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Figure 4
Comparison of changes in electron density due to the XCW procedure for the Zobel (1996BB41) data set. The plots presented are at (a) λopt = λTIH3 [λTIH3 = 0.03], (b) λopt = λTIH6 [λTIH6 = 0.08], (d) λ = λmax [λmax = 0.19], and (c) one step before at λ = λpen [λpen = 0.18]. Units are in e Å−3 , each contour indicates a change of 0.025 e Å−3.

Journal logoSTRUCTURAL SCIENCE
CRYSTAL ENGINEERING
MATERIALS
ISSN: 2052-5206
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