>, <a href="/publication-authors/t-verstraelen" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">T. Verstraelen</a>, <a href="/publication-authors/m-vandichel" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">M. Vandichel</a>, <a href="/publication-authors/ghysels" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">A. Ghysels</a>, <a href="/publication-authors/m-waroquier" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">M. Waroquier</a>, <a href="/publication-authors/v-van-speybroeck" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">V. Van Speybroeck</a> </span> </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">MOF2012</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">Edinburgh UK</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="2012-09-16T00:00:00+02:00">Sunday, 16 September, 2012</span> to <span class="date-display-end" property="dc:date" datatype="xsd:dateTime" content="2012-09-19T00:00:00+02:00">Wednesday, 19 September, 2012</span></span></div> </div> </div> <div class="field field-name-field-abstract-private field-type-file field-label-above"> <h3><div class="field-label">Abstract (private)&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/abstract_LVDH_MOF2012%282%29.pdf" type="application/pdf; length=21475">abstract_LVDH_MOF2012(2).pdf</a></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/mof2012-0" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">MOF2012</a> </span> </div> Wed, 27 Feb 2013 08:37:18 +0000 wim 2099 at https://molmod.ugent.be https://molmod.ugent.be/c1_c3_publications/empty-host-breathing-profiles-mil-53-type-frameworks-various-cations-nodal-points#comments A new approach towards basic metal-organic frameworks https://molmod.ugent.be/c1_c3_publications/new-approach-towards-basic-metal-organic-frameworks <div class="field field-name-field-a1-authors field-type-taxonomy-term-reference field-label-hidden"> <span class="field-items"> <a href="/publication-authors/p-valvekens" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">P. Valvekens</a>, <a href="/publication-authors/m-vandichel" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">M. Vandichel</a>, <a href="/publication-authors/m-waroquier" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">M. Waroquier</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/d-de-vos" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">D. De Vos</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. </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">MOF2012</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">Edinburgh, UK</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="2012-09-16T00:00:00+02:00">Sunday, 16 September, 2012</span> to <span class="date-display-end" property="dc:date" datatype="xsd:dateTime" content="2012-09-19T00:00:00+02:00">Wednesday, 19 September, 2012</span></span></div> </div> </div> <div class="field field-name-field-abstract-private field-type-file field-label-above"> <h3><div class="field-label">Abstract (private)&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/4011.pdf" type="application/pdf; length=19522">4011.pdf</a></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/mof2012-0" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">MOF2012</a> </span> </div> Mon, 28 Jan 2013 09:07:16 +0000 mat 1967 at https://molmod.ugent.be https://molmod.ugent.be/c1_c3_publications/new-approach-towards-basic-metal-organic-frameworks#comments Ab initio parametrised force field for the flexible Metal-Organic Framework MIL-53(Al) https://molmod.ugent.be/c1_c3_publications/ab-initio-parametrised-force-field-flexible-metal-organic-framework-mil-53al <div class="field field-name-field-a1-authors field-type-taxonomy-term-reference field-label-hidden"> <span class="field-items"> <a href="/publication-authors/l-vanduyfhuys" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">L. Vanduyfhuys</a>, <a href="/publication-authors/t-verstraelen" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">T. Verstraelen</a>, <a href="/publication-authors/m-vandichel" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">M. Vandichel</a>, <a href="/publication-authors/m-waroquier" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">M. Waroquier</a>, <a href="/publication-authors/v-van-speybroeck" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">V. Van Speybroeck</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. </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">MOF2012</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">Edinburgh, United Kingdom</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="2012-09-16T00:00:00+02:00">Sunday, 16 September, 2012</span> to <span class="date-display-end" property="dc:date" datatype="xsd:dateTime" content="2012-09-19T00:00:00+02:00">Wednesday, 19 September, 2012</span></span></div> </div> </div> <div class="field field-name-field-abstract-private field-type-file field-label-above"> <h3><div class="field-label">Abstract (private)&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/abstract.pdf" type="application/pdf; length=372362">abstract.pdf</a></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/mof2012-0" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">MOF2012</a> </span> </div> Thu, 24 Jan 2013 08:35:37 +0000 louis 1934 at https://molmod.ugent.be https://molmod.ugent.be/c1_c3_publications/ab-initio-parametrised-force-field-flexible-metal-organic-framework-mil-53al#comments MOF2012 https://molmod.ugent.be/travel/mof2012 <div class="field field-name-field-conference-location field-type-text field-label-hidden"> <div class="field-items"> <div class="field-item even">Edinburgh, UK</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="2012-09-15T00:00:00+02:00">Saturday, 15 September, 2012</span> to <span class="date-display-end" property="dc:date" datatype="xsd:dateTime" content="2012-09-19T00:00:00+02:00">Wednesday, 19 September, 2012</span></span></div> </div> </div> <div class="field field-name-field-a1-authors field-type-taxonomy-term-reference field-label-above"> <h3 class="field-label">Participant(s)</h3> <span class="field-items"> M. Vandichel, V. Van Speybroeck, L. Vanduyfhuys, T. Bogaerts </span> </div> <div class="field field-name-field-a1-project field-type-taxonomy-term-reference field-label-above"> <h3 class="field-label">Project ref.