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kanghuijun

至尊木虫 (文坛精英)

[求助] 求助,哪位大侠能有Be4AlMn的原子位置或cif文件,谢谢

如题

[ Last edited by kanghuijun on 2013-4-8 at 08:54 ]
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nsqhmily

木虫 (小有名气)

【答案】应助回帖

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感谢参与,应助指数 +1
kanghuijun(franch代发): 金币+5, 谢谢回帖交流,, 2013-04-08 21:33:13
kanghuijun: 金币+15, ★★★★★最佳答案, 谢谢 2013-04-09 07:59:43
*data for   ICSD #57525
Coll Code   57525
Rec  Date   2003/10/01
Chem Name   Aluminium Manganese Beryllium (1/1/4)
Structured  (Al Mn) Be4
Sum         Al1 Be4 Mn1
ANX         NO2
D(calc)     3.43
Title       Ternary Al Mn Be4 phases in commercially pure beryllium
Author(s)   Carrabine, J.A.
Reference   Journal of Nuclear Materials
            (1963), 8(2), 278-280
Unit Cell   6.11 6.11 6.11 90. 90. 90.
Vol         228.1
Z           4
Space Group F d -3 m S
SG Number   227
Cryst Sys   cubic
Pearson     cF24
Wyckoff     d a
Red Cell    F  4.320 4.320 4.320 60 60 60 57.025
Trans Red   0.500 0.500 0.000 / 0.000 0.500 0.500 / 0.500 0.000 0.500
Comments    The structure has been assigned a PDF number (calculated
            powder diffraction data): 01-071-5611
            The structure has been assigned a PDF number (experimental
            powder diffraction data): 18-7
            Structure type : Cu2Mg
            X-ray diffraction (powder)
            No R value given in the paper.
            At least one temperature factor missing in the paper.
Atom  #   OX   SITE      x           y           z           SOF      H
Al   1  +0    8 a   0           0           0              0.5        0   
Mn   1  +0    8 a   0           0           0              0.5        0   
Be   1  +0    16 d  0.625       0.625       0.625          1.         0   
*end for    ICSD #57525
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