Ghent University Academic Bibliography

Journal Article
A1
open access

Ab initio predictions of adsorption in flexible metal-organic frameworks for water harvesting applications

Ruben Goeminne (UGent) and Veronique Van Speybroeck (UGent)

(2025) JOURNAL OF THE AMERICAN CHEMICAL SOCIETY. 147(4). p.3615-3630

Confined hot-pressurized water in Brønsted-acidic beta zeolite speeds up the O demethylation of guaiacol

Massimo Bocus (UGent) , Elias Van Den Broeck (UGent) , Xian Wu, Mathias Bal, Jeroen Bomon, Louis Vanduyfhuys (UGent) , Bert F. Sels, Bert U. W. Maes and Veronique Van Speybroeck (UGent)

(2025) NATURE CATALYSIS. 8. p.33-45

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Transforming 2D imine into 3D thiazole covalent organic frameworks by conjugated connectors : fully conjugated photocatalysts

maojun deng (UGent) , Jeet Chakraborty (UGent) , Guizhen Wang, Kuber Singh Rawat (UGent) , Laurens Bourda (UGent) , Jiamin Sun, Ipsita Nath (UGent) , Yanwei Ji (UGent) , Pieter Geiregat (UGent) , Veronique Van Speybroeck (UGent) , et al.

(2025) JOURNAL OF THE AMERICAN CHEMICAL SOCIETY. 147(12). p.10219-10230

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Journal Article
A1
open access

MIL-91(Al) to boost solid-solid conversion reactions in Li-Se batteries

Tutku Mutlu-Cetinkaya, Pieter Dobbelaere (UGent) , Wim Temmerman (UGent) , Wenqing Lu, Vanessa Pimenta, Veronique Van Speybroeck (UGent) and Rezan Demir-Cakan

(2025) ENERGY & ENVIRONMENTAL MATERIALS.

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Journal Article
A1
open access

The operando nature of isobutene adsorbed in Zeolite H‐SSZ‐13 unraveled by machine learning potentials beyond DFT accuracy

Massimo Bocus (UGent) , Sander Vandenhaute (UGent) and Veronique Van Speybroeck (UGent)

(2025) ANGEWANDTE CHEMIE-INTERNATIONAL EDITION. 64(1).

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Journal Article
A1
open access

Mesoporous acridinium-based covalent organic framework for long-lived charge-separated exciton mediated photocatalytic [4+2] annulation

Ipsita Nath (UGent) , Jeet Chakraborty (UGent) , Kuber Singh Rawat (UGent) , Yanwei Ji (UGent) , Rundong Wang (UGent) , Korneel Molkens (UGent) , Nathalie De Geyter (UGent) , Rino Morent (UGent) , Veronique Van Speybroeck (UGent) , Pieter Geiregat (UGent) , et al.

(2025) ADVANCED MATERIALS. 37(1).

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Journal Article
A1
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Totally conjugated and coplanar covalent organic frameworks as photocatalysts for water purification : reduction of Cr (VI) while oxidizing water borne organic pollutants

Linyang Wang (UGent) , Jeet Chakraborty (UGent) , Kuber Singh Rawat (UGent) , maojun deng (UGent) , Jiamin Sun, Yifan Wang, Veronique Van Speybroeck (UGent) and Pascal Van Der Voort (UGent)

(2025) SEPARATION AND PURIFICATION TECHNOLOGY. 359.

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Increasing the phase stability of CsPbI3 nanocrystals by Zn2+ and Cd2+ addition : synergy of transmission electron microscopy and molecular dynamics

Irina Skvortsova, Tom Braeckevelt (UGent) , Annick De Backer, Nadine Schrenker, Bapi Pradhan, Johan Hofkens, Sandra Van Aert, Veronique Van Speybroeck (UGent) and Sara Bals

(2025) ACS NANO. 19(18). p.17698-17708

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Book Chapter

Theoretical understanding and insights on flexible metal–organic frameworks

Louis Vanduyfhuys (UGent) , M. Wahiduzzaman, Sven Rogge (UGent) , G. Maurin and Veronique Van Speybroeck (UGent)

(2024) Flexible metal–organic frameworks : structural design, synthesis and properties. In Inorganic materials 13. p.231-303

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Computational protocol for the spectral assignment of NMR resonances in covalent organic frameworks

Siebe Vanlommel (UGent) , Sander Borgmans (UGent) , C. Vinod Chandran, Sambhu Radhakrishnan, Pascal Van Der Voort (UGent) , Eric Breynaert and Veronique Van Speybroeck (UGent)

(2024) JOURNAL OF CHEMICAL THEORY AND COMPUTATION. 20(9). p.3823-3838

Academic Bibliography

Ab initio predictions of adsorption in flexible metal-organic frameworks for water harvesting applications

Confined hot-pressurized water in Brønsted-acidic beta zeolite speeds up the O demethylation of guaiacol

Transforming 2D imine into 3D thiazole covalent organic frameworks by conjugated connectors : fully conjugated photocatalysts

MIL-91(Al) to boost solid-solid conversion reactions in Li-Se batteries

The operando nature of isobutene adsorbed in Zeolite H‐SSZ‐13 unraveled by machine learning potentials beyond DFT accuracy

Mesoporous acridinium-based covalent organic framework for long-lived charge-separated exciton mediated photocatalytic [4+2] annulation

Totally conjugated and coplanar covalent organic frameworks as photocatalysts for water purification : reduction of Cr (VI) while oxidizing water borne organic pollutants

Increasing the phase stability of CsPbI3 nanocrystals by Zn2+ and Cd2+ addition : synergy of transmission electron microscopy and molecular dynamics

Theoretical understanding and insights on flexible metal–organic frameworks

Computational protocol for the spectral assignment of NMR resonances in covalent organic frameworks

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