https://molmod.ugent.be/promotors/prof-dr-ir-toon-verstraelen en https://molmod.ugent.be/thesis/model-informed-training-data-curation-reactive-all-atom-potentials <div class="field field-name-field-a1-authors field-type-taxonomy-term-reference field-label-hidden"> <span class="field-items"> L. Dumortier </span> </div> <div class="field field-name-field-thesis-date field-type-date field-label-hidden"> <div class="field-items"> <div class="field-item even"><span class="date-display-single" property="dc:date" datatype="xsd:dateTime" content="2025-06-20T00:00:00+02:00">Fri, 20/06/2025</span></div> </div> </div> <div class="field field-name-field-location field-type-list-text field-label-hidden"> <div class="field-items"> <div class="field-item even">iGent tower, Technologiepark, Zwijnaarde</div> </div> </div> <div class="field field-name-field-promotoren field-type-taxonomy-term-reference field-label-inline clearfix"> <h3 class="field-label">Supervisors</h3> <span class="field-items"> <a href="/promotors/prof-dr-ir-toon-verstraelen" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">Prof. Dr. ir. Toon Verstraelen</a>, <a href="/promotors/dr-jelle-vekeman" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">dr. Jelle Vekeman</a>, <a href="/promotors/dr-theodorus-de-bruin-and-dr-beno%C3%AEt-creton" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">dr. Theodorus De Bruin and dr. Benoît Creton</a> </span> </div> <div class="field field-name-field-private-thesis-attachment field-type-file field-label-above"> <h3><div class="field-label">Attachment (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/phd-locdumortier%20%281%29.pdf" type="application/pdf; length=13997655">phd-locdumortier (1).pdf</a></span></div> </div> </div> Tue, 08 Jul 2025 11:07:39 +0000 mieke 6430 at https://molmod.ugent.be https://molmod.ugent.be/thesis/model-informed-training-data-curation-reactive-all-atom-potentials#comments https://molmod.ugent.be/thesis/development-and-applications-frequency-dependent-polarizable-force-field-acks2%CF%89 <div class="field field-name-field-a1-authors field-type-taxonomy-term-reference field-label-hidden"> <span class="field-items"> Y.X. Cheng </span> </div> <div class="field field-name-field-thesis-date field-type-date field-label-hidden"> <div class="field-items"> <div class="field-item even"><span class="date-display-single" property="dc:date" datatype="xsd:dateTime" content="2023-11-13T00:00:00+01:00">Mon, 13/11/2023</span></div> </div> </div> <div class="field field-name-field-location field-type-list-text field-label-hidden"> <div class="field-items"> <div class="field-item even">Campus Sterre S2 Krijgslaan 281, 9000 Gent</div> </div> </div> <div class="field field-name-field-lib-link field-type-text field-label-hidden"> <div class="field-items"> <div class="field-item even"><div class="tex2jax"><p><a href="https://biblio.ugent.be/publication/01HFBGCC96FYEQW0FVQBK4W101">https://biblio.ugent.be/publication/01HFBGCC96FYEQW0FVQBK4W101</a></p> </div></div> </div> </div> <div class="field field-name-field-promotoren field-type-taxonomy-term-reference field-label-inline clearfix"> <h3 class="field-label">Supervisors</h3> <span class="field-items"> <a href="/promotors/prof-dr-ir-toon-verstraelen" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">Prof. Dr. ir. Toon Verstraelen</a> </span> </div> <div class="field field-name-field-private-thesis-attachment field-type-file field-label-above"> <h3><div class="field-label">Attachment (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/Final%20PhD_YingXing%20Cheng.pdf" type="application/pdf; length=10601492">Final PhD_YingXing Cheng.pdf</a></span></div> </div> </div> Thu, 16 Nov 2023 07:58:31 +0000 leen 6204 at https://molmod.ugent.be https://molmod.ugent.be/thesis/development-and-applications-frequency-dependent-polarizable-force-field-acks2%CF%89#comments https://molmod.ugent.be/thesis/accurate-description-phase-transitions-flexible-materials-using-transferable-machine-learning <div class="field