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[求助] 求ZnOPDF卡片 36-1451导出的TXT文件已有1人参与

自己电脑装不了jade，然后周围电脑上也没这个卡片，好多文献都是用的这一个，希望哪位大神帮忙发一个ZnOPDF卡片 36-1451导出的TXT文件，万分感谢！

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1楼 2016-12-18 22:47:52

已阅回复此楼关注TA 给TA发消息送TA红花 TA的回帖

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【答案】应助回帖

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感谢参与，应助指数 +1
就要风生水起: 金币+10, ★★★★★最佳答案 2016-12-28 13:00:30

Name and formula

Reference code: 00-036-1451

Mineral name: Zincite, syn
Compound name: Zinc Oxide
Common name: zinc white

Empirical formula: OZn
Chemical formula: ZnO

Crystallographic parameters

Crystal system: Hexagonal
Space group: P63mc
Space group number: 186

a (?):    3.2498
b (?):    3.2498
c (?):    5.2066
Alpha (°):    90.0000
Beta (°):    90.0000
Gamma (°): 120.0000

Volume of cell (10^6 pm^3):    47.62
Z:    2.00

RIR: -

Subfiles and quality

Subfiles: Alloy, metal or intermetalic
Common Phase
Corrosion
Educational pattern
Forensic
Inorganic
Mineral
NBS pattern
Pharmaceutical
Pigment/Dye
Quality: Star (S)

Comments

Color: Colorless
Creation Date: 1970/1/1
Modification Date: 1970/1/1
Sample Source or Locality: The sample was obtained from the New Jersey Zinc Co., Bethlehem, Pennsylvania, USA
Powder Data: References to other early patterns may be found in reference (5)
Optical Data: B=2.013, Q=2.029, Sign=+
Color: Colorless. The structure was determined by Bragg (1) and refined by Abrahams, Bernstein (2). A high pressure cubic NaCl-type of ZnO is reported by Bates et al. (3) and a cubic, sphalerite type is reported by Radczewski, Schicht (4)
Temperature of Data Collection: The approximate temperature of data collection was 26 C
Additional Patterns: To replace 00-005-0664 (5)
Additional Patterns: See ICSD 31052 (PDF 01-075-1526).

References

Primary reference: McMurdie, H., Morris, M., Evans, E., Paretzkin, B., Wong-Ng, W., Ettlinger, L., Hubbard, C., Powder Diffraction, 1, 76, (1986)
Structure: 2. Abrahams, S., Bernstein, J., Acta Crystallogr., Sec. B, 25, 1233, (1969)
Optical data: Dana's System of Mineralogy, 7th Ed., I, 504
Other: 5. Swanson, H., Fuyat, R., Natl. Bur. Stand. (U.S.), Circ. 539, 2, 25, (1953)

Peak list

No. h k l    d [A]    2Theta[deg] I [%]
  1 1 0 0    2.81430 31.770    57.0
  2 0 0 2    2.60332 34.422    44.0
  3 1 0 1    2.47592 36.253    100.0
  4 1 0 2    1.91114 47.539    23.0
  5 1 1 0    1.62472 56.603    32.0
  6 1 0 3    1.47712 62.864    29.0
  7 2 0 0    1.40715 66.380    4.0
  8 1 1 2    1.37818 67.963    23.0
  9 2 0 1    1.35825 69.100    11.0
10 0 0 4    1.30174 72.562    2.0
11 2 0 2    1.23801 76.955    4.0
12 1 0 4    1.18162 81.370    1.0
13 2 0 3    1.09312 89.607    7.0
14 2 1 0    1.06384 92.784    3.0
15 2 1 1    1.04226 95.304    6.0
16 1 1 4    1.01595 98.613    4.0
17 2 1 2    0.98464 102.946    2.0
18 1 0 5    0.97663 104.134    5.0
19 2 0 4    0.95561 107.430    1.0
20 3 0 0    0.93812 110.392    3.0
21 2 1 3    0.90694 116.279    8.0
22 3 0 2    0.88256 121.572    4.0
23 0 0 6    0.86768 125.188    1.0
24 2 0 5    0.83703 133.932    3.0
25 1 0 6    0.82928 136.521    1.0
26 2 1 4    0.82370 138.513    2.0
27 2 2 0    0.81247 142.918    3.0

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