In order to build the phase diagram of Cu-Ag nanoalloys, segregation isotherms for the different sites of the outer shell of a 405-atom cluster have been obtained by means of Monte Carlo simulations using N-body interatomic potentials. A dynamical equilibrium in phase space is observed for the (001) facets as well as for the (111) facets of the truncated octahedron. For the (001) facets, the bistability originates from a structural transition, the facets oscillating collectively between a Cu-rich square shape of coordinence 4 and an Ag-rich diamond shape of coordinence 6. For the (111) facets, the bistability is purely chemical and affects each facet individually. We thus predict the possible coexistence of Cu-pure and Ag-pure (111) facets within the same nanoparticle.
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http://dx.doi.org/10.1103/PhysRevLett.103.205701 | DOI Listing |
Materials (Basel)
January 2025
State Key Laboratory of Solidification Processing, Northwestern Polytechnical University, No. 127, Youyi Road (West), Xi'an 710072, China.
In this work, the high cycle fatigue behavior and tensile properties of Ti-Al-Mo-Cr-V-Nb-Zr-Sn titanium alloy at room temperature with a basketweave structure and bimodal structure were studied. The results show that the fatigue strength of the basketweave structure is higher, while the balance of strength and plasticity of the bimodal microstructure is better. However, the fatigue performance of the bimodal microstructure is unstable due to the bilinear phenomenon of the S-N curve.
View Article and Find Full Text PDFNano Lett
January 2025
Department of Materials Science and Engineering, Stanford University, Stanford, California 94305, United States.
The aqueous zinc metal battery holds great potential for large-scale energy storage due to its safety, low cost, and high theoretical capacity. However, challenges such as corrosion and dendritic growth necessitate controlled zinc deposition. This study employs epitaxy to achieve large-area, dense, and ultraflat zinc plating on textured copper foil.
View Article and Find Full Text PDFAcc Chem Res
January 2025
Department of Chemistry , University of California, Berkeley, California 94720, United States.
ConspectusColloidal nanocrystals are an interesting platform for studying the surface chemistry of materials due to their high surface area/volume ratios, which results in a large fraction of surface atoms. As synthesized, the surfaces of many colloidal nanocrystals are capped by organic ligands that help control their size and shape. While these organic ligands are necessary in synthesis, it is often desirable to replace them with other molecules to enhance their properties or to integrate them into devices.
View Article and Find Full Text PDFChem Asian J
January 2025
Yamanashi Daigaku, Clean Energy Research Center, 4-3-11 Takeda, 4008511, Kofu, JAPAN.
Oxide-derived copper (OD-Cu) has attracted considerable attention due to its exceptional electrocatalytic performance toward various reactions, including the reduction of nitrate (NO3-) to ammonia (NH3). Furthermore, numerous techniques have been developed to synthesize copper oxides with well-defined surface orientations. However, the relationship between the surface orientation of the precursor and the NO3- reduction performance of the resulting OD-Cu catalyst remains unclear.
View Article and Find Full Text PDFACS Appl Mater Interfaces
January 2025
CSIR-National Chemical Laboratory, Dr. Homi Bhabha Road, Pune 411008, India.
The tunability of the energy bandgap in the near-infrared (NIR) range uniquely positions colloidal lead sulfide (PbS) quantum dots (QDs) as a versatile material to enhance the performance of existing perovskite and silicon solar cells in tandem architectures. The desired narrow bandgap (NBG) PbS QDs exhibit polar (111) and nonpolar (100) terminal facets, making effective surface passivation through ligand engineering highly challenging. Despite recent breakthroughs in surface ligand engineering, NBG PbS QDs suffer from uncontrolled agglomeration in solid films, leading to increased energy disorder and trap formation.
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