ereprof. dr. Michel Waroquier
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Au@UiO-66 : a base free oxidation catalyst
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Active site engineering in UiO-66 type metal-organic frameworks by intentional creation of defects : a theoretical rationalization
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PPV polymerization through the Gilch route: diradical character of monomers
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- Journal Article
- A1
- open access
A comparison of barostats for the mechanical characterization of metal-organic frameworks
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- Journal Article
- A1
- open access
Shape-selective diffusion of olefins in 8-ring solid acid microporous zeolites
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- Journal Article
- A1
- open access
Mechanical properties from periodic plane wave quantum mechanical codes: the challenge of the flexible nanoporous MIL-47(V) framework
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- Journal Article
- A1
- open access
Advances in theory and their application within the field of zeolite chemistry
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- Conference Paper
- P1
- open access
Normal mode analysis of macromolecular systems with the mobile block Hessian method
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Exploring the vibrational fingerprint of the electronic excitation energy via molecular dynamics
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- Conference Paper
- C3
- open access
Modeling aldol condensations in UiO-66 type materials
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Reactivity of CO on carbon-covered cobalt surfaces in Fischer-Tropsch synthesis
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- Journal Article
- A1
- open access
Metal-dioxidoterephthalate MOFs of the MOF-74 type: microporous basic catalysts with well-defined active sites
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Nucleophile-dependent regio- and stereoselective ring opening of 1-azoniabicyclo[3.1.0]hexane tosylate
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Au@UiO-66 : a base free oxidation catalyst
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Synthesis of 2-hydroxy-1,4-oxazin-3-ones through ring transformation of 3-hydroxy-4-(1,2-dihydroxyethyl)-β-lactams and study of their reactivity