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Experimental determination of the energy difference between competing isomers of deposited, size-selected gold nanoclusters

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  • D. M. Foster

    (University of Birmingham)

  • R. Ferrando

    (University of Genoa)

  • R. E. Palmer

    (Swansea University, Bay Campus, Fabian Way)

Abstract

The equilibrium structures and dynamics of a nanoscale system are regulated by a complex potential energy surface (PES). This is a key target of theoretical calculations but experimentally elusive. We report the measurement of a key PES parameter for a model nanosystem: size-selected Au nanoclusters, soft-landed on amorphous silicon nitride supports. We obtain the energy difference between the most abundant structural isomers of magic number Au561 clusters, the decahedron and face-centred-cubic (fcc) structures, from the equilibrium proportions of the isomers. These are measured by atomic-resolution scanning transmission electron microscopy, with an ultra-stable heating stage, as a function of temperature (125–500 °C). At lower temperatures (20–125 °C) the behaviour is kinetic, exhibiting down conversion of metastable decahedra into fcc structures; the higher state is repopulated at higher temperatures in equilibrium. We find the decahedron is 0.040 ± 0.020 eV higher in energy than the fcc isomer, providing a benchmark for the theoretical treatment of nanoparticles.

Suggested Citation

  • D. M. Foster & R. Ferrando & R. E. Palmer, 2018. "Experimental determination of the energy difference between competing isomers of deposited, size-selected gold nanoclusters," Nature Communications, Nature, vol. 9(1), pages 1-6, December.
  • Handle: RePEc:nat:natcom:v:9:y:2018:i:1:d:10.1038_s41467-018-03794-9
    DOI: 10.1038/s41467-018-03794-9
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