field-name-field-a1-authors field-type-taxonomy-term-reference field-label-hidden"> <span class="field-items"> S. DeKeyser </span> </div> <div class="field field-name-field-courses field-type-list-text field-label-hidden"> <div class="field-items"> <div class="field-item even">Master of Science in Engineering Physics</div> </div> </div> <div class="field field-name-field-master-year field-type-date field-label-hidden"> <div class="field-items"> <div class="field-item even"><span class="date-display-single" property="dc:date" datatype="xsd:dateTime" content="2022-01-01T00:00:00+01:00">2022</span></div> </div> </div> <div class="field field-name-field-location field-type-list-text field-label-hidden"> <div class="field-items"> <div class="field-item even">UGain (building 60, Magnel), Technologiepark, Zwijnaarde</div> </div> </div> <div class="field field-name-field-promotoren field-type-taxonomy-term-reference field-label-inline clearfix"> <h3 class="field-label">Supervisors</h3> <span class="field-items"> <a href="/promotors/prof-dr-ir-veronique-van-speybroeck" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">Prof. Dr. ir. Veronique Van Speybroeck</a>, <a href="/promotors/prof-dr-ir-toon-verstraelen" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">Prof. Dr. ir. Toon Verstraelen</a> </span> </div> Mon, 14 Mar 2022 10:04:29 +0000 leen 5881 at https://molmod.ugent.be https://molmod.ugent.be/thesis/accurate-description-phase-transitions-flexible-materials-using-transferable-machine-learning#comments https://molmod.ugent.be/thesis/beyond-tree-tensor-networks-quantum-many-body-physics <div class="field field-name-field-a1-authors field-type-taxonomy-term-reference field-label-hidden"> <span class="field-items"> J. Van Bever </span> </div> <div class="field field-name-field-courses field-type-list-text field-label-hidden"> <div class="field-items"> <div class="field-item even">Master of Science in Physics and Astronomy</div> </div> </div> <div class="field field-name-field-master-year field-type-date field-label-hidden"> <div class="field-items"> <div class="field-item even"><span class="date-display-single" property="dc:date" datatype="xsd:dateTime" content="2019-01-01T00:00:00+01:00">2019</span></div> </div> </div> <div class="field field-name-field-promotoren field-type-taxonomy-term-reference field-label-inline clearfix"> <h3 class="field-label">Supervisors</h3> <span class="field-items"> <a href="/promotors/prof-dr-dimitri-van-neck" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">Prof. Dr. Dimitri Van Neck</a>, <a href="/promotors/prof-dr-ir-toon-verstraelen" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">Prof. Dr. ir. Toon Verstraelen</a> </span> </div> Tue, 14 Jan 2020 15:31:19 +0000 samuel 5506 at https://molmod.ugent.be https://molmod.ugent.be/thesis/beyond-tree-tensor-networks-quantum-many-body-physics#comments https://molmod.ugent.be/thesis/chemical-bonds-crystals-machine-learning-view-0 <div class="field field-name-field-a1-authors field-type-taxonomy-term-reference field-label-hidden"> <span class="field-items"> Y. Degeyter </span> </div> <div class="field field-name-field-courses field-type-list-text field-label-hidden"> <div class="field-items"> <div class="field-item even">Master of Science in Engineering Physics</div> </div> </div> <div class="field field-name-field-master-year field-type-date field-label-hidden"> <div class="field-items"> <div class="field-item even"><span class="date-display-single" property="dc:date" datatype="xsd:dateTime" content="2021-01-01T00:00:00+01:00">2021</span></div> </div> </div> <div class="field field-name-field-promotoren field-type-taxonomy-term-reference field-label-inline clearfix"> <h3 class="field-label">Supervisors</h3> <span class="field-items"> <a href="/promotors/prof-dr-stefaan-cottenier" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">Prof. Dr. Stefaan Cottenier</a>, <a href="/promotors/prof-dr-ir-toon-verstraelen" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">Prof. Dr. ir. Toon