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yachnne

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[交流] 【求助】高人！！！！！！帮我查下CuZn3的晶体结构资料吧

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1楼 2011-01-22 20:58:38

已阅回复此楼关注TA 给TA发消息送TA红花 TA的回帖

mooncakeaa

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★
yachnne(金币+5): 非常感谢 2011-01-23 20:26:15
jic8417(金币+1): 谢谢参与 2011-01-25 02:41:14

1. Cu3Zn

CC=103156 Help  CIFShel-XFullProfPowderCellOld ICSD
Title Characterization of large alloy single crystals by neutron diffraction.
Authors Ng, S.C.;Brockhouse, B.N.;Hallman, E.D.
Reference Proceedings of the Royal Society of London, Series A: Mathematical and Physical Sciences (1936) 157, 167-183
Link XRef SCOPUS SCIRUS Google
Also: Materials Research Bulletin (1967) 2, 69-73
Link XRef SCOPUS SCIRUS Google
Compound Cu0.75 Zn0.25 - Copper zinc (0.75/0.25) [N] [cF4] [a] [Cu]
Cell 3.6669(10), 3.6669, 3.6669, 90., 90., 90.
FM3-M (225) V=49.31
Remarks TYP =Cu : NDP PDC =01-071-7924 : PDF =65-6567 : TEM =295 :
No R value given in the paper.
At least one temperature factor missing in the paper.
Cell from 2nd ref. (Hume-Rothery et al.): 3.660
N * -(Cu0.75Zn0.25)-[FM3-M] Ng, S.C.;Brockhouse, B.N.;Hallman, (1967)
C 3.666900 3.666900 3.666900 90.000000 90.000000 90.000000
S z, y, -x
S y, x, -z
S x, z, -y
S z, x, -y
S y, z, -x
S x, y, -z
S z, -y, x
S y, -x, z
S x, -z, y
S  z, -x, y
S  y, -z, x
S  x, -y, z
S  -z, y, x
S  -y, x, z
S  -x, z, y
S  -z, x, y
S  -y, z, x
S  -x, y, z
S  -z, -y, -x
S  -y, -x, -z
S  -x, -z, -y
S  -z, -x, -y
S  -y, -z, -x
S  -x, -y, -z
S  -z, -y, x
S  -y, -x, z
S  -x, -z, y
S  -z, -x, y
S  -y, -z, x
S  -x, -y, z
S  -z, y, -x
S  -y, x, -z
S  -x, z, -y
S  -z, x, -y
S  -y, z, -x
S  -x, y, -z
S  z, -y, -x
S  y, -x, -z
S  x, -z, -y
S  z, -x, -y
S  y, -z, -x
S  x, -y, -z
S  z, y, x
S  y, x, z
S  x, z, y
S  z, x, y
S  y, z, x
S  x, y, z
S  z, y+1/2, -x+1/2
S  y, x+1/2, -z+1/2
S  x, z+1/2, -y+1/2
S  z, x+1/2, -y+1/2
S  y, z+1/2, -x+1/2
S  x, y+1/2, -z+1/2
S  z, -y+1/2, x+1/2
S  y, -x+1/2, z+1/2
S  x, -z+1/2, y+1/2
S  z, -x+1/2, y+1/2
S  y, -z+1/2, x+1/2
S  x, -y+1/2, z+1/2
S  -z, y+1/2, x+1/2
S  -y, x+1/2, z+1/2
S  -x, z+1/2, y+1/2
S  -z, x+1/2, y+1/2
S  -y, z+1/2, x+1/2
S  -x, y+1/2, z+1/2
S  -z, -y+1/2, -x+1/2
S  -y, -x+1/2, -z+1/2
S  -x, -z+1/2, -y+1/2
S  -z, -x+1/2, -y+1/2
S  -y, -z+1/2, -x+1/2
S  -x, -y+1/2, -z+1/2
S  -z, -y+1/2, x+1/2
S  -y, -x+1/2, z+1/2
S  -x, -z+1/2, y+1/2
S  -z, -x+1/2, y+1/2
S  -y, -z+1/2, x+1/2
S  -x, -y+1/2, z+1/2
S  -z, y+1/2, -x+1/2
S  -y, x+1/2, -z+1/2
S  -x, z+1/2, -y+1/2
S  -z, x+1/2, -y+1/2
S  -y, z+1/2, -x+1/2
S  -x, y+1/2, -z+1/2
S  z, -y+1/2, -x+1/2
S  y, -x+1/2, -z+1/2
S  x, -z+1/2, -y+1/2
S  z, -x+1/2, -y+1/2
S  y, -z+1/2, -x+1/2
S  x, -y+1/2, -z+1/2
S  z, y+1/2, x+1/2
S  y, x+1/2, z+1/2
S  x, z+1/2, y+1/2
S  z, x+1/2, y+1/2
S  y, z+1/2, x+1/2
S  x, y+1/2, z+1/2
S  z+1/2, y, -x+1/2
S  y+1/2, x, -z+1/2
S  x+1/2, z, -y+1/2
S z+1/2, x, -y+1/2
S y+1/2, z, -x+1/2
S x+1/2, y, -z+1/2
S z+1/2, -y, x+1/2
S y+1/2, -x, z+1/2
S x+1/2, -z, y+1/2
S z+1/2, -x, y+1/2
S y+1/2, -z, x+1/2
S x+1/2, -y, z+1/2
S -z+1/2, y, x+1/2
S -y+1/2, x, z+1/2
S -x+1/2, z, y+1/2
S -z+1/2, x, y+1/2
S -y+1/2, z, x+1/2
S -x+1/2, y, z+1/2
S -z+1/2, -y, -x+1/2
S -y+1/2, -x, -z+1/2
S -x+1/2, -z, -y+1/2
S -z+1/2, -x, -y+1/2
S -y+1/2, -z, -x+1/2
S -x+1/2, -y, -z+1/2
S -z+1/2, -y, x+1/2
S -y+1/2, -x, z+1/2
S -x+1/2, -z, y+1/2
S -z+1/2, -x, y+1/2
S -y+1/2, -z, x+1/2
S -x+1/2, -y, z+1/2
S -z+1/2, y, -x+1/2
S -y+1/2, x, -z+1/2
S -x+1/2, z, -y+1/2
S -z+1/2, x, -y+1/2
S -y+1/2, z, -x+1/2
S -x+1/2, y, -z+1/2
S z+1/2, -y, -x+1/2
S y+1/2, -x, -z+1/2
S x+1/2, -z, -y+1/2
S z+1/2, -x, -y+1/2
S y+1/2, -z, -x+1/2
S x+1/2, -y, -z+1/2
S z+1/2, y, x+1/2
S y+1/2, x, z+1/2
S x+1/2, z, y+1/2
S z+1/2, x, y+1/2
S y+1/2, z, x+1/2
S x+1/2, y, z+1/2
S z+1/2, y+1/2, -x
S y+1/2, x+1/2, -z
S x+1/2, z+1/2, -y
S z+1/2, x+1/2, -y
S y+1/2, z+1/2, -x
S x+1/2, y+1/2, -z
S z+1/2, -y+1/2, x
S y+1/2, -x+1/2, z
S x+1/2, -z+1/2, y
S z+1/2, -x+1/2, y
S y+1/2, -z+1/2, x
S x+1/2, -y+1/2, z
S -z+1/2, y+1/2, x
S -y+1/2, x+1/2, z
S -x+1/2, z+1/2, y
S -z+1/2, x+1/2, y
S -y+1/2, z+1/2, x
S -x+1/2, y+1/2, z
S -z+1/2, -y+1/2, -x
S -y+1/2, -x+1/2, -z
S -x+1/2, -z+1/2, -y
S -z+1/2, -x+1/2, -y
S -y+1/2, -z+1/2, -x
S -x+1/2, -y+1/2, -z
S -z+1/2, -y+1/2, x
S -y+1/2, -x+1/2, z
S -x+1/2, -z+1/2, y
S -z+1/2, -x+1/2, y
S -y+1/2, -z+1/2, x
S -x+1/2, -y+1/2, z
S -z+1/2, y+1/2, -x
S -y+1/2, x+1/2, -z
S -x+1/2, z+1/2, -y
S -z+1/2, x+1/2, -y
S -y+1/2, z+1/2, -x
S -x+1/2, y+1/2, -z
S z+1/2, -y+1/2, -x
S y+1/2, -x+1/2, -z
S x+1/2, -z+1/2, -y
S z+1/2, -x+1/2, -y
S y+1/2, -z+1/2, -x
S x+1/2, -y+1/2, -z
S z+1/2, y+1/2, x
S y+1/2, x+1/2, z
S x+1/2, z+1/2, y
S z+1/2, x+1/2, y
S y+1/2, z+1/2, x
S x+1/2, y+1/2, z
A Cu1 0.000000 0.000000 0.000000 0.000000 0.750000
A Zn1 0.000000 0.000000 0.000000 1.000000 0.250000

