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Structures of Platinum Oxide Clusters in the Gas Phase

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Kerpal,  Christian
Molecular Physics, Fritz Haber Institute, Max Planck Society;

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Harding,  Daniel J.
Molecular Physics, Fritz Haber Institute, Max Planck Society;

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Meijer,  Gerard
Molecular Physics, Fritz Haber Institute, Max Planck Society;

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Fielicke,  André
Molecular Physics, Fritz Haber Institute, Max Planck Society;

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Citation

Kerpal, C., Harding, D. J., Hermes, A. C., Meijer, G., Mackenzie, S. R., & Fielicke, A. (2013). Structures of Platinum Oxide Clusters in the Gas Phase. The Journal of Physical Chemistry A, 117(6), 1233-1239. doi:10.1021/jp3055137.


Cite as: https://hdl.handle.net/11858/00-001M-0000-000F-EEF6-3
Abstract
The structures of small gas-phase PtnO2m+ (n=1–6, m=1,2) cluster cations have been investigated in a combined infrared multiple photon dissociation (IRMPD) spectroscopy and density functional theory (DFT) study. On the basis of the infrared spectra obtained, it is concluded that in most clusters oxygen is bound dissociatively, preferring 2-fold bridge binding motifs, sometimes combined with singly coordinated terminal binding. Comparison of the oxide cluster structures with those of bare cationic platinum clusters reported previously reveals major structural changes induced in the platinum core upon oxygen binding. For some cluster sizes the presence of the Ar messenger atom(s) is found to induce a significant change in the observed cluster structure.