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金虫 (小有名气)

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散金: 30
帖子: 189
在线: 231.2小时
虫号: 1390391
注册: 2011-09-05
专业: 无机材料化学

[求助] 求CIF文件？

下面是从jade里面导出的pdf卡片，求帮助找到这个材料的cif啊，文献中没有给出，也没有其他的办法找出来，只有求各位虫友帮忙了。

PDF#20-0129: QM=Indexed; d=(Unknown); I=Diffractometer
Barium Iron Oxide
Ba Fe0.66 Fe0.34 O2.67
Radiation=CuKa1 Lambda=1.5405 Filter=Ni
Calibration= d-Cutoff= I/Ic(RIR)=
Ref= Okazaki, Mori, Miyazawa, Matsushita Electric Industrial Company, Ltd., Osaka, Japan.
Private Communication (1967)
Triclinic - Powder Diffraction Z=1 mp=
Cell=4.061x4.061x4.028<88.32x88.32x88.15> Pearson=a?4.67 (?)
Density(c)=5.900 Density(m)=5.79A Mwt=235.90 Vol=66.34 F(22)=21.1(0.037,28)
Ref= S. Mori.
J. Am. Ceram. Soc., 49 600 (1966)
Strong Line: 2.83/X 2.90/6 2.92/4 2.31/3 4.06/2 2.03/2 2.01/2 1.63/2 1.64/1 1.65/1
NOTE:  $Indicates super structure reflections.
The samples were prepared by oxidizing Ba Fe O2.5, heating between 400 C and 500 C, followed by cooling slowly in an atmosphere of oxygen.
See reference:  (S.
Mori).

d(A)    I(f) I(v) h k  l  n^2  2-Theta Theta  1/(2d) 2pi/d
10.300 4.0 1.0                   8.578 4.289  0.0485  0.6100
4.0600 20.0 14.0  -1 0  0       21.873  10.937  0.1232  1.5476
4.0300 8.0 6.0 0 0  1       22.038  11.019  0.1241  1.5591
2.9190 40.0 39.0 1 1  0       30.601  15.301  0.1713  2.1525
2.9020 55.0 54.0 0 1  1       30.785  15.393  0.1723  2.1651
2.8250  100.0  100.0 1  -1  0       31.646  15.823  0.1770  2.2241
2.4730 6.0 7.0                36.296  18.148  0.2022  2.5407
2.4140 8.0 9.0 1 1  1       37.216  18.608  0.2071  2.6028
2.3130 25.0 31.0  -1 1  1       38.905  19.452  0.2162  2.7165
2.0280 20.0 28.0  -2 0  0       44.645  22.323  0.2465  3.0982
2.0130 18.0 25.0 0 0  2       44.996  22.498  0.2484  3.1213
1.8400 4.0 6.0  -2  -1  0       49.496  24.748  0.2717  3.4148
1.8300 6.0 9.0 0 2  1       49.785  24.893  0.2732  3.4334
1.7920 4.0 6.0  -2 1  0       50.915  25.458  0.2790  3.5062
1.7860 4.0 6.0  -1 0  2       51.099  25.549  0.2800  3.5180
1.6970 6.0 10.0 1 2  1       53.989  26.995  0.2946  3.7025
1.6910 6.0 10.0 1 1  2       54.196  27.098  0.2957  3.7157
1.6490 10.0 17.0  -2  -1  1       55.695  27.847  0.3032  3.8103
1.6430 14.0 24.0  -1 2  1       55.916  27.958  0.3043  3.8242
1.6290 16.0 28.0  -2 1  1       56.439  28.220  0.3069  3.8571
1.4580 4.0 8.0 2 2  0       63.783  31.892  0.3429  4.3095
1.4500 8.0 16.0 0 2  2       64.177  32.088  0.3448  4.3332
1.4120 6.0 12.0 2  -2  0       66.121  33.060  0.3541  4.4498
1.4090 10.0 20.0  -2 0  2       66.280  33.140  0.3549  4.4593

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