American Mineralogist Crystal Structure Database

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BaTiO3
 
Kwei G H, Lawson A C, Billinge S J L, Cheong S W
Journal of Physical Chemistry 97 (1993) 2368-2377
Structures of the ferroelectric phases of barium titanate
Locality: synthetic
Note: T = 150 K
_database_code_amcsd 0018589
4.0057 4.0057 4.0057 89.846 89.846 89.846 R3m
atom     x     y     z  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Ba       0     0     0 .0012  .0012  .0012  .0012 -.0057 -.0057 -.0057
Ti   .4864 .4864 .4864 .0034  .0035  .0035  .0035 -.0020 -.0020 -.0020
O    .5093 .5093 .0181 .0028  .0041  .0041  .0006  .0004  .0010  .0010
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