Electron Ptychography Images Hydrogen Atom Superlattices and 3D Inhomogeneities in Palladium Hydride Nanoparticles

TL;DR

This paper demonstrates the use of electron ptychography to directly image hydrogen atoms in palladium hydride nanoparticles, revealing superlattice ordering and 3D inhomogeneities that were previously unobservable.

Contribution

It introduces a novel application of electron ptychography for 3D imaging of hydrogen in metal hydrides, uncovering spatial hydrogen arrangements and heterogeneities.

Findings

Observation of 1D hydrogen superlattice in PdHx

Detection of 3D hydrogen clustering within nanoparticles

Revealing spatial heterogeneity in metal hydrides

Abstract

When hydrogen atoms occupy interstitial sites in metal lattices, they form metal hydrides (MHx), whose structural and electronic properties can differ significantly from the host metals. Owing to the small size of hydrogen atom and its unique interactions with the host metal, MHx is of broad interest in both fundamental science and technological applications. Determining where the hydrogen is located within the MHx, and whether it orders on the partially occupied interstitial sites is crucial for predicting and understanding the resultant physical and electronic properties of the hydride. Directly imaging hydrogen within a host material remains a major challenge due to its weak interaction with X-rays and electrons in conventional imaging techniques. Here, we employ electron ptychography, a scanning transmission electron microscopy technique, to image the three-dimensional (3D) distribution of H atoms in Palladium hydrides (PdHx) nanocubes, one of the most studied and industrially relevant MHx materials. We observe an unexpected one-dimensional superlattice ordering of hydrogen within the PdHx nanocubes and 3D hydrogen clustering in localized regions within PdHx nanocubes, revealing spatial heterogeneity in metal hydride nanoparticles previously inaccessible by other methods.