On the Magnetic Susceptibility of Xenon Tetrafluoride

The magnetic susceptibility of XeF4 has been treated theoretically in the LCAO—MO approximation with particular emphasis placed on the calculation of the high-frequency elements in the paramagnetic part of the susceptibility. The results are in good agreement with a recently observed susceptibility...

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Veröffentlicht in:Journal of Chemical Physics (U.S.) 1964-01, Vol.40 (1), p.229-232
1. Verfasser: Boudreaux, Edward A.
Format: Artikel
Sprache:eng
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Zusammenfassung:The magnetic susceptibility of XeF4 has been treated theoretically in the LCAO—MO approximation with particular emphasis placed on the calculation of the high-frequency elements in the paramagnetic part of the susceptibility. The results are in good agreement with a recently observed susceptibility value and suggests that a previously proposed MO scheme is consistent in accounting for the magnetic properties of the molecule. A small ring current has also been calculated, thus substantiating the delocalized MO description advanced by other investigators.
ISSN:0021-9606
1089-7690
DOI:10.1063/1.1724868