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  • Geometries of third-row transition-metal complexes from density-functional theory 

    Buehl, Michael; Reimann, Christoph; Pantazis, Dimitrios A.; Bredow, Thomas; Neese, Frank (2008-09) - Journal article
    A set of 41 metal-ligand bond distances in 25 third-row transition-metal complexes, for which precise structural data are known in the gas phase, is used to assess optimized and zero-point averaged geometries obtained from ...