[ Last edited by mooncakeaa on 2011-1-22 at 22:23 ]

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2楼2011-01-22 21:40:51

已阅回复此楼关注TA 给TA发消息送TA红花 TA的回帖

mooncakeaa

木虫之王 (文坛精英)

应助: 135 (高中生)
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2. Cu0.7 Zn

CC=103153 Help CIFShel-XFullProfPowderCellOld ICSD
Title Ueber einige Leerstellen- und Stapelvarianten der beta-Messing Strukturfamilie.
Authors Lenz, J.;Schubert, K.
Reference Zeitschrift fuer Metallkunde (1971) 62, 810-816
Link XRef SCOPUS SCIRUS Google
Compound Cu0.7 Zn2 - Copper zinc (0.7/2) - HT [NO2] [hP3] [f d a] []
Cell 4.275, 4.275, 2.590, 90., 90., 120.
P6- (174) V=40.99
Remarks TEM =873 : PDC =01-071-7921 : SDM XDP PDF =65-1873 :
At least one temperature factor missing in the paper.
No R value given in the paper.

N * -Cu0.7Zn2-[P6-] Lenz, J.;Schubert, K.(1971)
C 4.275000 4.275000 2.590000 90.000000 90.000000 120.000000
S -x+y, -x, -z
S -y, x-y, -z
S x, y, -z
S -x+y, -x, z
S -y, x-y, z
S x, y, z
A Cu1 0.333300 0.666700 0.500000 0.000000 0.700000
A Zn1 0.000000 0.000000 0.000000
A Zn2 0.666700 0.333300 0.500000

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3楼2011-01-22 22:23:53

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