Onderzoeker
Tom Bettens
- Trefwoorden:Scheikunde
Affiliaties
- Scheikunde (Departement)
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Vanaf1 okt 2021 → 31 jan 2022 - Scheikunde (Departement)
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Vanaf1 okt 2021 → 31 jan 2022 - Scheikunde (Departement)
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Vanaf8 apr 2019 → 30 sep 2021 - Scheikunde (Departement)
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Vanaf1 okt 2017 → 31 jan 2022 - Faculteit van de Wetenschappen (Faculteit)
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Vanaf24 sep 2017 → 13 dec 2021 - Algemene Chemie (Onderzoeksgroep)
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Vanaf3 sep 2015 → 1 nov 2022 - Faculteit van de Wetenschappen (Faculteit)
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Vanaf3 sep 2015 → 14 sep 2017
Publicaties
1 - 9 van 9
- A Quantum Chemical Deep-Dive into the π-π Interactions of 3-Methylindole and Its Halogenated Derivatives—Towards an Improved Ligand Design and Tryptophan Stacking(2022)
Auteurs: Ruben Van Lommel, Tom Bettens, Thomas Barlow, Jolien Bertouille, Steven Ballet, Frank De Proft
- Conceptual density functional theory under pressure(2022)
Auteurs: Jochen Eeckhoudt, Mercedes Alonso Giner, Frank De Proft, Paul Geerlings, Tom Bettens, Bo Chen, Roberto Cammi
Pagina's: 9329-9350 - Towards the understanding of halogenation in peptide hydrogels: a quantum chemical approach(2021)
Auteurs: Tom Bettens, Valentin Lacanau, Ruben Van Lommel, De Maeseneer Tess, Wouter René Vandeplassche, Jolien Bertouille, Joost Brancart, Thomas Barlow, Tatiana Marianne Woller, Niko Van den Brande, et al.
Pagina's: 4792-4803 - Designing Force Probes Based on Reversible 6π-Electrocyclizations in Polyenes Using Quantum Chemical Calculations(2021)
Auteurs: Tom Bettens, Jochen Eeckhoudt, Marvin Hoffmann, Mercedes Alonso Giner, Paul Geerlings, Andreas Dreuw, Frank De Proft
Pagina's: 7477-7489 - Mechanochemically Triggered Topology Changes in Expanded Porphyrins(2021)
Auteurs: Tom Bettens, Marvin Hoffmann, Mercedes Alonso Giner, Paul Geerlings, Andreas Dreuw, Frank De Proft
Pagina's: 3397-3406 - Quantum chemical modeling of mechanochemical reactivity(2021)
Auteurs: Tom Bettens, Frank De Proft, Mercedes Alonso Giner, Paul Geerlings
Aantal pagina's: 286 - Ambident Nucleophilic Substitution: Understanding Non‐HSAB Behavior through Activation Strain and Conceptual DFT Analyses(2020)
Auteurs: Tom Bettens, Mercedes Alonso Giner, Frank De Proft, Trevor A. Hamlin, F. Matthias Bickelhaupt
Pagina's: 3884–3893 - The hunt for reactive alkynes in bio-orthogonal click reactions: insights from mechanochemical and conceptual DFT calculations(2020)
Auteurs: Tom Bettens, Mercedes Alonso Giner, Frank De Proft, Paul Geerlings
Pagina's: 1431-1439 - Implementing the mechanical force into the conceptual DFT framework: understanding and predicting molecular mechanochemical properties(2019)
Auteurs: Tom Bettens, Mercedes Alonso Giner, Paul Geerlings, Frank De Proft
Pagina's: 7378-7388