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Multi-configurational quantum chemical studies of the Tc2X8n (X = Cl, Br; n = 2, 3) anions. Crystallographic structure of octabromoditechnetate(3)

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a
Department of Chemistry, University of Nevada Las Vegas, Las Vegas, USA
E-mail: poineauf@unlv.nevada.edu
b
Laboratory for Computational Molecular Design, Ecole Polytechnique Fédérale de Lausanne, Institut des Sciences et Ingénierie Chimiques, Lausanne, Switzerland
c
Department of Chemistry and Supercomputing Institute, University of Minnesota, Minneapolis, USA
d
Energy Engineering and Systems Analysis Directorate, Argonne National Laboratory, 9700 Cass Avenue, Lemont, USA
Dalton Trans., 2012,41, 2869-2872

DOI: 10.1039/C2DT11952H
Received 17 Oct 2011, Accepted 12 Dec 2011
First published online 19 Jan 2012
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