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Figure 2
Difference Fourier maps at the z = 0 section for sample (I) from (a) the harmonic model and (b) the anharmonic model. Contour intervals are 0.2 e Å−3. The solid and dotted lines represent positive and negative densities, respectively; the broken lines are zero levels.

Journal logoSTRUCTURAL SCIENCE
CRYSTAL ENGINEERING
MATERIALS
ISSN: 2052-5206
Volume 61| Part 6| November 2005| Pages 608-615
doi:10.1107/S0108768105031034
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