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 = 40 K
_database_code_amcsd 0018585
4.0035 4.0035 4.0035 89.843 89.843 89.843 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 -.0014 -.0014 -.0014 -.0014 -.0039 -.0039 -.0039
Ti   .4847 .4847 .4847  .0019  .0019  .0019  .0019 -.0005 -.0005 -.0005
O    .5088 .5088 .0183  .0028  .0039  .0039  .0008  .0002  .0016  .0016