Crystal structure analysis and high‐temperature phase transitions of complex rare‐earth perovskite, La2(Al1/2MgTa1/2)O6.

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Title: Crystal structure analysis and high‐temperature phase transitions of complex rare‐earth perovskite, La2(Al1/2MgTa1/2)O6.
Authors: Sohn, Yoo Jung1 (AUTHOR) y.sohn@fz-juelich.de, Mauer, Georg1 (AUTHOR), Roth, Georg2 (AUTHOR), Guillon, Olivier1,3 (AUTHOR), Vaßen, Robert1 (AUTHOR)
Source: Journal of the American Ceramic Society. Feb2020, Vol. 103 Issue 2, p1404-1413. 10p. 4 Diagrams, 2 Charts, 4 Graphs.
Subjects: Phase transitions, Crystal structure, Thermal barrier coatings, Rare earth metals, Symmetry groups, Rietveld refinement
Abstract: In situ high‐temperature powder X‐ray diffraction analysis (HT‐XRD) was carried out in the temperature range from 25°C‐1430°C to investigate the crystal structure of double perovskites, La2(Al1/2MgTa1/2)O6 (LAMT) and its phase transitions. This complex perovskite is a promising candidate for application in thermal barrier coating systems. Rietveld analysis shows a rock‐salt type ordering of the B‐site cations in the monoclinic space group symmetry, P21/n at room temperature. Upon heating, a structural phase transition occurs at ~855°C, and the crystal structure becomes rhombohedral with the space group symmetry R3¯. On further heating, LAMT transforms to the ideal cubic phase at ~1390°C with the space group symmetry Fm3¯m. Both of the structural phase transitions are completely reversible, and were confirmed through complementary differential scanning calorimetry and thermogravimetry measurements. With increasing temperature, the degree of the octahedral tilting decreases and the variance of the different B–O bond lengths is reduced, until in the cubic phase, no tilting is present, and almost equal B–O bond lengths are obtained. [ABSTRACT FROM AUTHOR]
Copyright of Journal of the American Ceramic Society is the property of Wiley-Blackwell and its content may not be copied or emailed to multiple sites without the copyright holder's express written permission. Additionally, content may not be used with any artificial intelligence tools or machine learning technologies. However, users may print, download, or email articles for individual use. This abstract may be abridged. No warranty is given about the accuracy of the copy. Users should refer to the original published version of the material for the full abstract. (Copyright applies to all Abstracts.)
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  Label: Title
  Group: Ti
  Data: Crystal structure analysis and high‐temperature phase transitions of complex rare‐earth perovskite, La<subscript>2</subscript>(Al<subscript>1/2</subscript>MgTa<subscript>1/2</subscript>)O<subscript>6</subscript>.
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  Data: <searchLink fieldCode="AR" term="%22Sohn%2C+Yoo+Jung%22">Sohn, Yoo Jung</searchLink><relatesTo>1</relatesTo> (AUTHOR)<i> y.sohn@fz-juelich.de</i><br /><searchLink fieldCode="AR" term="%22Mauer%2C+Georg%22">Mauer, Georg</searchLink><relatesTo>1</relatesTo> (AUTHOR)<br /><searchLink fieldCode="AR" term="%22Roth%2C+Georg%22">Roth, Georg</searchLink><relatesTo>2</relatesTo> (AUTHOR)<br /><searchLink fieldCode="AR" term="%22Guillon%2C+Olivier%22">Guillon, Olivier</searchLink><relatesTo>1,3</relatesTo> (AUTHOR)<br /><searchLink fieldCode="AR" term="%22Vaßen%2C+Robert%22">Vaßen, Robert</searchLink><relatesTo>1</relatesTo> (AUTHOR)
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  Data: <searchLink fieldCode="JN" term="%22Journal+of+the+American+Ceramic+Society%22">Journal of the American Ceramic Society</searchLink>. Feb2020, Vol. 103 Issue 2, p1404-1413. 10p. 4 Diagrams, 2 Charts, 4 Graphs.
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  Data: <searchLink fieldCode="DE" term="%22Phase+transitions%22">Phase transitions</searchLink><br /><searchLink fieldCode="DE" term="%22Crystal+structure%22">Crystal structure</searchLink><br /><searchLink fieldCode="DE" term="%22Thermal+barrier+coatings%22">Thermal barrier coatings</searchLink><br /><searchLink fieldCode="DE" term="%22Rare+earth+metals%22">Rare earth metals</searchLink><br /><searchLink fieldCode="DE" term="%22Symmetry+groups%22">Symmetry groups</searchLink><br /><searchLink fieldCode="DE" term="%22Rietveld+refinement%22">Rietveld refinement</searchLink>
– Name: Abstract
  Label: Abstract
  Group: Ab
  Data: In situ high‐temperature powder X‐ray diffraction analysis (HT‐XRD) was carried out in the temperature range from 25°C‐1430°C to investigate the crystal structure of double perovskites, La2(Al1/2MgTa1/2)O6 (LAMT) and its phase transitions. This complex perovskite is a promising candidate for application in thermal barrier coating systems. Rietveld analysis shows a rock‐salt type ordering of the B‐site cations in the monoclinic space group symmetry, P21/n at room temperature. Upon heating, a structural phase transition occurs at ~855°C, and the crystal structure becomes rhombohedral with the space group symmetry R3¯. On further heating, LAMT transforms to the ideal cubic phase at ~1390°C with the space group symmetry Fm3¯m. Both of the structural phase transitions are completely reversible, and were confirmed through complementary differential scanning calorimetry and thermogravimetry measurements. With increasing temperature, the degree of the octahedral tilting decreases and the variance of the different B–O bond lengths is reduced, until in the cubic phase, no tilting is present, and almost equal B–O bond lengths are obtained. [ABSTRACT FROM AUTHOR]
– Name: AbstractSuppliedCopyright
  Label:
  Group: Ab
  Data: <i>Copyright of Journal of the American Ceramic Society is the property of Wiley-Blackwell and its content may not be copied or emailed to multiple sites without the copyright holder's express written permission. Additionally, content may not be used with any artificial intelligence tools or machine learning technologies. However, users may print, download, or email articles for individual use. This abstract may be abridged. No warranty is given about the accuracy of the copy. Users should refer to the original published version of the material for the full abstract.</i> (Copyright applies to all Abstracts.)
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      – Type: doi
        Value: 10.1111/jace.16740
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      – Code: eng
        Text: English
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        PageCount: 10
        StartPage: 1404
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      – SubjectFull: Phase transitions
        Type: general
      – SubjectFull: Crystal structure
        Type: general
      – SubjectFull: Thermal barrier coatings
        Type: general
      – SubjectFull: Rare earth metals
        Type: general
      – SubjectFull: Symmetry groups
        Type: general
      – SubjectFull: Rietveld refinement
        Type: general
    Titles:
      – TitleFull: Crystal structure analysis and high‐temperature phase transitions of complex rare‐earth perovskite, La2(Al1/2MgTa1/2)O6.
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            NameFull: Sohn, Yoo Jung
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            NameFull: Mauer, Georg
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            NameFull: Roth, Georg
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            NameFull: Guillon, Olivier
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            NameFull: Vaßen, Robert
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            – D: 01
              M: 02
              Text: Feb2020
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              Y: 2020
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            – TitleFull: Journal of the American Ceramic Society
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