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Showing 1 to 1 of 1 for “"Cluster Rechnungen"”.
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On the electronic structure of layered sodium cobalt oxides
… of NaxCoO2, the electronic spectrum of a CoO6 cluster has been calculated including all interactions between 3d orbitals as well as hopping processes between Co and O and O and O ions. The ground state for two electronic occupations in the cluster (i.e. Co3+ and Co4+) that correspond nominally …