The oxidation of copper catalysts during ethylene epoxidation was characterized using in situ photoemission spectroscopy and electron microscopy. Gas chromatography, proton-transfer reaction mass spectrometry and electron-ionization mass spectrometry were used to characterize the catalytic properties of the oxidized copper. We find that copper corrodes during epoxidation in a 1 : 1 mixture of o...

Systematic theoretical studies for the mechanisms of the epoxidation and complete oxidation of ethylene and propylene over silver surface as well as the reactivity and the stability of oxygen species on Cu, Ag, and Au surfaces have been presented. The Ž . Ž . dipped adcluster model DAM combined with the ab initio Hartree]Fock HF , secondŽ . Ž order Møller-Plesset MP2 , and SACrSAC-CI symmetry-a...

Energy-dependent (qE) non-photochemical quenching (NPQ) thermally dissipates excess absorbed light energy as a protective mechanism to prevent the over reduction of photosystem II and the generation of reactive oxygen species (ROS). The xanthophyll cycle, induced when the level of absorbed light energy exceeds the capacity of photochemistry, contributes to qE. In this work, we show that ethylen...

A steady-state cross-flow reactor for ethylene epoxidation was simulated using industrial data (low oxygen/ethylene feed ratio) and pilot plant data (high oxygen/ethylene feed ratio). A comparison between the conventional fixed-bed reactor and the cross-flow reactor with two types of feeding modes was performed. The present study showed the possibility of enhancing the reactor yield by distribu...

Ethylene oxide (EO) is industrially produced by epoxidation of ethylene on Ag-based heterogeneous catalysts. Electrophilic oxygen species are assumed to be active key in the EO production. This study explores possibility electrochemically these a solid electrochemical cell. Two series Ag based cermet electrodes were prepared either with Yttria Stabilized Zirconia (YSZ), pure ionic conductor, or...

Extensive density functional theory calculations of the O1s binding energies, adsorption energies, and the experimentally measured in situ X-ray photoelectron spectra of oxygen on silver are reported in an effort to clarify which species are present during ethylene epoxidation. We find that the O1s binding energy of an oxygen adatom increases near linearly with its adsorption energy due to the ...

Silver–copper alloys have been proposed as catalysts for ethylene epoxidation due to their superior selectivity compared to pure silver, the predominant catalyst for this reaction. Under reaction conditions it has been previously shown that, rather than a two-dimensional (2D) Ag–Cu alloy, a thin copper oxide-like layer forms on top of silver, and several possible surface structures were identif...