Redox-Induced Formation and Cleavage of O-O Bonds in a Peroxo-Bridged Manganese Dimer: a Density Functional Study

McGrady, John Ewart; Stranger, Robert

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Redox-Induced Formation and Cleavage of O-O Bonds in a Peroxo-Bridged Manganese Dimer: a Density Functional Study

Date

1999

Authors

McGrady, John Ewart

Stranger, Robert

Publisher

American Chemical Society

Abstract

The structural and electronic consequences of reduction and oxidation of a peroxo-bridged Mn2IV/IV dimer, Mn2(μ-O)2(μ-O2)(NH3) 62+, are examined using approximate density functional theory. In both cases, the initial electron-transfer step is localized

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http://hdl.handle.net/1885/92016

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ANU Research Publications

Source

Inorganic Chemistry

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Journal article

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2037-12-31

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Redox-Induced Formation and Cleavage of O-O Bonds in a Peroxo-Bridged Manganese Dimer: a Density Functional Study

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