The role of π-bonding on the high temperature structures in the uranium double perovskites Ba2CaUO6 and BaSrCaUO6

dc.contributor.authorReynolds, EMen_AU
dc.contributor.authorThorogood, GJen_AU
dc.contributor.authorAvdeev, Men_AU
dc.contributor.authorBrand, HEAen_AU
dc.contributor.authorGu, QFen_AU
dc.contributor.authorKennedy, BJen_AU
dc.date.accessioned2021-07-16T04:04:28Zen_AU
dc.date.available2021-07-16T04:04:28Zen_AU
dc.date.issued2015-08-12en_AU
dc.date.statistics2021-07-02en_AU
dc.description.abstractThe high temperature structural behaviour of the uranium perovskites Ba2CaUO6 and BaSrCaUO6 has been investigated using a combination of synchrotron X-ray and neutron powder diffraction. Ba2CaUO6 undergoes a complex sequence of structures associated with the progressive loss of cooperative octahedral tilting: P21/n → I2/m → I2/m → I4/m → Fm[3 with combining macron]m. The observation of the intermediate tetragonal structure, I4/m, in this, contrasts with the previously reported rhombohedral R[3 with combining macron] intermediate formed by the Ba2SrUO6 oxide. The importance of π-bonding in determining the structural sequence is discussed. © The Royal Society of Chemistry 2015en_AU
dc.identifier.citationReynolds, E., Thorogood, G. J., Avdeev, M., Brand, H. E. A., Gu, Q., & Kennedy, B. J. (2015). The role of π-bonding on the high temperature structures in the uranium double perovskites Ba2CaUO6 and BaSrCaUO6. Dalton Transactions, 44(36), 16036-16044. doi:10.1039/C5DT02663Fen_AU
dc.identifier.issn1477-9234en_AU
dc.identifier.issue36en_AU
dc.identifier.journaltitleDalton Transactionsen_AU
dc.identifier.pagination16036-16044en_AU
dc.identifier.urihttps://doi.org/10.1039/C5DT02663Fen_AU
dc.identifier.urihttps://apo.ansto.gov.au/dspace/handle/10238/11081en_AU
dc.identifier.volume44en_AU
dc.language.isoenen_AU
dc.publisherRoyal Society of Chemistryen_AU
dc.subjectTemperature range 0400-1000 Ken_AU
dc.subjectUraniumen_AU
dc.subjectPerovskitesen_AU
dc.subjectX-ray diffractionen_AU
dc.subjectNeutron diffractionen_AU
dc.subjectOxidesen_AU
dc.titleThe role of π-bonding on the high temperature structures in the uranium double perovskites Ba2CaUO6 and BaSrCaUO6en_AU
dc.typeJournal Articleen_AU
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