Identifying spectral descriptors for protonation in BaZr₀.₈Y₀.₂O₃₋ₓ with electron energy loss spectroscopy
Jul 24, 2024·,
,,,,,·
0 min read
Yea-Shine Lee
Roberto dos Reis
Linding Yuan
Zhi Li
Elizabeth Griffin
Chris Wolverton
James M. Rondinelli
Vinayak P. Dravid
Abstract
The hydrogen economy is of paramount importance in the global transition
to a sustainable, clean energy source that contributes to decarbonization
efforts. For example, the proton conducting proton ceramic fuel cells
(PCFCs) play a crucial role in promoting hydrogen energy technology. In
a PCFC, the electrolyte is typically a solid oxide material that enables
proton transport and can operate at temperatures lower than those of
traditional oxygen ion conducting fuel cells. The reduced operating
temperature of PCFCs contributes to their durability, scalability, and
efficiency. BaZr₀.₈Y₀.₂O₃₋ₓ (BZY) is one such promising proton conducting
solid oxide electrolyte. This conference contribution uses electron
energy loss spectroscopy (EELS) paired with first-principles spectra to
identify the local spectroscopic descriptors of proton incorporation in
BZY — connecting nanoscale STEM-EELS measurements to functional behaviour
of the protonic-ceramic electrolyte.
Type
Publication
Microscopy and Microanalysis 30, Suppl. 1, ozae044.582 (2024)

Authors
I develop predictive theories of condensed matter materials and propose them for experimentalists to make. My work pairs first-principles calculations with symmetry analysis to discover new classes of materials with interesting electronic and magnetic properties. Specific material class of interests include semicondcutors and ferroic materials. My recent interest extends to integrating these methods into agentic workflows to accelerate materials discovery.
I moved to Evanston in May 2023 to join the Rondinelli Group at Northwestern University as a research associate.