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Figure 10
(a, b, c) Three-dimensional static deformation density obtained from XWR (XCW at λmax = 0.7), ELMAM2 database transfer model, experimental multipole model, respectively. (d, e, f) Three-dimensional dynamic deformation density representing [ {\rho }^{\rm MP}({\bf x})], [{\rho }^{\rm ELMAM2}({\bf x})], [\rho _{\rm MP}^{{\rm MEM} - n2}(x)], respectively. The isocontour level is +0.3/−0.15 e Å−3. The blue and red regions indicate positive and negative deformation electron density, respectively.

Journal logoSTRUCTURAL SCIENCE
CRYSTAL ENGINEERING
MATERIALS
ISSN: 2052-5206
Volume 78| Part 2| April 2022| Pages 231-246
https://doi.org/10.1107/S2052520622001457
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