Molecular Adsorption Changes the Quantum Structure of Oxide-Supported Gold Nanoparticles: Chemisorption versus Physisorption

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Molecular Adsorption Changes the Quantum Structure of Oxide-Supported Gold Nanoparticles: Chemisorption versus Physisorption.

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adsorption versus dissociative chemisorption

Ž . Ab initio embedded cluster calculations of water interaction with the TiO 110 surface predict that molecular adsorption 2 is more favorable than dissociative chemisorption. Unlike all previous calculations, this result is in agreement with recent temperature-programmed desorption and modulated beams experiments. Calculated surface relaxation, water adsorption energy and the densities of ele...

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Chemisorption sites of CO on small gold clusters and transitions from chemisorption to physisorption.

Gold clusters adsorbed with CO, Au(m)(CO)(n) (-) (m=2-5; n=0-7), were studied by photoelectron spectroscopy (PES). The first few CO adsorptions were observed to induce significant redshifts to the PES spectra relative to pure gold clusters. For each Au cluster, a critical CO number (n(c)) was observed, beyond which the PES spectra of Au(m)(CO)(n) (-) change very little with increasing n. n(c) w...

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ژورنال

عنوان ژورنال: Physical Review Letters

سال: 2015

ISSN: 0031-9007,1079-7114

DOI: 10.1103/physrevlett.115.036804