Ghent University Academic Bibliography

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Total revalorization of high impact polystyrene (HIPS) : enhancing styrene recovery and upcycling of the rubber phase

Nikolaos S. Giakoumakis, Christophe Vos, Kwinten Janssens, Jelle Vekeman (UGent) , Mats Denayer, Frank De Proft, Carlos Marquez and Dirk De Vos

(2024) GREEN CHEMISTRY. 26(1). p.340-352
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The electrophilic aromatic bromination of benzenes : mechanistic and regioselective insights from density functional theory

Xavier Deraet, Eline Desmedt, Ruben Van Lommel, Veronique Van Speybroeck (UGent) and Frank De Proft (UGent)

(2023) PHYSICAL CHEMISTRY CHEMICAL PHYSICS. 25(42). p.28581-28594
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The halogen bond in weakly bonded complexes and the consequences for aromaticity and spin-orbit coupling

Ana V. Cunha, Remco Havenith (UGent) , Jari van Gog, Freija De Vleeschouwer, Frank De Proft and Wouter Herrebout

(2023) MOLECULES. 28(2).
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Mechanistic characterization of zeolite-catalyzed aromatic electrophilic substitution at realistic operating conditions

Massimo Bocus (UGent) , Louis Vanduyfhuys (UGent) , Frank De Proft, Bert M. Weckhuysen and Veronique Van Speybroeck (UGent)

(2022) JACS AU. 2(2). p.502-514
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Nanostructured materials and heterogeneous catalysis : a succinct review regarding DeNox catalysis

Dominique Bazin, Jelle Vekeman (UGent) , Qing Wang, Xavier Deraet, Frank De Proft, Hazar Guesmi and Frederik Tielens

(2022) COMPTES RENDUS CHIMIE. 25. p.237-244
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Synergistic effects in the activity of nano‐transition‐metal clusters Pt12M (M=Ir, Ru or Rh) for NO dissociation

Jelle Vekeman (UGent) , Qing Wang, Xavier Deraet, Dominique Bazin, Frank De Proft, Hazar Guesmi and Frederik Tielens

(2022) CHEMPHYSCHEM. 23(21).
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A sustainable way of recycling polyamides : dissolution and ammonolysis of polyamides to diamines and diamides using ammonia and biosourced glycerol

Wouter Stuyck, Kwinten Janssens, Mats Denayer, Free De Schouwer, Robin Coeck, Katrien V. Bernaerts, Jelle Vekeman (UGent) , Frank De Proft and Dirk E. De Vos

(2022) GREEN CHEMISTRY. 24(18). p.6923-6930
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Towards a predictive model for polymer solubility using the noncovalent interaction index: polyethylene as a case study

Mats Denayer, Jelle Vekeman (UGent) , Frederik Tielens and Frank De Proft

(2021) PHYSICAL CHEMISTRY CHEMICAL PHYSICS. 23(44). p.25374-25387
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Reactivity of single transition metal atoms on a hydroxylated amorphous silica surface : a periodic conceptual DFT investigation

Xavier Deraet, Jan Turek, Mercedes Alonso, Frederik Tielens, Stefaan Cottenier (UGent) , Paul W. Ayers, Bert M. Weckhuysen and Frank De Proft

(2021) CHEMISTRY-A EUROPEAN JOURNAL. 27(19). p.6050-6063
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Towards the understanding of halogenation in peptide hydrogels : a quantum chemical approach

Tom Bettens, Valentin Lacanau, Ruben Van Lommel, Tess De Maeseneer, Wouter Vandeplassche, Jolien Bertouille, Joost Brancart, Thomas M. A. Barlow, Tatiana Woller, Niko Van den Brande, et al.

(2021) MATERIALS ADVANCES. 2(14). p.4792-4803

Academic Bibliography

Total revalorization of high impact polystyrene (HIPS) : enhancing styrene recovery and upcycling of the rubber phase

The electrophilic aromatic bromination of benzenes : mechanistic and regioselective insights from density functional theory

The halogen bond in weakly bonded complexes and the consequences for aromaticity and spin-orbit coupling

Mechanistic characterization of zeolite-catalyzed aromatic electrophilic substitution at realistic operating conditions

Nanostructured materials and heterogeneous catalysis : a succinct review regarding DeNox catalysis

Synergistic effects in the activity of nano‐transition‐metal clusters Pt12M (M=Ir, Ru or Rh) for NO dissociation

A sustainable way of recycling polyamides : dissolution and ammonolysis of polyamides to diamines and diamides using ammonia and biosourced glycerol

Towards a predictive model for polymer solubility using the noncovalent interaction index: polyethylene as a case study

Reactivity of single transition metal atoms on a hydroxylated amorphous silica surface : a periodic conceptual DFT investigation

Towards the understanding of halogenation in peptide hydrogels : a quantum chemical approach

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