Multipole refinement and electron density analysis in natural borosilicate datolite using X-ray diffraction data

Ivanov, Y.V.; Belokoneva, E.L.

doi:10.1107/S0108768106041681

Acta Crystallographica Section B
Acta Crystallographica
Section B STRUCTURAL SCIENCE, CRYSTAL ENGINEERING AND MATERIALS

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Figure 1
The static model-deformation ED in the structural polyhedra of datolite. The contour interval is 0.1 e Å⁻³. The positive contours are solid, the negative contours are dashed and the zero level is bold-dashed. Contours in the vicinity of the atomic positions are omitted. (a) Section O3—Si—O4. (b) Section O4—B—O5.

STRUCTURAL SCIENCE
CRYSTAL ENGINEERING
MATERIALS

ISSN: 2052-5206

Volume 63| Part 1| January 2007| Pages 49-55

doi:10.1107/S0108768106041681

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