Verstraelen</a> </span> </div> Tue, 14 Jan 2020 15:27:58 +0000 samuel 5504 at https://molmod.ugent.be https://molmod.ugent.be/thesis/chemical-bonds-crystals-machine-learning-view-0#comments https://molmod.ugent.be/thesis/chemical-bonds-crystals-machine-learning-view <div class="field field-name-field-a1-authors field-type-taxonomy-term-reference field-label-hidden"> <span class="field-items"> F. Keutgens </span> </div> <div class="field field-name-field-courses field-type-list-text field-label-hidden"> <div class="field-items"> <div class="field-item even">Master of Science in Engineering Physics</div> </div> </div> <div class="field field-name-field-master-year field-type-date field-label-hidden"> <div class="field-items"> <div class="field-item even"><span class="date-display-single" property="dc:date" datatype="xsd:dateTime" content="2020-01-01T00:00:00+01:00">2020</span></div> </div> </div> <div class="field field-name-field-promotoren field-type-taxonomy-term-reference field-label-inline clearfix"> <h3 class="field-label">Supervisors</h3> <span class="field-items"> <a href="/promotors/prof-dr-stefaan-cottenier" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">Prof. Dr. Stefaan Cottenier</a>, <a href="/promotors/prof-dr-ir-toon-verstraelen" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">Prof. Dr. ir. Toon Verstraelen</a> </span> </div> Mon, 05 Aug 2019 06:40:54 +0000 wim 5423 at https://molmod.ugent.be https://molmod.ugent.be/thesis/chemical-bonds-crystals-machine-learning-view#comments https://molmod.ugent.be/thesis/boosting-discovery-rate-energy-materials-using-deep-learning <div class="field field-name-field-a1-authors field-type-taxonomy-term-reference field-label-hidden"> <span class="field-items"> J. De Witte </span> </div> <div class="field field-name-field-courses field-type-list-text field-label-hidden"> <div class="field-items"> <div class="field-item even">Master of Science in Engineering Physics</div> </div> </div> <div class="field field-name-field-master-year field-type-date field-label-hidden"> <div class="field-items"> <div class="field-item even"><span class="date-display-single" property="dc:date" datatype="xsd:dateTime" content="2020-01-01T00:00:00+01:00">2020</span></div> </div> </div> <div class="field field-name-field-promotoren field-type-taxonomy-term-reference field-label-inline clearfix"> <h3 class="field-label">Supervisors</h3> <span class="field-items"> <a href="/promotors/prof-dr-stefaan-cottenier" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">Prof. Dr. Stefaan Cottenier</a>, <a href="/promotors/prof-dr-ir-toon-verstraelen" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">Prof. Dr. ir. Toon Verstraelen</a> </span> </div> Mon, 05 Aug 2019 06:38:35 +0000 wim 5422 at https://molmod.ugent.be https://molmod.ugent.be/thesis/boosting-discovery-rate-energy-materials-using-deep-learning#comments https://molmod.ugent.be/thesis/understanding-noncovalent-interactions-force-fields-through-quantum-mechanics-application-gas <div class="field field-name-field-a1-authors field-type-taxonomy-term-reference field-label-hidden"> <span class="field-items"> S. Vandenbrande </span> </div> <div class="field field-name-field-thesis-date field-type-date field-label-hidden"> <div class="field-items"> <div class="field-item even"><span class="date-display-single" property="dc:date" datatype="xsd:dateTime" content="2019-05-08T00:00:00+02:00">Wed, 08/05/2019</span></div> </div> </div> <div class="field field-name-field-location field-type-list-text field-label-hidden"> <div class="field-items"> <div class="field-item even">Faculty of Engineering and Architecture, Jozef Plateaustraat, Ghent</div> </div> </div> <div class="field field-name-field-lib-link field-type-text field-label-hidden"> <div class="field-items"> <div class="field-item even"><div class="tex2jax"><p><a href="https://biblio.ugent.be/publication/8615972">https://biblio.ugent.be/publication/8615972</a></p> </div></div> </div> </div> <div class="field