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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=50905
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Title
Neutron and x-ray powder diffraction study of R Ba2 Fe3 O(8+w) phases.
Authors
Karen, P.;Kjekshus, A.;Huang, Q.;Lynn, J.W.;Rosov, N.;Sora, I.N.;Karen, V.L.;Mighell, A.D.;Santaro, A.
Reference
IC&volume=136&fpage=21&details=yes target=icsd_help>Journal of Solid State Chemistry (1998)
136
, 21-33
Link
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Compound
Ba0.6666 Fe0.9999 La0.3333 O2.8440489
- Lanthanum barium iron oxide (1/2/3/8.53)
[
ABX3
] [
cP5
] [
c b a
] [
CaTiO3
]
Cell
3.94582(7), 3.94582(7), 3.94582(7), 90., 90., 90.
PM3-M (221)
V=61.43
Remarks
R=0.056500 : N T =10 : =CaTiO3 : D
Atom (site) Oxid.
x, y, z, B, Occupancy
La1
(1a)
3
Ba1
(1a)
2
Fe1
(1b)
3.355
O1
(3c)
-2
0
0
0
0.51
0.33
0
0
0
0.51
0.66
0.5
0.5
0.5
0.45
1
0
0.5
0.5
0
0.94
Atom (site) Oxid.
B11, B22, B33, B12, B13, B23
La1
(1a)
3
Ba1
(1a)
2
Fe1
(1b)
3.355
O1
(3c)
-2
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1.67
1.67
0.97
0
0
0
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