Linking Local Structure to Functionality in High-Entropy Oxides

ORAL · Invited

Abstract

High-entropy oxides (HEOs) represent a new frontier in functional ceramics, where extreme chemical disorder enables properties unattainable in conventional materials. By combining multiple cations on a single sublattice, HEOs harness configurational entropy to stabilize phases and expand the accessible design space. This talk narrates how structural and functional behavior in HEOs can be tuned by composition and processing. We show that disorder can be leveraged to control magnetic transitions, structural phases, and other emergent phenomena in both bulk and thin-film forms. Polycrystalline powders and epitaxial films are synthesized using solid-state and physical vapor-based methods, then characterized with magnetometry, X-ray diffraction, synchrotron spectroscopy, and electron microscopy to probe behavior across multiple length scales. These measurements reveal how subtle changes in local coordination and cation distribution drive large shifts in macroscopic properties. Importantly, we find that entropy-driven design strategies not only stabilize unusual phases but also allow systematic control over magnetic, structural, and electronic responses. This framework highlights new routes for tailoring performance in systems where conventional approaches are limited. By bridging atomic-scale disorder with application-relevant properties, these studies expand our understanding of disorder–property relationships and establish high-entropy ceramics as versatile platforms for sensing, magnetic, and energy technologies. The results underscore how chemical complexity, far from being a barrier, can be a deliberate tool for materials discovery.

Publication: C.M. Rost, E. Sachet, T. Borman, A. Moballegh, E. Dickey, D. Hou, J. Jones, S. Curtarolo*, J-P. Maria*, Entropy-stabilized oxides, Nature Communications, Vol. 6, Sept. 2015, 8485.
G.R. Bejger, M.K. Caucci, S.S.I. Almishal, G.N. Kotsonis, J-P. Maria, S. Sinnott, C.M. Rost*, "Investigation of the cation valence and coordination of (LaPrCeSmY)0.2O2 using XANES." Materials Chemistry A, Vol. 13, August 2025, 29060-29069.
G.E. Niculescu, G.R. Bejger, J.P. Barber, J.T. Wright, S.S.I. Almishal, M. Webb, S.V.G. Ayyagari, J-P. Maria, N. Alem, C.M. Rost*. "Local Structure Maturation in High Entropy Oxide (Mg,Co,Ni,Cu,Zn)1-x(Cr,Mn)xO Thin Films." Journal of the American Ceramic Society, October 2024, 10.1111/jace.20171.
L. Min, J.P. Barber, Y. Wang, S.V.G. Ayyagari, G.E. Niculescu, E. Krysko, G.R. Bejger, L.Miao, S.H. Lee, Q. Zhang, N. Alem, C. M. Rost*, Z. Mao*; High Entropy Protected Sharp Magnetic Transitions in Highly Disordered Spinel Ferrites. Journal of the American Chemical Society, August 2024, 10.1021/jacs.4c04765.
E. Krysko, L. Min, Y. Wang, N. Zhang, J.P. Barber, G.E. Niculescu, J.T. Wright, F. Li, K. Burrage, M. Matsuda, R. A. Robinson, Q. Zhang, R. Katzbaer, R. Schaak, M. Terrones, C.M. Rost* and Z. Mao*, Studies on the Structure and the Magnetic Properties of High-Entropy Spinel Oxide (Mg,Mn,Fe,Co,Ni)Al2O4, APL Materials, Vol. 11, October 2023, 101123.

L. Min, M. Sretenovic, T.W. Valentine, T. Heitmann, R. Zu, V. Gopalan, C.M. Rost, X. Ke, Z. Mao, A topological kagome magnet in high entropy form, Communications Physics, Vol. 5, Mar. 2022, pp. 1-7.

Presenters

  • Christina Rost

    Virginia Tech

Authors

  • Christina Rost

    Virginia Tech