TY  - RPRT
TI  - Machine Learning-Accelerated First-Principles Molecular Dynamics Explains Anomalous Lattice Thermal Expansion in BaZr 0.78 Y 0.22 O 3-δ
AU  - Hudson, Blake G. [National Energy Technology Laboratory (NETL), Pittsburgh, PA (United States)]
AU  - Lee, Yueh-Lin [National Energy Technology Laboratory (NETL), Pittsburgh, PA (United States); National Energy Technology Laboratory (NETL) Support Contractor, Pittsburgh, PA (United States)] (ORCID:0000000324776412)
AU  - Abernathy, Harry W. [National Energy Technology Laboratory (NETL), Morgantown, WV (United States)] (ORCID:0000000304861476)
AU  - Saidi, Wissam [National Energy Technology Laboratory (NETL), Pittsburgh, PA (United States)] (ORCID:0000000167144832)
PY  - 2025
DO  - 10.1021/acs.jpclett.5c01724
UR  - https://www.osti.gov/biblio/2998009
ID  - 2998009
ER  -