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• W1489291431 abstract "Magnetic and electrical resistivity properties of RMo8O14 (R = La, Ce, Pr, Nd, Sm) compounds containing different bicapped-octahedral Mo8 clusters are discussed. Extended Hückel (EH) molecular calculations were carried out in order to study the influence of the position of metal capping atoms on the electronic structure of different Mo8 isomers. Different optimal metal electron counts are possible for these clusters. Periodic density functional calculations confirm the molecular character of these compounds and allow the understanding of their semiconducting and magnetic properties." @default.
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• W1489291431 date "2002-08-08" @default.
• W1489291431 modified "2023-10-03" @default.
• W1489291431 title "Electronic Structure, Electrical and Magnetic Properties of RMo₈O₁₄ Compounds (R = La, Ce, Pr, Nd, Sm) Containing Bicapped Mo₈ Clusters" @default.
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• W1489291431 doi "https://doi.org/10.1021/ic020194e" @default.
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