Perovskites ABX3 under pressure: transition to post-perovskite CaIrO3 type and other scenarios

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dc.contributor.authorAvdeev, Men_AU
dc.contributor.authorYakovlev, SOen_AU
dc.date.accessioned2021-08-25T01:12:26Zen_AU
dc.date.available2021-08-25T01:12:26Zen_AU
dc.date.issued2008-08-01en_AU
dc.date.statistics2021-08-24en_AU
dc.description.abstractRecently we have performed a systematic quantitative analysis of crystal structure distortion for ~1300 ABX3 perovskites in terms of Ato B-site polyhedra volume ratios VA/VB [1]. The analysis identified a number of compositions close to the boundary of perovskite type stability which we have studied experimentally by in situ high pressure synchrotron X-ray powder diffraction. Here we will present the results of these experiments for several materials studied under pressure for the first time and will discuss our theoretical and experimental findings focusing on the following aspects of perovskite (pv) and post-perovskite CaIrO3 (ppv) structure types: (1) interplay between geometry and symmetry in distorted perovskites (is there any intermediate phase between pv and ppv?); (2) topological and geometrical constraints for ABX3 stoichiometry (what might be the structure of hypothetical structure types denser than ppv?); and (3) the effect of vacancies in ABX3 and pressure-induced amorphization as an alternative to pv-ppv transition. © International Union of Crystallographyen_AU
dc.identifier.citationAvdeev, M., & Yakovlev, S. (2008). Perovskites ABX3 under pressure: transition to post-perovskite CaIrO3 type and other scenarios. Presentation at XXI IUCr Congress Osaka, Japan, 23-31 August 2008. In Acta Crystallographica Section A: Foundations and Advances, 64(a1), C75. doi:10.1107/S0108767308097614en_AU
dc.identifier.conferenceenddate31 August 2008en_AU
dc.identifier.conferencenameXXI IUCr Congressen_AU
dc.identifier.conferenceplaceOsaka, Japanen_AU
dc.identifier.conferencestartdate23 August 2008en_AU
dc.identifier.issn2053-2733en_AU
dc.identifier.issuea1en_AU
dc.identifier.journaltitleActa Crystallographica Section A: Foundations and Advancesen_AU
dc.identifier.paginationC75en_AU
dc.identifier.urihttps://doi.org/10.1107/S0108767308097614en_AU
dc.identifier.urihttps://apo.ansto.gov.au/dspace/handle/10238/11489en_AU
dc.identifier.volume64en_AU
dc.language.isoenen_AU
dc.publisherInternational Union of Crystallographyen_AU
dc.subjectCrystal structureen_AU
dc.subjectPerovskitesen_AU
dc.subjectX-ray diffractionen_AU
dc.subjectStoichiometryen_AU
dc.subjectPressure range mega pa 10-100en_AU
dc.subjectVacanciesen_AU
dc.titlePerovskites ABX3 under pressure: transition to post-perovskite CaIrO3 type and other scenariosen_AU
dc.typeConference Abstracten_AU
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