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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=92280
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Title
The crystal structures and phase transitions in Y-doped Ba Ce O3: their dependence on Y concentration and hydrogen doping.
Authors
Takeuchi, K.;Loong, C.-K.;Richardson, J.W.jr.;Guan, J.;Dorris, S.E.;Balachandran, U.
Reference
IC&volume=138&fpage=63&details=yes target=icsd_help>Solid State Ionics (2000)
138
, 63-77
Link
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Compound
Ba1 Ce0.8 O2.9 Y0.2
- Barium cerium(IV) yttrium oxide (1/0.8/0.2/2.9)
[
ABX3
] [
mS20
] [
i2 h g e
] [
]
Cell
6.239(2), 8.753(2), 6.233(2), 90., 91.03(2), 90.
I12/M1 (12)
V=340.33
Remarks
R=0.081000 : N D
At least one temperature factor is implausible or meaningless but agrees with the value given in the paper.
Atom (site) Oxid.
x, y, z, B, Occupancy
Ba1
(4i)
2
Ce1
(4e)
4
Y1
(4e)
3
O1
(4i)
-2
O2
(4g)
-2
O3
(4h)
-2
0.23
0
0.74
0.2(
1
0.25
0.25
0.25
-.5(
0.8
0.25
0.25
0.25
-.5(
0.2
0.16
0
0.23
0.4(
1
0
0.30
0
0.4(
0.95
0.5
0.20
0
0.4(
0.95
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