Towards a 32‐Electron Principle: Pu@Pb12 and Related Systems

Angewandte ChemieVolume 119, Issue 9 p. 1449-1452 Zuschrift Towards a 32-Electron Principle: Pu@Pb12 and Related Systems† Jean-Pierre Dognon Dr., Jean-Pierre Dognon Dr. Present and permanent address: CEA/Saclay, DSM/DRECAM/SCM, 91191 Gif-sur-Yvette, FranceSearch for more papers by this authorCarine Clavaguéra Dr., Carine Clavaguéra Dr. Present address: Laboratoire des Mécanismes Réactionnels, Département de Chimie, Ecole Polytechnique, CNRS, 91128 Palaiseau Cedex, FranceSearch for more papers by this authorPekka Pyykkö Prof. Dr., Pekka Pyykkö Prof. Dr. Pekka.Pyykko@helsinki.fi Department of Chemistry, University of Helsinki, P.O. Box 55, 00014 Helsinki, Finland, Fax: (+358) 9-191-50169Search for more papers by this author Jean-Pierre Dognon Dr., Jean-Pierre Dognon Dr. Present and permanent address: CEA/Saclay, DSM/DRECAM/SCM, 91191 Gif-sur-Yvette, FranceSearch for more papers by this authorCarine Clavaguéra Dr., Carine Clavaguéra Dr. Present address: Laboratoire des Mécanismes Réactionnels, Département de Chimie, Ecole Polytechnique, CNRS, 91128 Palaiseau Cedex, FranceSearch for more papers by this authorPekka Pyykkö Prof. Dr., Pekka Pyykkö Prof. Dr. Pekka.Pyykko@helsinki.fi Department of Chemistry, University of Helsinki, P.O. Box 55, 00014 Helsinki, Finland, Fax: (+358) 9-191-50169Search for more papers by this author First published: 09 February 2007 https://doi.org/10.1002/ange.200604198Citations: 16 † The Finnish group belongs to the Finnish Centre of Excellence in Computational Molecular Science (2006-2011). The grants 200903 and 266102 from The Academy of Finland are also gratefully acknowledged. C.C. thanks the Magnus Ehrnrooth Foundation for a postdoctoral scholarship. J.P.D. is supported by the French CEA-Direction des Sciences de la Matière/University of Helsinki collaboration. We thank J. P. Desclaux for his help in the use of the MCDFGME program. Considerable computer resources were obtained from CSC Computing, Espoo, Finland and at the "Ametisti" campus cluster. Read the full textAboutPDF ToolsRequest permissionAdd to favorites ShareShare Give accessShare full text accessShare full-text accessPlease review our Terms and Conditions of Use and check box below to share full-text version of article.I have read and accept the Wiley Online Library Terms and Conditions of UseShareable LinkUse the link below to share a full-text version of this article with your friends and colleagues. Learn more.Copy URL Share a linkShare onFacebookTwitterLinkedInRedditWechat Graphical Abstract Die vorhergesagten endohedralen ikosaedrischen Cluster Pu@Pb12 (siehe Bild; Pu blau, Pb gelb) und [Am@Pb12]+ haben ein äußeres 32-Elektronensystem, das formal besetzten 7s-, 7p-, 6d- und 5f-Actinoidorbitalen entspricht, von denen jedes mit einem 6p-basierten Pb-Orbital des [Pb12]2−-Käfigs wechselwirkt. Diese Untersuchung liefert das erste Beispiel für ein formales 32-Elektronen-Prinzip, und 32 ist keine falsche magische Zahl. Citing Literature Supporting Information Supporting information for this article is available on the WWW under http://www.wiley-vch.de/contents/jc_2001/2007/z604198_s.pdf or from the author. Please note: The publisher is not responsible for the content or functionality of any supporting information supplied by the authors. Any queries (other than missing content) should be directed to the corresponding author for the article. Volume119, Issue9February 19, 2007Pages 1449-1452 This is the German version of Angewandte Chemie. Note for articles published since 1962: Do not cite this version alone. Take me to the International Edition version with citable page numbers, DOI, and citation export. We apologize for the inconvenience. RelatedInformation