Glazer A M, Mabud S A
Acta Crystallographica B34 (1978) 1065-1070
Powder profile refinement of lead zirconate titanate at several temperatures.
II. Pure PbTiO3
Locality: synthetic
Sample: T = 550 C
_database_code_amcsd 0009632
3.97 3.97 3.97 90 90 90 P4/mmm
atom x y z Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
Pb 0 0 0 2.711 .042986 .042986 .042986 0 0 0
Ti .5 .5 .5 .694 .011341 .011341 .011341 0 0 0
O1 .5 .5 0 1.549 .013974 .013974 .047459 0 0 0
O2 .5 0 .5 1.549 .013974 .047459 .013974 0 0 0
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