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Naji, M. |
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Motta, Antonella |
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Aletan, Dirar |
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Casati, R. |
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Azam, Siraj |
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Ospanova, Alyiya |
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Ali, M. A. |
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Rančić, M. |
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Ollier, Nadège |
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Azevedo, Nuno Monteiro |
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Landes, Michael |
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Rignanese, Gian-Marco |
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Steiner, E.
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article
Ring current and electron delocalisation in an all-metal cluster, Al42-
Abstract
<p>Localised-orbital analysis of the current density induced by a perpendicular magnetic field in square-planar A1<sub>4</sub><sup>2-</sup> demonstrates the intrinsic non-localisability of the σ electrons of this metallic cluster and confirms their dominant role in its diamagnetic ring current. Though delocalised, the π electrons do not give rise to a significant ring current.</p>