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

Department of Chemistry, University of Nevada Las Vegas, Las Vegas, USA
Laboratory for Computational Molecular Design, Ecole Polytechnique Fédérale de Lausanne, Institut des Sciences et Ingénierie Chimiques, Lausanne, Switzerland
Department of Chemistry and Supercomputing Institute, University of Minnesota, Minneapolis, USA
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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