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Title: Structural phase transition of BaZrO{sub 3} under high pressure

Abstract

We studied the phase transition behavior of cubic BaZrO{sub 3} perovskite by in situ high pressure synchrotron X-ray diffraction experiments up to 46.4 GPa at room temperature. The phase transition from cubic phase to tetragonal phase was observed in BaZrO{sub 3} for the first time, which takes place at 17.2 GPa. A bulk modulus 189 (26) GPa for cubic BaZrO{sub 3} is derived from the pressure–volume data. Upon decompression, the high pressure phase transforms into the initial cubic phase. It is suggested that the unstable phonon mode caused by the rotation of oxygen octahedra plays a crucial role in the high pressure phase transition behavior of BaZrO{sub 3}.

Authors:
; ; ; ; ; ; ; ;  [1];  [2]
  1. State Key Laboratory of Superhard Materials, Jilin University, Changchun 130012 (China)
  2. Beijing Synchrotron Radiation Facility, Institute of High Energy Physics, Chinese Academy of Sciences, Beijing 100049 (China)
Publication Date:
OSTI Identifier:
22271129
Resource Type:
Journal Article
Resource Relation:
Journal Name: Journal of Applied Physics; Journal Volume: 115; Journal Issue: 12; Other Information: (c) 2014 AIP Publishing LLC; Country of input: International Atomic Energy Agency (IAEA)
Country of Publication:
United States
Language:
English
Subject:
75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND SUPERFLUIDITY; BARIUM COMPOUNDS; CUBIC LATTICES; IMPACT STRENGTH; PHASE TRANSFORMATIONS; PHONONS; PRESSURE DEPENDENCE; PRESSURE RANGE GIGA PA; TETRAGONAL LATTICES; X-RAY DIFFRACTION; ZIRCONATES

Citation Formats

Yang, Xue, Li, Quanjun, Liu, Ran, Liu, Bo, Zhang, Huafang, Jiang, Shuqing, Zou, Bo, Cui, Tian, Liu, Bingbing, E-mail: liubb@jlu.edu.cn, and Liu, Jing. Structural phase transition of BaZrO{sub 3} under high pressure. United States: N. p., 2014. Web. doi:10.1063/1.4868906.
Yang, Xue, Li, Quanjun, Liu, Ran, Liu, Bo, Zhang, Huafang, Jiang, Shuqing, Zou, Bo, Cui, Tian, Liu, Bingbing, E-mail: liubb@jlu.edu.cn, & Liu, Jing. Structural phase transition of BaZrO{sub 3} under high pressure. United States. doi:10.1063/1.4868906.
Yang, Xue, Li, Quanjun, Liu, Ran, Liu, Bo, Zhang, Huafang, Jiang, Shuqing, Zou, Bo, Cui, Tian, Liu, Bingbing, E-mail: liubb@jlu.edu.cn, and Liu, Jing. Fri . "Structural phase transition of BaZrO{sub 3} under high pressure". United States. doi:10.1063/1.4868906.
@article{osti_22271129,
title = {Structural phase transition of BaZrO{sub 3} under high pressure},
author = {Yang, Xue and Li, Quanjun and Liu, Ran and Liu, Bo and Zhang, Huafang and Jiang, Shuqing and Zou, Bo and Cui, Tian and Liu, Bingbing, E-mail: liubb@jlu.edu.cn and Liu, Jing},
abstractNote = {We studied the phase transition behavior of cubic BaZrO{sub 3} perovskite by in situ high pressure synchrotron X-ray diffraction experiments up to 46.4 GPa at room temperature. The phase transition from cubic phase to tetragonal phase was observed in BaZrO{sub 3} for the first time, which takes place at 17.2 GPa. A bulk modulus 189 (26) GPa for cubic BaZrO{sub 3} is derived from the pressure–volume data. Upon decompression, the high pressure phase transforms into the initial cubic phase. It is suggested that the unstable phonon mode caused by the rotation of oxygen octahedra plays a crucial role in the high pressure phase transition behavior of BaZrO{sub 3}.},
doi = {10.1063/1.4868906},
journal = {Journal of Applied Physics},
number = 12,
volume = 115,
place = {United States},
year = {Fri Mar 28 00:00:00 EDT 2014},
month = {Fri Mar 28 00:00:00 EDT 2014}
}
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