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Ethanol dehydration pathways in H-ZSM-5 : insights from temporal analysis of products
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- Journal Article
- A1
- open access
First-principles-based simulation of an industrial ethanol dehydration reactor
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Kinetics of lifetime changes in bimetallic nanocatalysts revealed by quick X-ray absorption spectroscopy
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Kinetics of lifetime changes in bimetallic nanocatalysts revealed by quick X-ray absorption spectroscopy
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Study of butanol conversion to butenes over H-ZSM-5 : effect of chemical structure on activity, selectivity and reaction pathways
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- Conference Paper
- C3
- open access
Bio-butanol dehydration via zeolites as a missing link between classic and bio refineries
(2017) -
- Conference Paper
- C3
- open access
Role of products and intermediates in bioethanol conversion to hydrocarbons on H-ZSM-5 : a time-resolved study
(2017) -
- Conference Paper
- C3
- open access
Fundamental understanding of heterogeneously catalyzed reactions : from hydrocarbon oxidation to bio-alcohol dehydration
(2017) -
- Conference Paper
- C3
- open access
Fundamental understanding of heterogeneously catalyzed reactions : from hydrocarbon oxidation to bio-alcohol dehydration
(2017) -
Role of intermediates in reaction pathways from ethene to hydrocarbons over H-ZSM-5
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Mechanistic insights into the formation of butene isomers from 1-butanol in H-ZSM-5 : DFT based microkinetic modelling
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Effect of zeolite confinement on the conversion of 1-butanol to butene isomers : mechanistic insights from DFT based microkinetic
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- Conference Paper
- C3
- open access
Bio-butanol dehydration by zeolites: the missing link between classic and bio refinery
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Ab initio molecular dynamics for ethanol asorption in H-ZSM-5
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The role of CO2 in the dehydrogenation of propane over WOx-VOx/SiO2
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Role of anharmonicity in the confinement effect in zeolites: structure, spectroscopy, and adsorption free energy of ethanol in H-ZSM-5
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DFT-based microkinetic modeling of ethanol dehydration in H-ZSM-5
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First principles kinetic study on the effect of zeolite framework on 1-butanol dehydration
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Anharmonicity and confinement in zeolites: structure, spectroscopy, and adsorption free energy of ethanol in H-ZSM-5
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Insights into the reaction mechanism of ethanol conversion into hydrocarbons on H-ZSM-5
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DFT investigation into alumina ALD growth inhibition on hydroxylated amorphous silica surface
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Acidity of H-ZSM-5 and H-FAU as a function of Si/Al ratio
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Microkinetics for toluene total oxidation over CuO–CeO2/Al2O3
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Molecular dynamics study of ethanol adsorption and protonation in H-ZSM-5
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Selective etherification of beta-citronellene catalyzed by zeolite beta
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Ab initio investigation of surface chemistry of alumina ALD on hydroxylated γ-alumina surface
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Reaction path analysis for 1-butanol dehydration in H-ZSM-5 zeolite: ab initio and microkinetic modeling
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Structure, adsorption free energy, and spectroscopy of ethanol in HZSM-5
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Bio-butanol dehydration in zeolites: mechanistic insights from DFT-based microkinetic modeling
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Catching the lifetime changes of active Pt-Ga nanoclusters during high temperature redox cycling by in situ Quick-XAS
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Regioselective etherification of b-citronellene catalyzed by zeolite beta
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Ethanol dehydration: from ab initio to industrial reactor simulation
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Theoretical study of butanol dehydration on Zeolites
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Ab initio based microkinetic modelling of ethanol dehydration in zeolites
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Reduction of CuO-CeO2/Al2O3 and CeO2/Al2O3 catalysts studied by Operando XAS and XRD
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Propane and propene activation on V2O5 based catalysts: a combined ab initio: statistical thermodynamics study
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Reaction path analysis of propene selective oxidation over V2O5 and V2O5/TiO2
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Reaction path analysis of propene selective oxidation over V2O5 and V2O5/TiO2
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Hydrocarbon oxidation over metal oxide catalysts: an ab initio and operando X-ray absorption study
(2012) -
Reaction path analysis of propane selective oxidation over V2O5 and V2O5/TiO2
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- Journal Article
- A1
- open access
Theoretical study of the effect of (001) TiO2 anatase support on V2O5
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Time-resolved operando X-ray absorption study of CuO-CeO2/Al2O3 catalyst during total oxidation of propane
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Quick EXAFS measurements at SAMBA-SOLEIL:Cu K and Ce LIII edge
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First principles study of propane oxidation on supported and unsupported V2O5 catalysts: C-H bond activation and reaction path analysis
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- Conference Paper
- C3
- open access
In situ X-ray absorption study of the total oxidation of propane over CuO-CeO2/Al2O3
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- Conference Paper
- C3
- open access
In situ X-ray absorption study of CuO-CeO2/Al2O3 catalysts in the total oxidation of propane
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Ab initio modeling of propene oxidation on V2O5 catalysts
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Ab initio study of alkene activation on vanadium oxide based catalysts