Temperature-dependent rf-ion trap mass spectrometry and first-principles simulations reveal the detailed reaction mechanism of the catalytic gas-phase oxidation of CO by free Au(2)(-) ions in the presence of O(2). A metastable intermediate with a mass of Au(2)CO(3)(-) was observed at low temperatures. Two alternative structures corresponding to digold carbonate or peroxyformate are predicted fo...

The catalytic conversion of hydrocarbons for the production of hydrogen and syngas (H2/CO) is of great interest in research and technology. Detailed heterogeneous kinetics can also provide a better understanding of the reactions involved during the catalytic processes commonly used in the synthesis gas production. The developed models can predict conversion and selectivity at varying operation ...

High-concentration CaO particles and gas compositions have a significant influence on NOx reduction by selective non-catalytic reduction (SNCR) in cement precalciners. The effect of gas composition on NOx reduction by SNCR with NH₃ was studied in a cement precalciner atmosphere with and without CaO at 700-1100 °C. It was found that CaO significantly lowers NOx reduction efficiency between 750 °...

the catalytic oxidation of toluene to benzoic acid in the liquid phase has been studied in an un-stirred tank reactor. low concentration of acetic acid was added in order to increase the solubility of the catalyst in toluene. the dependence of the rate of reaction on the concentration of toluene catalyst and oxygen pressure was studied. it has been suggested that liquid phase oxidation of tolue...

The formation of radicals in the gas phase oxidation of cyclohexane over metal oxides was studied using spin trapping and EPR spectroscopy; the results confirmed that during the catalytic initiation, the oxygen responsible for the radicals formation originates from the lattice of the metal oxide.

Determination of metal oxidation state under relevant working conditions is crucial to understand catalytic behaviour. The reduction behaviour of Pt and Re was evaluated simultaneously as a function of support and solvent in a pressurized reactor (autoclave). The bimetallic catalysts are used in selective hydrogenation of carboxylic acids and amides. Gas phase reduction reduced the metals more ...

Light-off of the partial oxidation of methane to synthesis gas on a rhodiumcoated cordierite honeycomb monolith at short contact times is studied experimentally and numerically. The objective of this investigation is a better understanding of transient processes in catalytic oxidation reactors. The numerical simulation predicts the time-dependent solid-temperature distribution of the entire rea...

In situ knowledge of the gas phase around a catalyst is essential to make an accurate correlation between the catalytic activity and surface structure in operando studies. Although ambient pressure X-ray photoelectron spectroscopy (AP-XPS) can provide information on the gas phase as well as the surface structure of a working catalyst, the gas phase detected has not been spatially resolved to da...

The bubble effectiveness in liquid phase cylohexane non-catalytic oxidation process is discussed in this paper. Then the bubble effectiveness and a new proposed kinetic model are used in the mathematical model of the industrial reactor for the cyclohexane non-catalytic oxidation process. Furthermore, simulation and optimization based on this reactor model are carried out. The results of sim...