Shared and Closed-Shell O−O Interactions in Silicates
نویسندگان
چکیده
منابع مشابه
Shared and closed-shell O-O interactions in silicates.
Bond paths of maximum electron density spanning O-O edges shared between equivalent or quasiequivalent MOn (n > 4) coordination polyhedra are not uncommon electron density features displayed by silicates. On the basis of the positive values for the local electronic energy density, H(rc), at the bond critical points, rc, they qualify as weak "closed-shell" interactions. As observed for M-O bonde...
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ژورنال
عنوان ژورنال: The Journal of Physical Chemistry A
سال: 2008
ISSN: 1089-5639,1520-5215
DOI: 10.1021/jp076396j