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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=99684
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Title
Studies of microstructure and ruthenium valence in the ruthenocuprates Pb2 Ru Sr2 Cu2 O8 Cl and (Ru, M) Sr2 Gd Cu2 O8 (M =Sn, Nb).
Authors
McLaughlin, A.C.; Attfield, J.P.; Liu, R.S.; Jang, L.-Y.; Zhou, W.Z.
Reference
IC&volume=177&fpage=834&details=yes target=icsd_help>Journal of Solid State Chemistry (2004)
177
, 834-838
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Also:
IC&volume=4&fpage=431&details=yes target=icsd_help>Solid State Sciences (2002)
4
, 431-436
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Compound
Cl1 Cu2 O8 Pb2 Ru1 Sr2
- Dilead distrontium chloride octaoxorutheno(V)dicuprate
[
AB2C2D2XY8
] [
tP32
] [
k g2 f2 e2 b a
] [
]
Cell
5.4671(2), 5.4671(2), 15.3674(9), 90, 90, 90
P4/MBM (127)
V=459.32
Remarks
R=0.022800 : N
The coordinates are those given in the paper but the atomic distances do not agree with those calculated during testing.The coordinates are probably correct.
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
Pb1
(4f)
2
Ru1
(2a)
5
Sr1
(4f)
2
Cu1
(4e)
2
O1
(4e)
-2
O2
(8k)
-2
O3
(4g)
-2
O4
(4g)
-2
Cl1
(2b)
-1
0.5
0.
0.37
0.00
1
0.
0.
0.
0.00
1
0.5
0.
0.14
0.00
1
0.
0.
0.27
0.00
1
0.
0.
0.12
0.00
1
0.23
0.26
0.28
0.00
1
0.19
0.69
0.
0.01
0.47
0.69
0.19
0.
0.01
0.51
0.
0.
0.5
0.03
1
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