Jelle Vekeman

FWO postdoc (WE05)
Jelle.Vekeman@UGent.be
+32 (0)9 264 65 60
​​​​​Tech Lane Ghent Science Park, Campus Ardoyen
Technologiepark 46, 9052 Zwijnaarde, Belgium
Office n°028

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A1 Publications

Published

2023

Elucidating the Impact of Chemical Variability on the Nano-Structure of Fe-Rich Slags , C. Siakati, J. Vekeman, F. Tielens, D. Seveno, Y. Pontikes , Journal of Non-Crystalline Solids , 618, 122541 , 2023 , IF: 3.5 , Q1
A Molecular Understanding of Citrate Adsorption on Calcium Oxalate Polyhydrates , Y. Su, J. Vekeman, F. Siro Brigiano, E. P. Hessou, Y. Zhao, D. Sorgeloos, M. Raes, T. Hauffman, K. Li, F. Tielens , Physical Chemistry Chemical Physics (PCCP) , 25, 12148-12156 , 2023 , IF: 3.945 , Q1
Development of Accurate Potentials for the Physisorption of Water on Graphene , J. Vekeman, I. García Cuesta, N. Faginas-Lago, J. Sánchez-Marín, A. Sánchez de Merás , The Journal of Chemical Physics , 158, 024104 , 2023 , IF: 4.304

2022

Synergistic Effects in the Activity of Nano-Transition-Metal clusters Pt12M (M = Ir, Ru or Rh) for NO dissociation , J. Vekeman, Q. Wang, X. Deraet, D. Bazin, F. De Proft, H. Guesmi, F. Tielens , ChemPhysChem , 23, 21, e202200740 , 2022 , IF: 3.151
A Sustainable Way of Recycling Polyamides: Dissolution and Ammonolysis of Polyamides to Diamines and Diamides Using Ammonia and Biosourced Glycerol , W. Stuyck, K. Janssens, M. Denayer, F. De Schouwer, R. Coeck, K.V. Bernaerts, J. Vekeman, F. De Proft , Green Chemistry , 24, 6923-6930 , 2022 , IF: 11.034
Nanostructured Materials and Heterogeneous Catalysis: A Succint Review Regarding DeNox Catalysis , D. Bazin, J. Vekeman, Q. Wang, X. Deraet, F. De Proft, H. Guesmi, F. Tielens , Comptes Rendus. Chimie , 25, S3, 163 , 2022 , IF: 3.117

Non CMM publications (A1)

