*data for ICSD #26410
Coll Code 26410
Rec Date 1981/12/31
Mod Date 1998/06/26
Chem Name Iron Diiron(III) Oxide
Structured Fe3 O4
Sum Fe3 O4
ANX AB2X4
Min Name Magnetite
D(calc) 5.2
Title The Structure of Magnetite
Author(s) Fleet, M.E.
Reference Acta Crystallographica B (24,1968-38,1982)
(1981), 37, 917-920
Unit Cell 8.3941(7) 8.3941(7) 8.3941(7) 90. 90. 90.
Vol 591.46
Z 8
Space Group F d -3 m Z
SG Number 227
Cryst Sys cubic
Pearson cF56
Wyckoff e d a
R Value .033
Red Cell F 5.935 5.935 5.935 60 60 60 147.864
Trans Red 0.500 0.500 0.000 / 0.000 0.500 0.500 / 0.500 0.000 0.500
Comments Compound with mineral name: Magnetite
The structure has been assigned a PDF number (calculated
powder diffraction data): 01-074-0748
The structure has been assigned a PDF number (experimental
powder diffraction data): 19-629
Structure type : Al2MgO4
X-ray diffraction from single crystal
Unusual difference between calculated and measured density
At least one temperature factor is implausible or
meaningless but agrees with the value given in the paper.
Atom # OX SITE x y z SOF H
Fe 1 +3 8 a 0.125 0.125 0.125 1. 0
Fe 2 +2.5 16 d 0.5 0.5 0.5 1. 0
O 1 -2 32 e 0.2549(1) 0.2549(1) 0.2549(1) 1. 0
Lbl Type B11 B22 B33 B12 B13 B23
Fe1 Fe3+ 0.00349(14) 0.00349(14) 0.00349(14) 0 0 0
Fe2 Fe2.5+ 0.00461(14) 0.00461(14) 0.00461(14) 0.00045(5) 0.00045(5) 0.00045(5)
O1 O2- 0.00541(24) 0.00541(24) 0.00541(24) -.00003(17) -.00003(17) -.00003(17)
*end for ICSD #26410 http://pan.baidu.com/s/1c5xb5O,
我可以弄到,还需要吗
*data for ICSD #26410
Coll Code 26410
Rec Date 1981/12/31
Mod Date 1998/06/26
Chem Name Iron Diiron(III) Oxide
Structured Fe3 O4
Sum Fe3 O4
ANX AB2X4
Min Name Magnetite
D(calc) 5.2
Title The Structure of Magnetite
Author(s) Fleet, M.E.
Reference Acta Crystallographica B (24,1968-38,1982)
(1981), 37, 917-920
Unit Cell 8.3941(7) 8.3941(7) 8.3941(7) 90. 90. 90.
Vol 591.46
Z 8
Space Group F d -3 m Z
SG Number 227
Cryst Sys cubic
Pearson cF56
Wyckoff e d a
R Value .033
Red Cell F 5.935 5.935 5.935 60 60 60 147.864
Trans Red 0.500 0.500 0.000 / 0.000 0.500 0.500 / 0.500 0.000 0.500
Comments Compound with mineral name: Magnetite
The structure has been assigned a PDF number (calculated
powder diffraction data): 01-074-0748
The structure has been assigned a PDF number (experimental
powder diffraction data): 19-629
Structure type : Al2MgO4
X-ray diffraction from single crystal
Unusual difference between calculated and measured density
At least one temperature factor is implausible or
meaningless but agrees with the value given in the paper.
Atom # OX SITE x y z SOF H
Fe 1 +3 8 a 0.125 0.125 0.125 1. 0
Fe 2 +2.5 16 d 0.5 0.5 0.5 1. 0
O 1 -2 32 e 0.2549(1) 0.2549(1) 0.2549(1) 1. 0
Lbl Type B11 B22 B33 B12 B13 B23
Fe1 Fe3+ 0.00349(14) 0.00349(14) 0.00349(14) 0 0 0
Fe2 Fe2.5+ 0.00461(14) 0.00461(14) 0.00461(14) 0.00045(5) 0.00045(5) 0.00045(5)
O1 O2- 0.00541(24) 0.00541(24) 0.00541(24) -.00003(17) -.00003(17) -.00003(17)
*end for ICSD #26410
http://pan.baidu.com/s/1c5xb5O,
cif文件不能用。能不能再给我发一个
需要可以用的cif文件。Fe3O4, ICSD 43001
送了你一朵小红花表谢意
http://pan.baidu.com/s/1nvdq8WT