An Introduction to the Electronic Structure of Atoms and MoleculesProfessor of Chemistry / McMaster University / Hamilton, Ontario |
This table lists the values of the contours appearing in molecular density
maps and bond density maps for those cases where the values are not given
in the figure. In charge density maps the contours increase in value from
the outermost one to the innermost one in the order indicated below. As
an example, the reader may refer to Fig.
6-2, a contour map of the charge density for H2 with the
contours labelled in the order indicated by the table. In the bond density
difference maps the contour values increase (solid lines) or decrease (dashed
lines) from the zero lines indicated on cach contour map.
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