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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
Rubidium- und Caesium-Verbindungen mit dem Isopolyanion (Ta6 O19)(8-) - Synthesen, Kristallstrukturen, thermische und schwingungsspektroskopische Untersuchungen der Oxotantalate A8 (Ta6 O19) . n(H2 O) (A = Rb, Cs; n = 0,4,14).
Authors
Hartl, H.;Pickhard, F.;Emmerling, F.;Roehr, C.
Reference
Zeitschrift fuer Anorganische und Allgem (2001)
627
, 263-263
Link
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Compound
H28 Cs8 O33 Ta6
- Octacaesium hexatantalate tetradecahydrate
[
A6B8X33
] [
mP150
] [
e23 a
] [
]
Cell
10.554(1), 16.1490(60), 11.714(2), 90., 99.97(2), 90.
P121/N1 (14)
V=1966.34
Remarks
R=0.081200 :
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
Ta1
(4e)
5
Ta2
(4e)
5
Ta3
(4e)
5
Cs1
(4e)
1
Cs2
(4e)
1
Cs3
(4e)
1
Cs4
(4e)
1
O1
(4e)
-2
O2
(4e)
-2
O3
(2a)
-2
O4
(4e)
-2
O5
(4e)
-2
O6
(4e)
-2
O7
(4e)
-2
O8
(4e)
-2
O9
(4e)
-2
O10
(4e)
-2
O11
(4e)
-2
O12
(4e)
-2
O13
(4e)
-2
O14
(4e)
-2
O15
(4e)
-2
O16
(4e)
-2
O17
(4e)
-2
H1
(4e)
1
0.62
0.39
0.61
0
1
0.69
0.57
0.48
0
1
0.51
0.42
0.33
0
1
0.87
0.36
0.39
0
1
0.89
0.10
0.36
0
1
0.46
0.19
0.37
0
1
1.16
0.43
0.16
0
1
0.61
0.35
0.45
0.00
1
0.81
-.09
0.44
0.04
1
0.5
0.5
0.5
0.00
1
0.08
0.02
0.22
0.00
1
0.75
0.47
0.58
0.00
1
0.35
0.37
0.37
0.00
1
0.94
0.14
0.10
0.00
1
0.16
0.37
0.52
0.00
1
0.21
0.18
0.19
0.00
1
0.53
0.36
0.20
0.01
1
0.68
0.22
0.22
0.02
1.
0.14
0.22
0.40
0.02
1.
0.61
0.02
0.39
0.02
1.
0.93
0.31
0.14
0.02
1.
0.83
0.21
0.56
0.03
1.
0.99
0.54
0.33
0.02
1.
0.33
0.50
0.65
0.00
1.
0
14.
Atom (site) Oxid.
U11, U22, U33, U12, U13, U23
Ta1
(4e)
5
Ta2
(4e)
5
Ta3
(4e)
5
Cs1
(4e)
1
Cs2
(4e)
1
Cs3
(4e)
1
Cs4
(4e)
1
O1
(4e)
-2
O2
(4e)
-2
O3
(2a)
-2
O4
(4e)
-2
O5
(4e)
-2
O6
(4e)
-2
O7
(4e)
-2
O8
(4e)
-2
O9
(4e)
-2
O10
(4e)
-2
O11
(4e)
-2
O12
(4e)
-2
O13
(4e)
-2
O14
(4e)
-2
O15
(4e)
-2
O16
(4e)
-2
O17
(4e)
-2
H1
(4e)
1
0.00
0.00
0.00
0.00
0.00
0.00
0.00
0.00
0.00
-.00
0.00
0.00
0.00
0.00
0.00
0.00
0.00
-.00
0.00
0.01
0.02
0.00
0.00
-.00
0.01
0.01
0.02
-.00
0.00
-.01
0.02
0.00
0.02
-.00
0.00
0.00
0.01
0.03
0.02
0.00
-.00
-.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
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
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
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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