ereprof. dr. Michel Waroquier
work address
Technologiepark Zwijnaarde 903
9052 Zwijnaarde
9052 Zwijnaarde
1 – 15 of 453
- show: 15
- |
- sort: year (new to old)
Close
Embed this list
<iframe src=""
width=""
height=""
allowtransparency="true"
frameborder="0">
</iframe>
- 2016
- Exploring the flexibility of MIL-47(V)-type materials using force field molecular dynamics simulations
- Ab initio study of the trapping of polonium on noble metals
- 2015
- Mechanical properties from periodic plane wave quantum mechanical codes: the challenge of the flexible nanoporous MIL-47(V) framework
- Determination of the nature of the Cu coordination complexes formed in the presence of NO and NH3 within SSZ-13
- Advances in theory and their application within the field of zeolite chemistry
- How zeolitic acid strength and composition alter the reactivity of alkenes and aromatics towards methanol
- Au@UiO-66: a base free oxidation catalyst
- Active site engineering in UiO-66 type metal-organic frameworks by intentional creation of defects: a theoretical rationalization
- Shape-selective diffusion of olefins in 8-ring solid acid microporous zeolites
- Au@UiO-66: a base free oxidation catalyst
- Possibility of [1,5] sigmatropic shifts in bicyclo[4.2.0]octa-2,4-dienes
- Elucidating the structural isomerism of fluorescent strigolactone analogue CISA-1
- QuickFF: a program for a quick and easy derivation of force fields for metal-organic frameworks from ab initio input
- Fine-tuning the theoretically predicted structure of MIL-47(V) with the aid of powder X-ray diffraction
- Mechanistic studies of aldol condensations in UiO-66 and UiO-66-NH2 metal organic frameworks