“…34 the adsorption energy, particle shape, and the electronic structure of deposited Au nanoparticles and to influence their unique catalytic properties. 2,9,14,17,19,[25][26][27][28][29][30][31][32] Theoretical calculations have demonstrated that Au particles bind more strongly to a defect-rich surface compared with a defect-deficient surface and that significant charge transfer occurs from the titania support to the Au particles. 2,9,30,31 High-resolution STM combined with density functional theoretical (DFT) calculations 31 has confirmed that bridging oxygen vacancies are the active nucleation sites for Au particles on titania and that each vacancy site can bind approximately three Au atoms on average.…”