Uranium Trioxide - Structure - Bond Valence Parameters

Bond Valence Parameters

It is possible by bond valence calculations to estimate how great a contribution a given oxygen atom is making to the assumed valence of uranium. Bond valence calculations use parameters which are estimated after examining a large number of crystal structures of uranium oxides (and related uranium compounds), note that the oxidation states which this method provides are only a guide which assists in the understanding of a crystal structure.

The formula to use is


s = e^{-\frac{R-R_O}{B}}

The sum of the s values is equal to the oxidation state of the metal centre.

For uranium binding to oxygen the constants RO and B are tabulated in the table below. For each oxidation state use the parameters from the table shown below.

Oxidation state RO B
U(VI) 2.08 Å 0.35
U(V) 2.10 Å 0.35
U(IV) 2.13 Å 0.35

It is possible to do these calculations on paper or software.

Read more about this topic:  Uranium Trioxide, Structure

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