Particle Shape Control via Etching of Core-Shell Nanocrystals

TL;DR

This paper explores a novel etching method in controlled environments to synthesize multi-component core-shell nanocrystals with diverse shapes, enhancing their functional properties for catalysis and plasmonics.

Contribution

It introduces a new etching technique combined with simulations to create complex nanocrystal shapes with controlled composition and structure.

Findings

Distinct non-equilibrium microstructures observed during etching.

Various complex shapes achieved at room temperature.

Structural and dynamic properties significantly altered after etching.

Abstract

The application of nanocrystals as heterogeneous catalysts and plasmonic nanoparticles requires fine control of their shape and chemical composition. A promising idea to achieve synergistic effects is to combine two distinct chemical and/or physical functionalities in bi-metallic core-shell nanocrystals. Although techniques for the synthesis of single-component nanocrystals with spherical or anisotropic shape are well established, new methods are sought to tailor multicomponent nanocrystals. Here, we probe etching in a controlled redox environment as a synthesis technique for multi-component nanocrystals. Our Monte Carlo computer simulations demonstrate the appearance of characteristic non-equilibrium intermediate microstructures that are further thermodynamically tested and analyzed with molecular dynamics. Convex platelet, concave polyhedron, pod, cage and strutted-cage shapes are obtained at room temperature with fully coherent structure exposing crystallographic facets and chemical elements along distinct particle crystallographic directions. We observe that structural and dynamic properties are markedly modified compared to the untreated compact nanocrystal.