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Figure 13
Comparison between simulated (solid line) and measured (circles) intensities at the Fe K-edge for the C2/c reflections (a) (2, 1, 1/2) and (b) ([\bar5, 0, 1/2]) not accounted for by the P2/c model. The simulations include charge disproportions between octahedral B1b–B1b′, B3–B3′ and B4–B4′ atoms.

Journal logoJOURNAL OF
SYNCHROTRON
RADIATION
ISSN: 1600-5775
Volume 19| Part 2| February 2012| Pages 159-173
doi:10.1107/S0909049512001367
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