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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=94011
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Title
X-ray structure analysis and electron density distributions of the layered compounds Cux Ti S2.
Authors
Kusawake, T.;Takahashi, Y.;Wey, M.Y.;Ohshima, K.-I.
Reference
IC&volume=13&fpage=991&details=yes target=icsd_help>Journal of Physics: Condensed Matter (2001)
13
, 991-992
Link
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Compound
Cu0.326 S2 Ti1
- Copper titanium sulfide (0.33/1/2)
[
A5B16X32
] [
cF53
] [
e d a
] [
]
Cell
9.9216(3), 9.9216(3), 9.9216(3), 90, 90, 90
FD3-MZ (227)
V=976.66
Remarks
R=0.022000 : T =295 : D
Atom (site) Oxid.
x, y, z, B, Occupancy
Ti1
(16d)
3.674
S1
(32e)
-2
Cu1
(8a)
1
0.5
0.5
0.5
0.01
1
0.25
0.25
0.25
0.00
1
0.12
0.12
0.12
0.01
0.65
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