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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
Structural characterization of Cu-rich barium copper oxides.
Authors
Thompson, J.G.;White, T.J.;Withers, R.L.;Fitz Gerald, J.D.;Barlow, P.J.;Collocott, S.J.
Reference
Materials Forum (1990)
14
, 27-32
Link
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Compound
Ba2 Cu3 O6
- Barium copper oxide (2/3/6)
[
A2B3X6
] [
mP44
] [
o8 n2 m2 k i
] [
]
Cell
8.48, 7.33, 12.154, 90., 110.4, 90.
P12/M1 (10)
V=708.09
Remarks
R=0.175000 : P =78-2476 : X
At least one temperature factor missing in the paper.
No R value given in the paper.
Given sp. gr. was P121
Atom (site) Oxid.
x, y, z, B, Occupancy
Ba1
(2m)
2
Ba2
(2n)
2
Ba3
(2m)
2
Ba4
(2n)
2
Cu1
(2k)
2.67
Cu2
(4o)
2.67
Cu3
(2i)
2.67
Cu4
(4o)
2.67
O1
(4o)
-2
O2
(4o)
-2
O3
(4o)
-2
O7
(4o)
-2
O8
(4o)
-2
O9
(4o)
-2
0.82
0
0.75
0
1
0.07
0.5
0.75
0
1
0.32
0
0.75
0
1
0.57
0.5
0.75
0
1
0
0.25
0.5
0
1
0.33
0.25
0.5
0
1
0
0.25
0
0
1
0.33
0.25
0
0
1
0.22
0.25
0.12
0
1
0.10
0.25
0.87
0
1
0.56
0.25
0.12
0
1
0.22
0.25
0.62
0
1
0.10
0.25
0.37
0
1
0.56
0.25
0.62
0
1
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