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Figure 2
The goodness-of-fit of reflections grouped in 0.1 Å−1 ranges of [\sin\theta /\lambda] (XRD and PND) for multipole (circles with solid line) and orbital models without the `bond' term (triangles with a dotted line). The histogram shows a distribution of reflections (in hundreds for XRD) over [\sin\theta /\lambda].

ISSN: 2053-2733
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