Thangavelu, K and Rayaprol, S and Siruguri, V and Sastry, P U and Asthana, Saket
(2015)
Global and local structural variations near the antiferroelectric regime.
AIP Conference Proceedings, 1665 (030030).
ISSN 0094-243X
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Abstract
Rietveld refinement of neutron and x-ray diffraction data of Na 0.5Bi0.5TiO3 shows R3c phase stabilization at room temperature. The intermediate antiferroelectric region between 180°C to 280°C exhibits phase coexistence i.e R3c + Pnma, along with decrease in octahedral tilt angle and increase in unit cell volume. The local structural changes observed from Raman scattering in the A-O, Ti-O and TiO6 phonon modes favor the global structural variation. A possible antiparallel cation displacement due to Pnma phase formation leads to the origin of antiferroelectric ordering in Na 0.5Bi0.5TiO3.
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