CO oxidation and NO reduction on metal surfaces: density functional theory investigations

This article reviews the accumulated theoretical results, in particular density functional theory calculations, on two catalytic processes, CO oxidation and NO reduction on metal surfaces. Owing to their importance in automotive emission control, these two reactions have generated a lot of interest in the last 20 years. Here the pathways and energetics of the involved elementary reactions under different catalytic conditions are described in detail and the understanding of the reactions is generalized. It is concluded that density functional theory calculations can be applied to catalysis to elucidate mechanisms of complex surface reactions and to understand the electronic structure of chemical processes in general. The achieved molecular knowledge of chemical reactions is certainly beneficial to new catalyst design.

Archaeological and Palaeoecological investigations of a Middle Bronze Age settlement at Ballyarnet Lake, Co. Derry

Excavations at Ballyarnet Lake, Co Derry, have identified a Middle Bronze Age settlement site at the margins of the lake. The site is characterised by a palisaded enclosure surrounding a structure containing a hearth. Finds include a large quantity of Cordoned Urn ware, lithics and a faience bead. Palaeoenvironmental studies, including pollen, plant macrofossil and beetle analyses, provide insights into the environmental background of the settlement. The site is considered in terms of the broader context of Middle Bronze Age settlement.

Preliminary investigations on the effects of ageing and cooking on the Raman spectra of porcine longissimus dorsi

The influence of ageing and cooking on the Raman spectrum of porcine longissimus dorsi was investigated. The rich information contained in the Raman spectrum was highlighted, with numerous changes attributed to changes in the environment and conformations of the myofibrillar proteins.

Kinetic and thermodynamic investigations on arsenic adsorption onto dolomitic sorbents

Arsenic and its compounds are toxic pollutants for the environment and all living organisms. At present, there is considerable interest in studying new sorbent materials for the removal of arsenic from aqueous solutions. This work discusses the feasibility of arsenic uptake onto dolomite which is considered to be a potential inexpensive adsorbent. Thermodynamic and kinetic experiments were undertaken to assess the capacity and rate of As uptake onto dolomite. Experimental data were mathematically described using adsorption kinetic models, namely pseudo-first-order and pseudo-second-order models. The arsenic removal was found to be dependent on the dosage of dolomite, adsorbent particle size and the presence of various anions. Thermodynamic results indicate that the adsorption follows an exothermic chemisorption process. The experimental data indicate successful removal of As(V) ion from aqueous solution indicating that dolomite be used as an inexpensive treatment process. (C) 2010 Elsevier B.V. All rights reserved.