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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=404487
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Title
Eine silberhaltige Phase eines Oxoruthenats: Ag0.4 Na2.3 Ca4.3 Ru O8.
Authors
Mueller-Buschbaum, H.;Frenzen, S.
Reference
Zeitschrift fuer Naturforschung, Teil B. (1996)
51
, 485-488
Link
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Compound
Ag0.4 Ca4.3 Na2.3 O8 Ru1
- Silver sodium calcium ruthenium oxide (0.4/2.3/4.3/1/8)
[
AB3C4X8
] [
oS32
] [
n m h g2 d c b a
] [
]
Cell
9.255(1), 6.683(1), 6.696(3), 90., 90., 90.
CMMM (65)
V=414.16
Remarks
R=0.040700 : D
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.
Deviation of the charge sum from zero tolerable.
Atom (site) Oxid.
x, y, z, B, Occupancy
Na1
(2a)
1
Ag1
(2a)
1
Na2
(2b)
1
Ca2
(2b)
2
Na3
(2d)
1
Ca1
(8m)
2
Ru1
(2c)
5
O1
(8n)
-2
O2
(4h)
-2
O3
(4g)
-2
O4
(4g)
-2
0
0
0
0
0.59
0
0
0
0
0.40
0.5
0
0
0
0.69
0.5
0
0
0
0.30
0
0
0.5
0
1
0.25
0.25
0.24
0
1
0.5
0
0.5
0
1
0.5
0.21
0.29
0.01
1
0.28
0
0.5
0.00
1
0.22
0
0
0.01
0.5
0.24
0
0
0.01
0.5
Atom (site) Oxid.
U11, U22, U33, U12, U13, U23
Na1
(2a)
1
Ag1
(2a)
1
Na2
(2b)
1
Ca2
(2b)
2
Na3
(2d)
1
Ca1
(8m)
2
Ru1
(2c)
5
O1
(8n)
-2
O2
(4h)
-2
O3
(4g)
-2
O4
(4g)
-2
0.00
0.01
0.01
0
0
0
0.00
0.01
0.01
0
0
0
0.00
0.01
0.00
0
0
0
0.00
0.01
0.00
0
0
0
0.01
0.00
0.01
0
0
0
0.00
0.01
0.00
0.00
0
0
0.00
0.00
0.00
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
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