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Figure 9
The ∇2ρ(r) contour plot in the mean-squared S—C—C—Ni plane of the isolated equilibrium EGAXAN structure (negative values are indicated by red dashed lines). The green dots denote (3, −1) of ρ(r). The green tubular lines correspond to three eigenvalue paths of selected interatomic surfaces.

Journal logoSTRUCTURAL SCIENCE
CRYSTAL ENGINEERING
MATERIALS
ISSN: 2052-5206
Volume 76| Part 3| June 2020| Pages 436-449
https://doi.org/10.1107/S2052520620005685
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