Vj. Fratello et Cd. Brandle, CALCULATION OF DIELECTRIC POLARIZABILITIES OF PEROVSKITE SUBSTRATE MATERIALS FOR HIGH-TEMPERATURE SUPERCONDUCTORS, Journal of materials research, 9(10), 1994, pp. 2554-2560
Dielectric polarizabilities for most of the ions in known perovskites
scale with the ionic volume and the valence. These ionic dielectric po
larizabilities and the ion additivity rule have been used to calculate
molecular dielectric polarizabilities for perovskite substrate materi
als used for high-temperature superconductors. Using the ion additivit
y rule to predict possible low permittivity compositions seems to sugg
est that the constraints of the perovskite structure and stoichiometry
, lattice match to high-temperature superconductors, and congruent mel
ting required for bulk growth limit the compositions to ones unlikely
to be superior to the currently available materials. The most limiting
factor on the relative permittivity of the perovskites is probably th
e close-packed nature and lack of voids in the structure. However, in
nonferroelectric perovskites, the polarizabilities derived from relati
ve permittivity data using the Clausius-Mossotti relation are signific
antly less than the calculated values, with deviations that correlate
with degree of cation compression. Use of cation compression to reduce
the polarizability shows some promise for improving dielectric consta
nts.