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Faraday Discussions|October 7, 2003
Modelling inorganic solids and their interfaces: a combined approach of atomistic and electronic structure simulation techniquesStephen C Parker, Sebastien Kerisit, Arnaud Marmier, et al.
Faraday Discussions|October 7, 2003
Multipoles and interaction potentials in ionic materials from planewave-DFT calculationsAndrés Aguado, Leonardo Bernasconi, Sandro Jahn, et al.
Faraday Discussions|October 7, 2003
Ligand field spectroscopy of Cu(II) and Ag(II) complexes in the gas phase: theory and experimentLjiljana Puskar, Hazel Cox, Alan Goren, et al.
Faraday Discussions|October 7, 2003
Quantum chemical studies of redox-active enzymesPer E M Siegbahn
Faraday Discussions|October 9, 2004
Spin-forbidden CO ligand recombination in myoglobinJeremy N Harvey
Faraday Discussions|October 9, 2004
Environmental effects on a conical intersection: a model studyIrene Burghardt, Lorenz S Cederbaum, James T Hynes
Faraday Discussions|October 9, 2004
Extraordinary branching ratios in astrophysically important dissociative recombination reactionsWolf D Geppert, Richard Thomas, Anneli Ehlerding, et al.
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