BS
Bartłomiej M. Szyja
Authored
3 records found
Catalytic hydrogenation of CO<sub>2</sub> to formates by a lutidine-derived Ru-CNC pincer complex
Theoretical insight into the unrealized potential
Metal-ligand cooperative properties of a bis-N-heterocyclic carbene ruthenium CNC pincer catalyst and its activity in CO2 hydrogenation to formates were studied by DFT calculations complemented by NMR spectroscopy and kinetic measurements. The dearomatized Ru-CNC∗ pincer (1∗) is
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Establishing hierarchy
The chain of events leading to the formation of silicalite-1 nanosheets
In applying a multi-scale spectroscopic and computational approach, we demonstrate that the synthesis of stacked zeolite silicalite-1 nanosheets, in the presence of a long-tail diquaternary ammonium salt surfactant, proceeds through a pre-organised phase in the condensed state. I
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This paper reports for the first time a computational analysis of the redox properties of graphene-supported Ru-porphyrins as potential catalytic materials for electrochemical CO2 reduction. Density functional theory reveals that such catalytic ensembles can efficiently activate
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