Calculated optical and magnetic properties of hexafluorouranate (V) anion: UF6 -

Ramiro Arratia-Pérez, Lucia Hernandez-Acevedo, Gulzari L. Malli

Resultado de la investigación: Contribución a una revistaArtículo

29 Citas (Scopus)

Resumen

The optical and magnetic properties of hexafluorouranate (V) anion U-F bound was discussed. The Dirac scattered wave calculation was also performed at the optimized U-F bond distances using the first order pertubational procedure. Orbital contributions from unquenched orbital angular contributes significantly to the Zee man effects as well as the 235U hyperfine interactions. It was observed that the close agreement between theory and experiments for the Zeeman splitting suggests that the use of four component Dirac molecular wave functions is necessary while a relativistic treatment taking into account double group.

Idioma originalInglés
Páginas (desde-hasta)7743-7747
Número de páginas5
PublicaciónJournal of Chemical Physics
Volumen121
N.º16
DOI
EstadoPublicada - 22 oct 2004

Áreas temáticas de ASJC Scopus

  • Óptica y física atómica y molecular
  • Química física y teórica
  • Física y astronomía (todo)

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