Article,

Aquaperoxovanadium(V) complexes: Quantum-chemical study

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Russian Journal of Inorganic Chemistry, 56 (5): 738-744 (2011)
DOI: 10.1134/S0036023611050184

Abstract

The addition of a water molecule to mono-, di-, and triperoxovanadium(V) complexes has been studied at the density functional theory (B3LYP/6-31G**) and Møller-Plesset perturbation theory (MP2/6-31G**) levels. It has been demonstrated that the H

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