Towards a Predictive Model for Polymer Solubility Using the Noncovalent Interaction Index: Polyethylene as a Case Study , M. Denayer, J. Vekeman, F. Tielens, F. De Proft , Physical Chemistry Chemical Physics (PCCP) , 23, 25374-25387 , 2021 , 3.676
Study on the biological behaviors of Ca-P coatings with different morphology on carbon/carbon composites , Y. Su, K. Li, J. Vekeman, E. P. Hessou, F. Tielens, J. Wang , Materials Science and Engineering C , 129, October 2021, 112391 , 2021 , 7.328 , 7/40
Grand Canonical Monte Carlo Simulations to Determine the Optimal Interlayer Distance of a Graphene Slit-Shaped Pore for Adsorption of Methane, Hydrogen and their Equimolar Mixture , J. Vekeman, D. Bahamon, I. García Cuesta, N. Faginas-Lago, J. Sánchez-Marín, A. Sánchez de Merás, L.F. Vega , Nanomaterials , 11, 10, 2534 , 2021 , 5.076
Lanthanum Carbonate to Control Plasma and Urinary Oxalate Level in Type 1 Primary Hyperoxaluria? , A. Pozdzik, C. David, J. Vekeman, F. Tielens, M. Daudon , International Journal of Urology Case Reports , 4, 4, 235-238 , 2021 , 3.369 , Q2
In Search of an efficient Complexing Agent for Oxalates and Phosphates: A Quantum Chemical Study , J. Vekeman, J. Torres, C.E. David, E. Van de Perre, K.M. Wissing, E. Letavernier, D. Bazin, M. Daudon, A. Pozdzik, F. Tielens , Nanomaterials , 11, 7, 1763 , 2021 , 5.076 , 35/160 [Q1]
Opportunities Given by Density Functional Theory in Pathological Calcifications , F. Tielens, J. Vekeman, D. Bazin, M. Daudon , Comptes Rendus. Chimie , 24, S2, 1-10 , 2021 , 2.223 , Q3
Morphology of Calcium Oxalate Polyhydrates: A Quantum Chemical and Computational Study , T. Debroise, T. Sedzik, J. Vekeman, Y. Su, C. Bonhomme, F. Tielens , Crystal Growth & Design , 20,6,3807-3815 , 2020 , 4.153
Modeling of Complex Interaces: From Surface Chemistry to Nano Chemistry , J. Vekeman, F. Tielens , Nanomaterials , 10,3,540 , 2020 , 4.034
A Subtle Balance Between Interchain Interactions and Surface Reconstruction at the origin of the Alkylthiol/Au (111) Self-Assembled Monolayer Geometry , A.-J. Truyens, J. Vekeman, F. Tielens , Surface Science , 121597 , 2020 , 1.849
Unravelling Phosphate Adsorption on Hydrous Ferric Oxide Surfaces at the Molecular Level , Y. Weng, J. Vekeman, H. Zhang, L. Chou, M. Elskens, F. Tielens , Chemosphere , 261,127776 , 2020 , 5.778
One Step Further in the Elucidation of the Crystallographic Structure of Whitlockite , T. Debroise, E. Colombo, G. Belletti, J. Vekeman, Y. Su, R. Papoular, N. S. Hwang, D. Bazin, M. Daudon, P. Quaino, F. Tielens , Crystal Growth & Design , 20,4,2553-2561 , 2019 , 4.153
Flexibility in the Graphene Sheet: The Influence on Gas Adsorption from Molecular Dynamics Studies , J. Vekeman, J. Sánchez-Marín, A. Sánchez de Merás, I. García Cuesta, N. Fagina , The Journal of Physical Chemistry C , 123,46,28035-28047 , 2019 , 4.189
Molecular Dynamics of CH4/N2 Mixtures on a Flexible Graphene Layer: Adsorption and Selectivity Case Study , J. Vekeman, N. Faginas-Lago, A. Lombardi, A. Sánchez, I. García Cuesta, M. Rosi , Frontiers in Chemistry , 7,386 , 2019 , 3.420
Potential Models for the Simulation of Methane Adsorption on Graphene: Development and CCSD(T) Benchmarks , J. Vekeman, I.G. Cuesta, N. Faginas-Lago, J. Wilson, J. Sánchez-Marín, A. Sánchez de Merás , Physical Chemistry Chemical Physics (PCCP) , 20,39,25518-25530 , 2018 , 3.567
Modeling the Interaction of Carbon Monoxide with Flexible Graphene: From Coupled Cluster Calculations to Molecular Dynamics Studies , J. Wilson, N. Faginas-Lago, J. Vekeman, I.G. Cuesta, J. Sánchez-Marín, A. Sánchez de Merás , ChemPhysChem , 19,6,774-783 , 2018 , 3.144

Other Publications

A2 publications

2022

Rules All PIs Should Follow , J.S. Chen, C.Y. Huang, S. Lanke, M.S. Fernandopulle, Y. Ji, Y. Zhi, S.G. Rodríguez, A.Y. Frommel, M. Lukacisin, Y. Zhang, C.N. Zdenek, X.-Y. Wu, S. Seenuvasaragavan, Y. Zhuang, C. Bergh, J. Coulbois, S. Salloum-Asfar, B. Cao, K. Davis, F. Oda, N. Konstantinides, L. Zhang, D. Agarwal, J.N. Rainaldi, J. Kadlec, J. Vekeman, V.A. Kanicherla, K. Oi, K.J. Isaacson, R. Ganji, E. Dawson-Glass , Science , 376, 6588, 24-26 , 2022 , 47.73

P1 publications

2018

Nitrogen Gas on Graphene , J. Vekeman, N. Faginas-Lago, I.G. Cuesta, J. Sánchez-Marín, A. Sánchez de Merás , International Conference on Computational Science and its Applications , 563-578 , 2018

Keynote / Plenary / Invited talks

Talks

Posters

2018

Nitrogen Gas on Graphene , J. Vekeman, N. Faginas-Lago, I.G. Cuesta, J. Sánchez-Marín, A. Sánchez de Merás , International Conference on Computational Science and its Applications , 563-578 , 2018

Funding