Structures of small gold cluster cations (Aun+, n<14): Ion mobility measurements versus density functional calculations
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Structure Determination of Isolated Metal Clusters via Far-Infrared SpectroscopySize dependence of the structures and energetic and electronic properties of gold clustersStructure and energetics of small gold nanoclusters and their positive ionsElectronic photodissociation spectroscopy of Aun- x Xe (n = 7-11) versus time-dependent density functional theory prediction.Photodissociation of small group-11 metal cluster ions: fragmentation pathways and photoabsorption cross sections.An investigation of enhanced secondary ion emission under Au(n)+ (n = 1-7) bombardment.Laser ablation synthesis of new gold arsenides using nano-gold and arsenic as precursors. Laser desorption ionisation time-of-flight mass spectrometry and spectrophotometry.Unraveling the Planar-Globular Transition in Gold Nanoclusters through Evolutionary Search.Determining the size-dependent structure of ligand-free gold-cluster ions.CO oxidation as a prototypical reaction for heterogeneous processes.Probing the electronic properties and structural evolution of anionic gold clusters in the gas phase.Stabilized gold clusters: from isolation toward controlled synthesis.Understanding ligand effects in gold clusters using mass spectrometry.Gas phase metal cluster model systems for heterogeneous catalysis.SCC-DFTB parameters for simulating hybrid gold-thiolates compounds.Probing the structures of gas-phase rhodium cluster cations by far-infrared spectroscopy.Observation of linear to planar structural transition in sulfur-doped gold clusters: Au(x)S- (x = 2-5).The shape of Au8: gold leaf or gold nugget?Density functional study of the interaction between small Au clusters, Au(n) (n=1-7) and the rutile TiO2 surface. II. Adsorption on a partially reduced surface.Structures of neutral and anionic Au(16) clusters revisited.Binding of propene on small gold clusters and on Au(111): simple rules for binding sites and relative binding energies.Global minimization of gold clusters by combining neural network potentials and the basin-hopping method.Small tin cluster anions: transition from quasispherical to prolate structures.Comparative study of the structures of copper, silver, and gold icosamers: Influence of metal type and charge state.Au19M (M=Cr, Mn, and Fe) as magnetic copies of the golden pyramid.Multiple adsorption of molecular oxygen on small Au/Pd cationic clusters at finite temperature. A van der Waals density functional study.Synthesis, characterization and optical properties of low nuclearity liganded silver clusters: Ag31(SG)19 and Ag15(SG)11.On the structures and bonding in boron-gold alloy clusters: B6Au(n)- and B6Au(n) (n = 1-3).Superoxide formation on isolated cationic gold clusters.First-principles study of intermediate size silver clusters: Shape evolution and its impact on cluster properties.Density functional study on size-dependent structures, stabilities, electronic and magnetic properties of Au(n)M (M = Al and Si, n = 1-9) clusters: comparison with pure gold clusters.Geometric and electronic properties of gold clusters doped with a single oxygen atom.Improved tandem mass spectrometer coupled to a laser vaporization cluster ion source.DFT global optimisation of gas-phase and MgO-supported sub-nanometre AuPd clusters.Evaluation of photodissociation spectroscopy as a structure elucidation tool for isolated clusters: a case study of Ag4(+) and Au4(+).Relaxation dynamics and structural isomerism in Nb10 and Nb10+.Theoretical study of structural and optical properties of noble metal cluster-dipeptide hybrids at defect centers of MgO.Free gold clusters: beyond the static, monostructure description.The role of dimensionality on the quenching of spin-orbit effects in the optics of gold nanostructures.Experimental vibrational spectra of gas-phase tantalum cluster cations.
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Structures of small gold cluster cations (Aun+, n<14): Ion mobility measurements versus density functional calculations
description
article
@en
im März 2002 veröffentlichter wissenschaftlicher Artikel
@de
wetenschappelijk artikel
@nl
наукова стаття, опублікована в березні 2002
@uk
name
Structures of small gold clust ...... ensity functional calculations
@en
Structures of small gold clust ...... ensity functional calculations
@nl
type
label
Structures of small gold clust ...... ensity functional calculations
@en
Structures of small gold clust ...... ensity functional calculations
@nl
prefLabel
Structures of small gold clust ...... ensity functional calculations
@en
Structures of small gold clust ...... ensity functional calculations
@nl
P2093
P2860
P356
P1476
Structures of small gold clust ...... ensity functional calculations
@en
P2093
Filip Furche
Manfred M. Kappes
Patrick Weis
Reinhart Ahlrichs
Stefan Gilb
P2860
P304
P356
10.1063/1.1445121
P407
P577
2002-03-08T00:00:00Z