Home The correlation between metal oxidation state and bond valence parameters for M—O bonds (M = V, Fe and Cu). A simple method to search for the metal oxidation-state independent parameter pairs
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The correlation between metal oxidation state and bond valence parameters for M—O bonds (M = V, Fe and Cu). A simple method to search for the metal oxidation-state independent parameter pairs

  • Sheng-Zhi Hu and Zhao-Hui Zhou
Published/Copyright: September 25, 2009

Abstract

Based on the latest available crystal data and the reported bond valence parameters, the linear correlation between the bond valence parameter R0 with B = 0.37 Å for M—O bonds (M = V, Fe and Cu) and the metal oxidation state n is shown for the first time. For V—O bonds, a linear equation of R0n is perfectly established as R0 = 0.0250n + 1.674 (n = 2–5). Similarly, a linear equation for Fe—O bonds is fitted as R0 = 0.0335n + 1.648 (n = 2–4), as well as R0 = 0.0855n + 1.482 (n = 1–3) for Cu—O bonds fitted properly. In addition, the linear correlation between R0 and n within certain range of B values for V—O and Fe—O bonds is also established. Consequently, the oxidation-state independent parameters (R0, B) of (1.788, 0.32 Å) for V—O bonds and (1.795, 0.30 Å) for Fe—O bonds can be derived from the zero slope of the R0n straight lines. However, a similar parameter pair for Cu—O bonds cannot be found using this unique approach.

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Published Online: 2009-9-25
Published in Print: 2004-10-1

© 2004 Oldenbourg Wissenschaftsverlag GmbH

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