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- W2093369325 abstract "Utilizing all-electron Dirac-exact relativistic calculations with the Normalized Elimination of the Small Component (NESC) method and the local vibrational mode approach, the transition from metal-halide to metal halogen bonding is determined for Au-complexes interacting with halogen-donors. The local stretching force constants of the metal-halogen interactions reveal a smooth transition from weak non-covalent halogen bonding to non-classical 3-center-4-electron bonding and finally covalent metal-halide bonding. The strongest halogen bonds are found for dialkylaurates interacting with Cl2 or FCl. Differing trends in the intrinsic halogen-metal bond strength, the binding energy, and the electrostatic potential are explained." @default.
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- W2093369325 date "1981-01-01" @default.
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- W2093369325 title "N,N′-Dimethylethyleneurea (DMEU) complexes of lanthanide perchlorates" @default.
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- W2093369325 doi "https://doi.org/10.1016/0022-1902(81)80305-3" @default.
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