DENSITY-FUNCTIONAL THEORY; TRANSITION-METAL-COMPLEXES; EFFECTIVE CORE POTENTIALS; SOLVATION FREE-ENERGIES; NON-INNOCENT LIGAND; STAUDINGER REACTION; WATER OXIDATION; MOLECULAR CALCULATIONS; IMIDO COMPLEXES; BOND ACTIVATION
CHEMISTRY-A EUROPEAN JOURNAL, v.21, no.4, pp.1780 - 1789
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