Overview

Recent developments in all aspects of computational chemistry are discussed, including structure and bonding, mechanism - especially in catalytic processes, bioinorganic chemistry, transition metal chemistry, spectroscopy - in particular the calculation of open shell system and ligand field effects in d and f element compounds, organometallics, methodological advances, and heavy element complexes - especially relativistic effects. Faraday Discussions documents a long-established series of Faraday Discussion meetings which provide a unique international forum for the exchange of views and newly acquired results in developing areas of physical chemistry, biophysical chemistry and chemical physics. The papers presented are published in the Faraday Discussion volume together with a record of the discussion contributions made at the meeting. Faraday Discussions therefore provide an important record of current international knowledge and views in the field concerned.

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