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Figure 5
The neutron PDF calculated (blue lines) at different stages in the development of the SCDS model. The difference between the current and previous step calculated is shown as a red line in each case. (a) Average PZN. (b) After B-site Ising model. (c) Pb 〈110〉 displacement. (d) Nanodomains formed. (e) Size-effect applied. (f) BVS MC. Positions labelled with * are discussed in the text.

IUCrJ
Volume 3| Part 1| January 2016| Pages 20-31
ISSN: 2052-2525
doi:10.1107/S2052252515018722