3 papers
cond-mat.mtrl-sci2026
Oxygen vacancies beyond the dilute limit in doped CaMnO3 perovskites and implications for screening materials in thermochemical applications
Harender S. Dhattarwal, Colin M. Hylton-Farrington, Ian G. McKendry +2
Thermochemical energy storage (TCES) in oxide perovskites relies on reversible oxygen vacancy formation, and computational high-throughput screening of candidate materials has pred…
physics.chem-ph2025
Electronic Fluctuations and Ionic Dynamics in Molten Silver Iodide
Harender S. Dhattarwal, Richard C. Remsing
Molten salts are high-temperature ionic liquids whose unique combination of strong Coulombic interactions, large polarizabilities, and high ionic conductivities makes them central…
cond-mat.mtrl-sci2025
Electronic Paddlewheels Impact the Dynamics of Superionic Conduction in AgI
Harender S. Dhattarwal, Richard C. Remsing
Solid-state ion conductors hold promise as next generation battery materials. To realize their full potential, an understanding of atomic-scale ion conduction mechanisms is needed,…