Simulation-Guided Preparation of Copper Chalcogenide Nanoparticle-Based Transparent Photothermal Coating with Enhanced Deicing Performance

In this investigation, transparent photothermal coatings utilizing plasmonic copper chalcogenide (Cu₂–_xS) nanoparticles were designed and fabricated for the deicing of glass surfaces. Cu₂–_xS nanoparticles, chosen for their high near-infrared (NIR) absorption and efficient photothermal conversion, were analyzed via finite difference time domain (FDTD) simulations to optimize nanoparticle morphology, thus avoiding costly trial-and-error synthesis. FDTD simulations determined that Cu₂–_xS nanorods (Cu-NRs) with an optimal aspect ratio of 2.2 had superior NIR absorption. Guided by FDTD simulations, the composite coating composed of Cu-NRs in clear acrylic resin paint was brush-coated to glass, achieving 62.4% visual transmittance and over 95% NIR absorbance. Photothermal conversion tests exhibited a significant temperature increase, with the coating reaching 65 °C under NIR irradiation within 6 min. The dynamic deicing process of ice beads on the coating at −20 °C completed within 220s, in contrast to the frozen state on glass coated with clear acrylic resin paint. Furthermore, heat transfer simulations in COMSOL illustrated melting initiation at the ice-coating interface and subsequent progression through the ice layer. This simulation-driven synthesis method and photothermal testing offer a design framework for the fabrication of photothermal deicing coatings with applications for automobiles, buildings, and aircraft in cold environments. © 2024 American Chemical Society