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Figure 6
Profiles of ∇2ρ (e Å−5; black squares) and (%; grey triangles) along the bond paths of (a) the P—P bond and (b) the P—O bond (P is on the left, O on the right). The ellipticities are given for (b) only. The x axis represents the coordinate (in Å) with respect to the bond-critical points (x = 0) along the bond path.

Journal logoSTRUCTURAL SCIENCE
CRYSTAL ENGINEERING
MATERIALS
ISSN: 2052-5206
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