In-situ X-ray diffraction study of carbonate formation and decomposition in perovskite-type BCFZ

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Original languageEnglish
Pages (from-to)1085-1089
Number of pages5
JournalJournal of solid state chemistry
Volume184
Issue number5
Early online date17 Mar 2011
Publication statusPublished - May 2011

Abstract

The effect of CO2 on the two phase perovskite with average composition of BaCo0.4Fe0.4Zr0.2O 3-δ is investigated by in-situ X-ray diffraction (XRD) as well as transmission electron microscopy (TEM). Partial decomposition of the BCFZ into high-temperature rhombohedral BaCO3 polymorph was observed during annealing in an atmosphere, which contained 50 vol% CO2/50 vol% N2 at 1173 K. This carbonate structure is not quenchable and cannot be detected by ex-situ methods. Additionally, the reversible phase transition of BaCO3 from orthorhombic to rhombohedral to cubic at different temperatures accompanied by formation of CoO was shown by in-situ XRD and TEM. Furthermore, complete regeneration of perovskite phase was obtained after high-temperature treatment under CO2-free conditions.

Keywords

    BCFZ, Carbonate, CO stability, In-situ XRD, Perovskite, Phase transition, TEM

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In-situ X-ray diffraction study of carbonate formation and decomposition in perovskite-type BCFZ. / Efimov, Konstantin; Czuprat, Oliver; Feldhoff, Armin.
In: Journal of solid state chemistry, Vol. 184, No. 5, 05.2011, p. 1085-1089.

Research output: Contribution to journalArticleResearchpeer review

Efimov K, Czuprat O, Feldhoff A. In-situ X-ray diffraction study of carbonate formation and decomposition in perovskite-type BCFZ. Journal of solid state chemistry. 2011 May;184(5):1085-1089. Epub 2011 Mar 17. doi: 10.1016/j.jssc.2011.03.023
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abstract = "The effect of CO2 on the two phase perovskite with average composition of BaCo0.4Fe0.4Zr0.2O 3-δ is investigated by in-situ X-ray diffraction (XRD) as well as transmission electron microscopy (TEM). Partial decomposition of the BCFZ into high-temperature rhombohedral BaCO3 polymorph was observed during annealing in an atmosphere, which contained 50 vol% CO2/50 vol% N2 at 1173 K. This carbonate structure is not quenchable and cannot be detected by ex-situ methods. Additionally, the reversible phase transition of BaCO3 from orthorhombic to rhombohedral to cubic at different temperatures accompanied by formation of CoO was shown by in-situ XRD and TEM. Furthermore, complete regeneration of perovskite phase was obtained after high-temperature treatment under CO2-free conditions.",
keywords = "BCFZ, Carbonate, CO stability, In-situ XRD, Perovskite, Phase transition, TEM",
author = "Konstantin Efimov and Oliver Czuprat and Armin Feldhoff",
note = "Funding Information: K.E. and A.F. gratefully acknowledge financial support by the State of Lower Saxony (Germany, NTH bottom-up project, No. 21-71023-25-7/09 ). O.C. appreciates funding from the European Union's Seventh Framework Program FP7/2007-2013 under grant agreement No. 228701 . The authors gratefully acknowledge fruitful discussions with Prof. J{\"u}rgen Caro.",
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AU - Efimov, Konstantin

AU - Czuprat, Oliver

AU - Feldhoff, Armin

N1 - Funding Information: K.E. and A.F. gratefully acknowledge financial support by the State of Lower Saxony (Germany, NTH bottom-up project, No. 21-71023-25-7/09 ). O.C. appreciates funding from the European Union's Seventh Framework Program FP7/2007-2013 under grant agreement No. 228701 . The authors gratefully acknowledge fruitful discussions with Prof. Jürgen Caro.

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N2 - The effect of CO2 on the two phase perovskite with average composition of BaCo0.4Fe0.4Zr0.2O 3-δ is investigated by in-situ X-ray diffraction (XRD) as well as transmission electron microscopy (TEM). Partial decomposition of the BCFZ into high-temperature rhombohedral BaCO3 polymorph was observed during annealing in an atmosphere, which contained 50 vol% CO2/50 vol% N2 at 1173 K. This carbonate structure is not quenchable and cannot be detected by ex-situ methods. Additionally, the reversible phase transition of BaCO3 from orthorhombic to rhombohedral to cubic at different temperatures accompanied by formation of CoO was shown by in-situ XRD and TEM. Furthermore, complete regeneration of perovskite phase was obtained after high-temperature treatment under CO2-free conditions.

AB - The effect of CO2 on the two phase perovskite with average composition of BaCo0.4Fe0.4Zr0.2O 3-δ is investigated by in-situ X-ray diffraction (XRD) as well as transmission electron microscopy (TEM). Partial decomposition of the BCFZ into high-temperature rhombohedral BaCO3 polymorph was observed during annealing in an atmosphere, which contained 50 vol% CO2/50 vol% N2 at 1173 K. This carbonate structure is not quenchable and cannot be detected by ex-situ methods. Additionally, the reversible phase transition of BaCO3 from orthorhombic to rhombohedral to cubic at different temperatures accompanied by formation of CoO was shown by in-situ XRD and TEM. Furthermore, complete regeneration of perovskite phase was obtained after high-temperature treatment under CO2-free conditions.

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KW - Carbonate

KW - CO stability

KW - In-situ XRD

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KW - Phase transition

KW - TEM

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