Acta Crystallographica Section B
Acta Crystallographica
Section B
STRUCTURAL SCIENCE, CRYSTAL ENGINEERING AND MATERIALS
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Figure 4
The comparative plots of (
a
) Zn
L
2
, (
b
) Cu
L
2
and (
c
) LiNCS·H
L
geometries after B3LYP optimization (red) and as taken from the crystal structure (black). This figure is in colour in the electronic version of this paper.
STRUCTURAL SCIENCE
CRYSTAL ENGINEERING
MATERIALS
ISSN: 2052-5206
Volume 63
|
Part 3
|
May 2007
|
Pages 402-410
doi:10.1107/S0108768107003898
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The IUCr is a scientific union serving the interests of crystallographers and other scientists employing crystallographic methods.