title: Effects of lattice polarity on interfacial space charges and defect disorder in ionically conducting AgI heterostructures.
abstract: Heterostructured (β/γ)-AgI exhibits a spontaneous lattice polarization not accounted for in standard space-charge models. This polarization field dominates the positional variation of energies of isolated defects, and Ag(+) vacancies and interstitials are stabilized at alternate [β/γ] interfaces. This suggests enhanced Frenkel pair separation, analogous to electronic charge separation in polar semiconductor heterostructures. Stoichiometric systems are, however, characterized by associated Frenkel pairs due to strong V(Ag)-Ag(i) interactions and show no enhancement of defect numbers. In nonstoichiometric systems, lattice polarization does direct the distribution of the excess defect species, and defect-defect interactions enhance local Frenkel pair concentrations at interfaces, suggesting that nonstoichiometry is critical to the extreme room-temperature ionic conductivities observed in heterostructured AgI nanoplates.
authors.affiliation: Department of Materials, University of Oxford, United Kingdom. benjamin.morgan@materials.ox.ac.uk
authors.forename: Benjamin J
authors.initials: BJ
authors.lastname: Morgan
authors.forename: Paul A
authors.initials: PA
authors.lastname: Madden