Hidden Complexity in Stress‐Induced Phase Transformations of CeO 2 –ZrO 2 Ceramics
Year: 2026
Type: article
Abstract: ABSTRACT Ceria‐doped zirconia exhibits transformation‐induced plasticity, offering a path toward ductile ceramics. However, the atomic‐scale stress‐ and orientation‐dependent transformation mechanisms remain unclear. Here, we use large‐scale atomistic simulations based on a machine‐learning interatomic potential to study uniaxial compressions of pure and ceria‐doped tetragonal zirconia. The simulations reveal a transformation landscape far richer than the commonly assumed direct tetragonal‐to‐monoclinic pathway, with multiple metastable monoclinic and orthorhombic phases acting as intermediate or trapping states. Guided by the martensitic transformation theory, we show how doping and boundary conditions reshape this landscape and affect the resulting transformation strains and critical stresses.
DOI: 10.1111/jace.71007
Language: English
Subfield: Ceramics and Composites
Field: Materials Science
Domain: Physical Sciences
Open Access status: hybrid
Estimated APC paid: $4,070
OpenAlex ID: W7168795306
