Steven Vandenbrande

Ghent University — Belgium

Chemistry · Physical Sciences

18h-index1.8kcitations29works0.02yr avg
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Research Topics

Metal-Organic Frameworks: Synthesis and Applications(10), Machine Learning in Materials Science(6), Advanced Chemical Physics Studies(5), Zeolite Catalysis and Synthesis(5), X-ray Diffraction in Crystallography(5)

Publications29 total

CCDC 2057223: Experimental Crystal Structure Determination
The Cambridge Structural Database·2021Open Access
CCDC 2057222: Experimental Crystal Structure Determination
The Cambridge Structural Database·2021Open Access
Chlorination of a Zeolitic-Imidazolate Framework Tunes Packing and van der Waals Interaction of Carbon Dioxide for Optimized Adsorptive Separation
Journal of the American Chemical Society·2021· 41 citedOpen Access
Supporting molecular data for High rate nanofluidic energy absorption in porous zeolitic frameworks
2021· 2 citedOpen Access
Supporting molecular data for High rate nanofluidic energy absorption in porous zeolitic frameworks
Zenodo (CERN European Organization for Nuclear Research)·2021Open Access
High-rate nanofluidic energy absorption in porous zeolitic frameworks
Oxford University Research Archive (ORA) (University of Oxford)·2021· 26 cited
Charting the Metal-Dependent High-Pressure Stability of Bimetallic UiO-66 Materials
ACS Materials Letters·2020· 48 citedOpen Access
Light Olefin Diffusion during the MTO Process on H-SAPO-34: A Complex Interplay of Molecular Factors
Journal of the American Chemical Society·2020· 137 citedOpen Access
Thermal Engineering of Metal–Organic Frameworks for Adsorption Applications: A Molecular Simulation Perspective
ACS Applied Materials & Interfaces·2019· 98 citedOpen Access
Modeling the Structural and Thermal Properties of Loaded Metal–Organic Frameworks. An Interplay of Quantum and Anharmonic Fluctuations
Journal of Chemical Theory and Computation·2019· 31 citedOpen Access
Modeling Gas Adsorption in Flexible Metal–Organic Frameworks via Hybrid Monte Carlo/Molecular Dynamics Schemes
Advanced Theory and Simulations·2019· 84 citedOpen Access
Understanding noncovalent interactions in force fields through quantum mechanics : application to gas adsorption in metal-organic frameworks
Ghent University Academic Bibliography (Ghent University)·2019
Ab Initio Evaluation of Henry Coefficients Using Importance Sampling
Journal of Chemical Theory and Computation·2018· 24 citedOpen Access
i-PI 2.0: A universal force engine for advanced molecular simulations
Computer Physics Communications·2018· 370 citedOpen Access
Extension of the QuickFF force field protocol for an improved accuracy of structural, vibrational, mechanical and thermal properties of metal–organic frameworks
Journal of Computational Chemistry·2018· 87 citedOpen Access
Thermodynamic insight into stimuli-responsive behaviour of soft porous crystals
Nature Communications·2018· 135 citedOpen Access
Non-covalent force field expressed in terms of spherical density functions
Ghent University Academic Bibliography (Ghent University)·2018Open Access
Influence of a Confined Methanol Solvent on the Reactivity of Active Sites in UiO‐66
ChemPhysChem·2017· 24 citedOpen Access
Methane Adsorption in Zr-Based MOFs: Comparison and Critical Evaluation of Force Fields
The Journal of Physical Chemistry C·2017· 50 citedOpen Access
Back Cover: Alternating Copolymer of Double Four Ring Silicate and Dimethyl Silicone Monomer–PSS‐1 (Chem. Eur. J. 47/2017)
Chemistry - A European Journal·2017
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Frequent Co-authors

Véronique Van Speybroeck(24), Jelle Wieme(13), Michel Waroquier(13), Toon Verstraelen(11), Sven M. J. Rogge(11), Louis Vanduyfhuys(9), Aran Lamaire(5), Johan A. Martens(5), Christine E. A. Kirschhock(5), Venkat Kapil(3), Paul W. Ayers(3), Guillaume Maurin(3), Lik H. Wee(3), Karel Asselman(3), Erika de Oliveira Jardim(3), Joaquín Silvestre‐Albero(3), Jorge A. R. Navarro(3), Yueting Sun(3), Clive R. Siviour(3), Jin‐Chong Tan(3)