field-name-field-promotoren field-type-taxonomy-term-reference field-label-inline clearfix"> <h3 class="field-label">Supervisors</h3> <span class="field-items"> <a href="/promotors/prof-dr-ir-veronique-van-speybroeck" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">Prof. Dr. ir. Veronique Van Speybroeck</a>, <a href="/promotors/prof-dr-ir-toon-verstraelen" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">Prof. Dr. ir. Toon Verstraelen</a> </span> </div> <div class="field field-name-field-private-thesis-attachment field-type-file field-label-above"> <h3><div class="field-label">Attachment (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/PhD_Dissertation_StevenVandenbrande.pdf" type="application/pdf; length=19317269">PhD_Dissertation_StevenVandenbrande.pdf</a></span></div> </div> </div> Thu, 02 May 2019 10:11:27 +0000 leen 5358 at https://molmod.ugent.be https://molmod.ugent.be/thesis/understanding-noncovalent-interactions-force-fields-through-quantum-mechanics-application-gas#comments https://molmod.ugent.be/thesis/variational-information-theoretic-atoms-molecules <div class="field field-name-field-a1-authors field-type-taxonomy-term-reference field-label-hidden"> <span class="field-items"> F. Heidar-Zadeh </span> </div> <div class="field field-name-field-thesis-date field-type-date field-label-hidden"> <div class="field-items"> <div class="field-item even"><span class="date-display-single" property="dc:date" datatype="xsd:dateTime" content="2017-07-07T00:00:00+02:00">Fri, 07/07/2017</span></div> </div> </div> <div class="field field-name-field-lib-link field-type-text field-label-hidden"> <div class="field-items"> <div class="field-item even"><div class="tex2jax"><p><a href="http://hdl.handle.net/1854/LU-8531565">http://hdl.handle.net/1854/LU-8531565</a></p> </div></div> </div> </div> <div class="field field-name-field-promotoren field-type-taxonomy-term-reference field-label-inline clearfix"> <h3 class="field-label">Supervisors</h3> <span class="field-items"> <a href="/promotors/prof-dr-paul-w-ayers" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">Prof. Dr. Paul W. Ayers</a>, <a href="/promotors/prof-dr-patrick-bultinck" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">Prof. Dr. Patrick Bultinck</a>, <a href="/promotors/prof-dr-ir-toon-verstraelen" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">Prof. Dr. ir. Toon Verstraelen</a> </span> </div> Wed, 28 Nov 2018 07:27:15 +0000 wim 5254 at https://molmod.ugent.be https://molmod.ugent.be/thesis/variational-information-theoretic-atoms-molecules#comments https://molmod.ugent.be/thesis/development-hybrid-mcmd-schemes-model-adsorption-guest-molecules-flexible-metal-organic <div class="field field-name-field-a1-authors field-type-taxonomy-term-reference field-label-hidden"> <span class="field-items"> R. Goeminne </span> </div> <div class="field field-name-field-courses field-type-list-text field-label-hidden"> <div class="field-items"> <div class="field-item even">Master of Science in Engineering Physics</div> </div> </div> <div class="field field-name-field-master-year field-type-date field-label-hidden"> <div class="field-items"> <div class="field-item even"><span class="date-display-single" property="dc:date" datatype="xsd:dateTime" content="2018-01-01T00:00:00+01:00">2018</span></div> </div> </div> <div class="field field-name-field-promotoren field-type-taxonomy-term-reference field-label-inline clearfix"> <h3 class="field-label">Supervisors</h3> <span class="field-items"> <a href="/promotors/prof-dr-ir-veronique-van-speybroeck" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">Prof. Dr. ir. Veronique Van Speybroeck</a>, <a href="/promotors/prof-dr-ir-toon-verstraelen" typeof="skos:Concept" property="rdfs:label skos:prefLabel" datatype="">Prof. Dr. ir. Toon Verstraelen</a> </span> </div> Tue, 03 Oct 2017 13:12:43 +0000 wim 4932 at https://molmod.ugent.be https://molmod.ugent.be/thesis/development-hybrid-mcmd-schemes-model-adsorption-guest-molecules-flexible-metal-organic#comments