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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=89783
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Title
In situ powder diffraction study of titanite (Ca Ti O Si O4) at high pressure and high temperature.
Authors
Kunz, M.;Arlt, T.;Stolz, J.
Reference
IC&volume=85&fpage=146&details=yes target=icsd_help>American Mineralogist (2000)
85
, 146-147
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Compound
Ca1 O5 Si1 Ti1
-
[Titanite]
Calcium oxotitanium silicate
[
ABCX5
] [
mP32
] [
e8
] [
]
Cell
6.9982(2), 8.6853(3), 6.5079(3), 90., 113.523(4), 90.
P121/A1 (14)
V=362.69
Remarks
R=0.010000 : P =2250 : T =440 : X M =Titanite :
Atom (site) Oxid.
x, y, z, B, Occupancy
Ca1
(4e)
2
Ti1
(4e)
4
Si1
(4e)
4
O1
(4e)
-2
O2
(4e)
-2
O3
(4e)
-2
O4
(4e)
-2
O5
(4e)
-2
0.25
0.91
0.76
0.00
1
0.52
0.75
0.23
0.00
1
0.72
0.93
0.75
0.00
1
0.78
0.80
0.27
0.00
1
0.91
0.81
0.91
0.00
1
0.39
0.94
0.13
0.00
1
0.91
0.32
0.44
0.00
1
0.36
0.47
0.64
0.00
1
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