Crystal structure of metastable perovskite Bi(Mg1/2Ti1/2)O3:: Bi-based structural analogue of antiferroelectric PbZrO3

被引:114
作者
Khalyavin, Dmitry D. [1 ]
Salak, Andrei N.
Vyshatko, Nikolai P.
Lopes, Augusto B.
Olekhnovich, Nikolai M.
Pushkarev, Anatoly V.
Maroz, Ivan I.
Radyush, Yury V.
机构
[1] Univ Aveiro, CICECO, Dept Ceram & Glass Engn, P-3810193 Aveiro, Portugal
[2] Natl Acad Sci, Inst Solid State & Semicond Phys, Minsk 220072, BELARUS
关键词
D O I
10.1021/cm061129w
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
A metastable perovskite phase of Bi(Mg1/2Ti1/2)O-3 composition (BMT) has been obtained under high-pressure (6 GPa) and high-temperature (1270 K) conditions. X-ray and electron diffraction studies have revealed a complex superstructure originating from antiferroelectric-like displacements of Bi3+ cations and octahedral tilting. A group theoretical analysis was used to enumerate the possible crystal structures compatible with both types of the distortions. On the basis of the symmetry arguments in combination with the diffraction methods, it has been concluded that the perovskite BMT is characterized by the orthorhombic Pnnm space group with unit cell parameters a = 11.3207(10) angstrom, b = 5.6433(10) angstrom, and c = 7.8314(10) angstrom. A relation of the BMT crystal structure to that commonly accepted for antiferroelectric perovskite PbZrO3 (PZ) is discussed.
引用
收藏
页码:5104 / 5110
页数:7
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