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Figure 1
C1—C2—N plane of density maps of α-glycine. (a), (b) residual density (difference Fourier map) with contours at 0.05 e Å−3; (c), (d) dynamic deformation density [equation (4)[link]] with contours at 0.05 e Å−3; (e), (f) MEM density with contours at 0.2 e Å−3 up to 2.5 e Å−3. For (a), (c), (e) the IAM prior, and for (b), (d), (f) the IAM-HO prior has been used. The numbers on the axes indicate the distance in Å with respect to an arbitrarily selected origin. Solid lines denote positive values, dotted values denote negative values and dashed lines are the zero contour.

Journal logoSTRUCTURAL SCIENCE
CRYSTAL ENGINEERING
MATERIALS
ISSN: 2052-5206
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