Ghent University Academic Bibliography

Surface chemistry as main governing factor in the adsorption of acetaminophen, doxycycline hyclate, and tetracycline on fish and shrimp waste-derived hydrochars

Tatwadhika Rangin Siddhartha (UGent) , Frederik Ronsse (UGent) and Philippe Heynderickx (UGent)

(2026) CLEAN TECHNOLOGIES AND ENVIRONMENTAL POLICY. 28(8).

Journal Article
A1
open access

Solvent switch strategy to facilitate the downstream process of chemical recycling of plastics

Emelin Yhoany Luna Barrios (UGent) , Ion Olazabal, Tobias De Somer (UGent) , Pieter Nachtergaele (UGent) , Xabier Lopez, Marta Ximenis, Steven De Meester (UGent) and Haritz Sardon

(2026) RESOURCES CONSERVATION AND RECYCLING. 226.

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Journal Article
A1
open access

Semi-empirical evaluation of hindered internal rotors for accelerated thermodynamics predictions

Lowie Tomme (UGent) , Jeroen Aerssens (UGent) , Istvan Lengyel (UGent) , Maarten Sabbe (UGent) , Maarten Dobbelaere (UGent) , Christian Stevens (UGent) and Kevin Van Geem (UGent)

(2026) JOURNAL OF PHYSICAL CHEMISTRY A. 130(10). p.2158-2168

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Journal Article
A2
open access

Computational modeling of the mobility, stability, and al positioning ability of cyclic cationic organic structure-directing agents in AEI Zeolite

Pau Ferri (UGent) , Pieter Cnudde (UGent) , Manuel Moliner, Veronique Van Speybroeck (UGent) and Mercedes Boronat

(2025) JACS AU. 5(3). p.1471-1481

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A1
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The adsorption/photocatalytic degradation kinetics of oxygen vacancy-enriched ZnO in relation to surface functional groups of cationic/anionic dyes

Alireza Ranjbari (UGent) , Alireza Pourvahabi Anbari (UGent) , Muhammad Kashif (UGent) , Keshab K. Adhikary (UGent) , Ki-Hyun Kim and Philippe Heynderickx (UGent)

(2025) CHEMICAL ENGINEERING JOURNAL. 505.

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A1
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Multiscale analysis of the M1 MoVNbTeO catalyst for ethylene production via selective ethane oxidation : from atomistic calculations to the industrial reactor

José G. Rivera, Martin Purino (UGent) , José F. Durán, Carlos Alvarado Camacho, Alberto Hernandez, Maarten Sabbe (UGent) and Carlos O. Castillo-Araiza

(2025) CHEMICAL ENGINEERING JOURNAL. 506.

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A1
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Managing expectations and imbalanced training data in reactive force field development : an application to water adsorption on alumina

Loïc Dumortier (UGent) , Céline Chizallet, Benoit Creton, Theodorus de Bruin and Toon Verstraelen (UGent)

(2024) JOURNAL OF CHEMICAL THEORY AND COMPUTATION. 20(9). p.3779-3797

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A1
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Construction of low-toxicity cadmium sulfide/nitrogen-doped muti-walled carbon nanotubes for peroxymonosulfate activation : the crucial role of electron transfer

Jin Qian, Sai Bai, Mengqi Geng, Dandan Zhang, Guoping Xiang, Yichu Zhang, Yangju Li, Dongdong Chu, Di Wu (UGent) , Rui Ma, et al.

(2024) ENVIRONMENTAL RESEARCH. 266.

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Journal Article
A2
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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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A1
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Density functional theory studies on ortho-position adsorption of SO3 at step sites of a CaO surface with SO2 and CO2

Lu Liu, Guangcai Shao, Peng Gong, Zhiwei Wu, Jiaming Chu, Yangang Hu, Junfeng Wang, Shuang Wang, Chenghang Zheng, Xiang Gao, et al.

(2022) FUEL. 310(Part B).

Academic Bibliography

Surface chemistry as main governing factor in the adsorption of acetaminophen, doxycycline hyclate, and tetracycline on fish and shrimp waste-derived hydrochars

Solvent switch strategy to facilitate the downstream process of chemical recycling of plastics

Semi-empirical evaluation of hindered internal rotors for accelerated thermodynamics predictions

Computational modeling of the mobility, stability, and al positioning ability of cyclic cationic organic structure-directing agents in AEI Zeolite

The adsorption/photocatalytic degradation kinetics of oxygen vacancy-enriched ZnO in relation to surface functional groups of cationic/anionic dyes

Multiscale analysis of the M1 MoVNbTeO catalyst for ethylene production via selective ethane oxidation : from atomistic calculations to the industrial reactor

Managing expectations and imbalanced training data in reactive force field development : an application to water adsorption on alumina

Construction of low-toxicity cadmium sulfide/nitrogen-doped muti-walled carbon nanotubes for peroxymonosulfate activation : the crucial role of electron transfer

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

Density functional theory studies on ortho-position adsorption of SO3 at step sites of a CaO surface with SO2 and CO2

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