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CC=Collection Code: [AB2X4]=ANX Form: [cF56]=Pearson: [e d a]=Wyckoff Symbol: [Al2MgO4]=Structure Type:
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Title
Structure of Ba Bi O(3-x) at high temperature.
Authors
Pei, S.;Jorgensen, J.D.;Hinks, D.G.;Lightfoot, P.;Zheng, Y.;Richards, D.R.;Dabrowski, B.;Mitchell, A.W.
Reference
Materials Research Bulletin (1990)
25
, 146-147
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Compound
Ba1 Bi1 O3
- Barium bismuth oxide (1/1/3)
[
ABC2X6
] [
cF40
] [
e c b a
] [
K2NaAlF6
]
Cell
8.7684(1), 8.7684(1), 8.7684(1), 90., 90., 90.
FM3-M (225)
V=674.16
Remarks
R=0.097000 : N T =873 : =K2NaAlF6 : M =Bi :
Perovskite, stable from 793 to 1043 K
Atom (site) Oxid.
x, y, z, B, Occupancy
Ba1
(8c)
2
Bi1
(4a)
3
Bi2
(4b)
5
O1
(24e)
-2
0.25
0.25
0.25
2.45
1
0
0
0
1.3(
1
0.5
0.5
0.5
0.9(
1
0.26
0
0
0
1
Atom (site) Oxid.
U11, U22, U33, U12, U13, U23
Ba1
(8c)
2
Bi1
(4a)
3
Bi2
(4b)
5
O1
(24e)
-2
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.01
0.09
0.09
0
0
0
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