A Theoretical Study of the Insertion of Atoms and Ions into Titanosilsequioxane (Ti-POSS) in Comparison with POSS

<table class="table-group" width="800px"><tr class="fig-image" id="a"><td><img alt="391325.fig.005a" src="https://static.hindawi.com/articles/ijps/volume-2012/391325/figures/391325.fig.005a.jpg"/></td></tr><tr class="fig-caption"><td align="center"><table><tr><td><b>(a) </b> Axial C<sub>s</sub></td></tr></table></td></tr><tr class="fig-image" id="b"><td><img alt="391325.fig.005b" src="https://static.hindawi.com/articles/ijps/volume-2012/391325/figures/391325.fig.005b.jpg"/></td></tr><tr class="fig-caption"><td align="center"><table><tr><td><b>(b) </b> Endo D<sub>4h</sub></td></tr></table></td></tr></table>

<table>The B3LYP/6-311+G(d) optimized geometries of the exohedral (Axial) and endohedral (Endo) complexes of Cl<sup>−</sup> and Ti-T<sub>8</sub> in angstroms.</table>

International Journal of Polymer Science

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Figure 5

Figure 5: A Theoretical Study of the Insertion of Atoms and Ions into Titanosilsequioxane (Ti-POSS) in Comparison with POSS 