Multiconfigurational quantum chemical methods for molecular systems containing actinides.

نویسندگان

  • Laura Gagliardi
  • Björn O Roos
چکیده

Recent advances in computational actinide chemistry are reported in this tutorial review. Muticonfigurational quantum chemical methods have been employed to study the gas phase spectroscopy of small actinide molecules. Examples of actinide compounds studied in solution are also presented. Finally the multiple bond in the diuranium molecule and other diactinide compounds is described.

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عنوان ژورنال:
  • Chemical Society reviews

دوره 36 6  شماره 

صفحات  -

تاریخ انتشار 2007