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A structural study of Ruddlesden-Popper phases Sr3-xYx(Fe1.25Ni0.75)O7-delta with x <= 0.75 by neutron powder diffraction and EXAFS/XANES spectroscopy
Stockholm University, Faculty of Science, Department of Materials and Environmental Chemistry (MMK).
Stockholm University, Faculty of Science, Department of Materials and Environmental Chemistry (MMK). University of Warsaw, Poland; Chalmers University of Technology, Sweden.
Stockholm University, Faculty of Science, Department of Materials and Environmental Chemistry (MMK).
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Number of Authors: 62018 (English)In: Journal of Materials Chemistry A, ISSN 2050-7488, Vol. 6, no 13, p. 5313-5323Article in journal (Refereed) Published
Abstract [en]

The structures of Ruddlesden-Popper n = 2 member phases Sr3-xYxFe1.25Ni0.75O7-delta with 0 <= x <= 0.75 have been investigated using neutron powder diffraction and K-edge Fe and Ni EXAFS/XANES spectroscopy in order to gain information about the evolution of the oxygen vacancy distribution and Fe/Ni oxidation state with x. Both samples prepared at 1300 degrees C under a flow of N-2(g), with delta = 1.41-1.00, and samples subsequently annealed in air at 900 degrees C, with delta = 0.44-0.59, were characterized. The as-prepared x = 0.75 phase has delta = 1, the O1 atom site is vacant, and the Fe3+/Ni2+ ions have a square pyramidal coordination. With decreasing x the O3 occupancy decreases nearly linearly to 81% for x = 0, while the O1 occupancy increases from 0 for x = 0.4 to 33% for x = 0. The air-annealed x = 0.75 sample has a delta value of 0.59 and the Fe3+/Fe4+/Ni2+/Ni3+ ions have both square pyramidal and octahedral coordination. With decreasing x, the delta value decreases to 0.45 for x = 0, implying an increase in the oxidation states of Fe/Ni ions. EXAFS/XANES data show that for the as-prepared samples the coordination changes are predominantly for Ni2+ ions and that the air-annealed samples contain both Fe3+/Fe4+ and Ni2+/Ni3+ ions.

Place, publisher, year, edition, pages
2018. Vol. 6, no 13, p. 5313-5323
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Chemical Sciences Environmental Engineering Materials Engineering
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URN: urn:nbn:se:su:diva-155952DOI: 10.1039/c7ta07113bISI: 000428670000011OAI: oai:DiVA.org:su-155952DiVA, id: diva2:1209035
Available from: 2018-05-21 Created: 2018-05-21 Last updated: 2022-03-23Bibliographically approved

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Grins, JekabsSvensson, Gunnar

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