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DFT Studies of Pt/Au Bimetallic Clusters and Their Interactions with the CO Molecule

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Outgoing claims: the papers this work cites, builds on, or argues with.

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Influence of ensemble size on CO chemisorption and catalytic n-hexane conversion by Au-Pt(111) bimetallic single-crystal surfaces
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A density functional theory study of CO adsorption on Pt–Au nanoparticles
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Reaction of platinum-gold cluster compounds with dihydrogen
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The catalysis of hydrogen-deuterium equilibration by platinum-gold cluster compounds
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Geometrical and Electronic Structures of Gold, Silver, and Gold−Silver Binary Clusters: Origins of Ductility of Gold and Gold−Silver Alloy Formation
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The Simple Cubic Structure of Ruthenium Clusters
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Structures of Platinum Clusters: Planar or Spherical?
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Composition-Controlled Synthesis of Bimetallic Gold−Silver Nanoparticles
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Surface Manipulation of the Electronic Energy of Subnanometer-Sized Gold Clusters: An Electrochemical and Spectroscopic Investigation
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C−N Coupling of Methane and Ammonia by Bimetallic Platinum−Gold Cluster Cations
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Gold–platinum alloy nanoparticle assembly as catalyst for methanol electrooxidation
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Fabrication of core-shell Au-Pt nanoparticle film and its potential application as catalysis and SERS substrateElectronic supplementary information (ESI) available: AFM image and line scans of core-shell Au-Pt nanoparticle film (colour version of Fig. 4). See…
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Reactions of alkanes and cycloalkanes on platinum–gold alloy films
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Platinum-Gold Cluster Compounds
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Atoms, molecules, solids, and surfaces: Applications of the generalized gradient approximation for exchange and correlation
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Ab initio molecular dynamics for liquid metals
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Erratum: Atoms, molecules, solids, and surfaces: Applications of the generalized gradient approximation for exchange and correlation
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Projector augmented-wave method
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Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set
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From ultrasoft pseudopotentials to the projector augmented-wave method

What points at this work

Incoming claims: where this work appears in other papers’ reference lists and arguments.

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CO adsorption on pure and binary-alloy gold clusters: A quantum chemical study
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Density functional study of CO adsorption on Scn (n=2–13) clusters
inferred← citeshttps://doi.org/10.1063/1.2993252openalex-snapshot
Gas binding to Au13, Au12Pd, and Au11Pd2 nanoclusters in the context of catalytic oxidation and reduction reactions
inferred← citeshttps://doi.org/10.1063/1.4761892openalex-snapshot
Theoretical study of AunV-CO, n = 1–14: The dopant vanadium enhances CO adsorption on gold clusters
inferred← citeshttps://doi.org/10.1063/1.4869019openalex-snapshot
Structural and electronic properties of Au n − x Pt x ( n = 2–14; x ⩽ n ) clusters: The density functional theory investigation
inferred← citeshttps://doi.org/10.1063/1.4906072openalex-snapshot
Optical absorption spectra of palladium doped gold cluster cations
inferred← citeshttps://doi.org/10.1063/5.0287869openalex-snapshot
A novel experimental setup for determination of CO content to characterize catalyst performance for application of sealed-off CO2 laser
inferred← citeshttps://doi.org/10.1071/ch11179openalex-snapshot
A Density Functional Theory Investigation of the Bimetallic Clusters Nb2Rh and NbRh2 and the Complexes They Form with CO
inferred← citeshttps://doi.org/10.1080/00268976.2014.983573openalex-snapshot
DFT studies on the interaction of PtxRuyMz(M = Fe, Ni, Cu, Mo, Sn,x+y+z= 4,x≥ 1,y≥ 1) alloy clusters with O2
inferred← citeshttps://doi.org/10.1080/00268976.2026.2623980openalex-snapshot
Geometrical features, electronic properties and chemical adsorptions of Co-doped Cu clusters
inferred← citeshttps://doi.org/10.1088/0957-4484/21/6/062001openalex-snapshot
Nanostructured catalysts in fuel cells
inferred← citeshttps://doi.org/10.1088/1361-648x/abb683openalex-snapshot
Density functional study of gallium clusters on graphene: electronic doping and diffusion
inferred← citeshttps://doi.org/10.1103/physrevb.81.174205openalex-snapshot
Free energy surface of two- and three-dimensional transitions of Au 12 nanoclusters obtained byab initiometadynamics
inferred← citeshttps://doi.org/10.1115/1.4024574openalex-snapshot
Preparation of Electrocatalysts for Polymer Electrolyte Fuel Cell Cathodes From Au-Pt Core-Shell Nanoparticles Synthesized by Simultaneous Aqueous-Phase Reduction
inferred← citeshttps://doi.org/10.1140/epjd/e2011-20055-xopenalex-snapshot
Structural, electronic and magnetic properties of AunPt (n = 1−12) clusters in comparison with corresponding pure Aun+1 (n = 1−12) clusters
inferred← citeshttps://doi.org/10.1140/epjd/e2012-20464-3openalex-snapshot
Theoretical investigation on the structure and electronic properties of bimetallic gold-zinc cluster cations and their monocarbonyls
inferred← citeshttps://doi.org/10.1140/epjd/e2014-40750-2openalex-snapshot
First principle study of the sensitivity of CO adsorption on pure and binary clusters of lead and silicon
inferred← citeshttps://doi.org/10.1149/1945-7111/ab754bopenalex-snapshot
Tailored Pt Coatings on Metallic Tin—An Effective Catalyst for Fuel Cells Anodes
inferred← citeshttps://doi.org/10.1149/2.018309jesopenalex-snapshot
Multilayered Nanoclusters of Platinum and Gold: Insights on Electrodeposition Pathways, Electrocatalysis, Surface and Bulk Compositional Properties
inferred← citeshttps://doi.org/10.1201/b17429-7openalex-snapshot
- Polymer Electrolyte Membranes
inferred← citeshttps://doi.org/10.1515/psr-2021-0141openalex-snapshot
Computational study of Cu n AgAu (n = 1–4) clusters invoking DFT based descriptors
inferred← citeshttps://doi.org/10.32657/10356/21206openalex-snapshot
Study of Pt-M (M=Au and Co) nano-catalysts with low Pt loading for PEMFC applications
inferred← citeshttps://doi.org/10.3389/fchem.2019.00644openalex-snapshot
A Global Optimizer for Nanoclusters
inferred← citeshttps://doi.org/10.3390/met13121973openalex-snapshot
Effect of Hf Dopant on Resistance to CO Toxicity on ZrCo(110) Surface for H Adsorption
inferred← citeshttps://doi.org/10.4028/www.scientific.net/amr.516-517.1889openalex-snapshot
Theory Study on the Geometric Structures and Electronic Properties of PtnN0,±(n=1-5) Clusters
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