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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=412780
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Title
Tin-magnesium substitution in Ir3 Sn7 - structure and chemical bonding in Mgx Ir3 Sn7-x (x = 0 - 1.67).
Authors
Schlueter, M.; Haeussermann, U.; Heying, B.; Poettgen, R.
Reference
IC&volume=173&fpage=418&details=yes target=icsd_help>Journal of Solid State Chemistry (2003)
173
, 418-424
Link
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Compound
Ir3 Mg1.67 Sn5.33
- Magnesium iridium stannide (1.67/3/5.33)
[
N3O7
] [
cI40
] [
f e d
] [
]
Cell
9.3061(6), 9.3061(6), 9.3061(6), 90., 90., 90.
IM3-M (229)
V=805.94
Remarks
R=0.039100 :
Atom (site) Oxid.
x, y, z, B, Occupancy
Sn1
(16f)
0
Mg1
(16f)
0
Sn2
(12d)
0
Mg2
(12d)
0
Ir1
(12e)
0
0.16
0.16
0.16
0.01
0.83
0.16
0.16
0.16
0.01
0.16
0.25
0
0.5
0.00
0.66
0.25
0
0.5
0.00
0.33
0.34
0
0
0.00
1
Atom (site) Oxid.
U11, U22, U33, U12, U13, U23
Sn1
(16f)
0
Mg1
(16f)
0
Sn2
(12d)
0
Mg2
(12d)
0
Ir1
(12e)
0
0.01
0.01
0.01
0.00
0.00
0.00
0.01
0.01
0.01
0.00
0.00
0.00
0.01
0.00
0.00
0
0
0
0.01
0.00
0.00
0
0
0
0.00
0.01
0.01
0
0
0
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