</h3> <span class="field-items"> BOF mandaat, BOF-ERC I/00057/02, FWO mandaat </span> </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"> MOF2012 </span> </div> Wed, 23 Jan 2013 14:57:27 +0000 wim 1931 at https://molmod.ugent.be https://molmod.ugent.be/travel/mof2012#comments Electronic modification and controlled defect introduction improve the catalytic activity of Zr-MOFs https://molmod.ugent.be/c1_c3_publications/electronic-modification-and-controlled-defect-introduction-improve-catalytic <div class="field field-name-field-a1-authors field-type-taxonomy-term-reference field-label-hidden"> <span class="field-items"> <a href="/publication-authors/f-vermoortele" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">F. Vermoortele</a>, <a href="/publication-authors/b-van-de-voorde" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">B. Van de Voorde</a>, <a href="/publication-authors/b-bueken" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">B. Bueken</a>, <a href="/publication-authors/r-ameloot" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">R. Ameloot</a>, <a href="/publication-authors/d-de-vos" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">D. De Vos</a>, <a href="/publication-authors/m-vandichel" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">M. Vandichel</a>, <a href="/publication-authors/m-waroquier" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">M. Waroquier</a>, <a href="/publication-authors/v-van-speybroeck" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">V. Van Speybroeck</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. 121</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">MOF2012</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">Edinburgh, UK</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="2012-09-16T00:00:00+02:00">Sunday, 16 September, 2012</span> to <span class="date-display-end" property="dc:date" datatype="xsd:dateTime" content="2012-09-19T00:00:00+02:00">Wednesday, 19 September, 2012</span></span></div> </div> </div> <div class="field field-name-field-abstract-private field-type-file field-label-above"> <h3><div class="field-label">Abstract (private)&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/4170.pdf" type="application/pdf; length=33799">4170.pdf</a></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/mof2012-0" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">MOF2012</a> </span> </div> Thu, 20 Sep 2012 08:34:44 +0000 mat 1461 at https://molmod.ugent.be https://molmod.ugent.be/c1_c3_publications/electronic-modification-and-controlled-defect-introduction-improve-catalytic#comments Modeling Lewis acid catalyzed reactions in MOFs: How to solve the challenges? https://molmod.ugent.be/c1_c3_publications/modeling-lewis-acid-catalyzed-reactions-mofs-how-solve-challenges <div class="field field-name-field-a1-authors field-type-taxonomy-term-reference field-label-hidden"> <span class="field-items"> <a href="/publication-authors/m-vandichel" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">M. Vandichel</a>, <a href="/publication-authors/f-vermoortele" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">F. Vermoortele</a>, <a href="/publication-authors/b-van-de-voorde" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">B. Van de Voorde</a>, <a href="/publication-authors/s-cottenie" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">S. Cottenie</a>, <a href="/publication-authors/d-de-vos" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">D. De Vos</a>, <a href="/publication-authors/m-waroquier" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">M. Waroquier</a>, <a href="/publication-authors/v-van-speybroeck" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">V. Van Speybroeck</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. 37</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">MOF2012</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">Edinburgh, UK</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="2012-09-16T00:00:00+02:00">Sunday, 16 September, 2012</span> to <span class="date-display-end" property="dc:date" datatype="xsd:dateTime" content="2012-09-19T00:00:00+02:00">Wednesday, 19 September, 2012</span></span></div> </div> </div> <div class="field field-name-field-abstract-private field-type-file field-label-above"> <h3><div class="field-label">Abstract (private)&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/4183.pdf" type="application/pdf; length=33239">4183.pdf</a></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/mof2012-0" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">MOF2012</a> </span> </div> Tue, 07 Aug 2012 08:01:54 +0000 mat 1393 at https://molmod.ugent.be https://molmod.ugent.be/c1_c3_publications/modeling-lewis-acid-catalyzed-reactions-mofs-how-solve-challenges#comments