Continuous Encodable Reshaping of Gold Nanocrystals through Facet Modulation

Shape control of nanocrystals (NCs) is crucial for tuning their assembly behavior and functional properties, yet the precise manipulation of facet composition remains challenging. Here, we present a nanocrystal reshaping strategy to control and modulate the facets of gold (Au) NCs. Our one-pot approach, conducted at room temperature, requires only initial Au NCs, Au³⁺ ions, and surfactants, distinguishing it from conventional reduction-mediated “etching-and-regrowth” methods. Detailed structural studies using electron microscopy, small-angle X-ray scattering (SAXS), and UV−vis spectroscopy reveal the surfactant-encoded pathway for NC transformation from shaped particles to spheres and then into various polyhedral shapes while preserving the individual particles' volume. The proposed reshaping mechanism involves the dissolution of surface Au atoms into Au⁺ complexes in the presence of Au³⁺ and surfactant, followed by surfactant-guided redeposition and formation of facets with different atomic planes. Using the ethanol oxidation reaction (EOR) as a probe, we observe a quasi-linear decrease in onset potential and an increase in activity with increasing {100} facet exposure. This work broadens synthetic strategies by offering precise NC reshaping and facet control.. Authors: Lu, Fang [Brookhaven National Laboratory (BNL), Upton, NY (United States)] (ORCID:0000000337657615); Zhang, Yugang [Brookhaven National Laboratory (BNL), Upton, NY (United States)]; Zhang, Lihua [Brookhaven National Laboratory (BNL), Upton, NY (United States)] (ORCID:0000000333312345); Su, Dong [Brookhaven National Laboratory (BNL), Upton, NY (United States)]; Zhuang, Zechao [Columbia University, New York City, NY (United States)] (ORCID:0000000347881119). DOE Contract: SC0009476; SC0012704. Subjects: 36 MATERIALS SCIENCE; 37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CHEMISTRY; Chemical reactions; Gold; Nanoparticles; Surfactants; X-ray scattering