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CC=Collection Code: [AB2X4]=ANX Form: [cF56]=Pearson: [e d a]=Wyckoff Symbol: [Al2MgO4]=Structure Type:
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CC=250021
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Title
Refinement of the crystal structure of lead titanate with different degrees of imperfection of cationic and anionic sublattices by the Rietveld method.
Authors
Akimov, A.I.;Savchuk, G.K.;Rubtsov, V.A.;Letko, A.K.
Reference
Kristallografiya (2003)
48
, 267-271
Link
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Compound
O2.957 Pb0.992 Ti0.984
- Lead titanium oxide (0.99/0.98/2.96)
[
ABX3
] [
tP5
] [
c b2 a
] [
]
Cell
3.8990(3), 3.8990(3), 4.1552(0), 90, 90, 90
P4MM (99)
V=63.17
Remarks
R=0.050000 : T =1143 : X D
Atom (site) Oxid.
x, y, z, B, Occupancy
Pb1
(1a)
2
Ti1
(1b)
4
O1
(1b)
-2
O2
(2c)
-2
0.0
0.0
0.0
0.01
0.99
0.5
0.5
0.53
0.01
0.98
0.5
0.5
0.07
0.05
1
0.5
0
0.64
0.00
0.97
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