Louis Vanduyfhuys

Minimal Basis Iterative Stockholder: Atoms in Molecules for Force-Field Development

Toon Verstraelen, Steven Vandenbrande, Farnaz Heidar‐Zadeh et al. · Journal of Chemical Theory and Computation · 2016 · 239 citations · Full text

Engineering, Atomic Partial Charges, Molecular Biology +17

QuickFF: A program for a quick and easy derivation of force fields for metal‐organic frameworks from <i>ab initio</i> input

Louis Vanduyfhuys, Steven Vandenbrande, Toon Verstraelen et al. · Journal of Computational Chemistry · 2015 · 169 citations · Full text

Engineering, Software Package, Computational Chemistry +19

Metal–organic frameworks as potential shock absorbers: the case of the highly flexible MIL-53(Al)

Pascal G. Yot, Zoubeyr Boudene, Jasmine Macia et al. · Chemical Communications · 2014 · 141 citations · Full text

Thermodynamic insight into stimuli-responsive behaviour of soft porous crystals

Louis Vanduyfhuys, Sven M. J. Rogge, Jelle Wieme et al. · Nature Communications · 2018 · 134 citations · Full text

Thermodynamic Insight in the High-Pressure Behavior of UiO-66: Effect of Linker Defects and Linker Expansion

Sven M. J. Rogge, Jelle Wieme, Louis Vanduyfhuys et al. · Chemistry of Materials · 2016 · 117 citations · Full text

Materials Science, Crystal Structure, Molecular Solid +15