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[求助] 求M0s2标准谱图jcpds37-1492的数据已有1人参与

求M0s2标准谱图jcpds37-1492的数据

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桀少爷: 金币+5, ★★★★★最佳答案, 谢谢你 2016-12-24 19:11:29

Name and formula

Reference code: 00-037-1492

Mineral name: Molybdenite-2H, syn
Compound name: Molybdenum Sulfide
PDF index name: Molybdenum Sulfide

Empirical formula: MoS2
Chemical formula: MoS2

Crystallographic parameters

Crystal system: Hexagonal
Space group: P63/mmc
Space group number: 194

a (?):    3.1612
b (?):    3.1612
c (?):    12.2985
Alpha (°):    90.0000
Beta (°):    90.0000
Gamma (°): 120.0000

Volume of cell (10^6 pm^3): 106.43
Z:    2.00

RIR: -

Subfiles and quality

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

Comments

Color: Dark gray
Creation Date: 1970/1/1
Modification Date: 1970/1/1
Sample Source or Locality: The sample was obtained from Aesar, a branch of Johnson Matthey Inc., Seabrook, New Hampshire, USA.  It was labelled 98% MoS2
Additional Patterns: See ICSD 31067 (PDF 01-075-1539)
Color: Dark gray
Structures: The structure was determined by Dickinson and Pauling (1)
Temperature of Data Collection: The mean temperature of data collection was 25.8?. A rhombohedral form of molybdenite, with 'c' multiplied by 1.5, was found as a natural mineral (Traill, 2)
Additional Patterns: To replace 00-006-0097, Swanson et al. (3). References to other early patterns will be found in Swanson et al., (3).

References

Primary reference: McMurdie, H., Morris, M., Evans, E., Paretzkin, B., Wong-Ng, W., Hubbard, C., Powder Diffraction, 1, 269, (1986)
Structure: 1. Dickinson, R., Pauling, L., J. Am. Chem. Soc., 45, 1466, (1923)
Other: 3. Swanson, H., Gilfrich, N., Ugrinic, G., Natl. Bur. Stand. (U.S.), Circ. 539, 5, 47, (1955)

Peak list

No. h k l    d [A]    2Theta[deg] I [%]
  1 0 0 2    6.15536 14.378    100.0
  2 0 0 4    3.07372 29.027    2.0
  3 1 0 0    2.73824 32.677    22.0
  4 1 0 1    2.67213 33.509    12.0
  5 1 0 2    2.50141 35.871    10.0
  6 1 0 3    2.27739 39.539    58.0
  7 0 0 6    2.04956 44.152    11.0
  8 1 0 5    1.82995 49.788    29.0
  9 1 0 6    1.64137 55.978    4.0
10 1 1 0    1.58052 58.336    14.0
11 0 0 8    1.53721 60.146    12.0
12 1 0 7    1.47816 62.815    2.0
13 1 1 4    1.40550 66.468    1.0
14 2 0 0    1.36910 68.476    3.0
15 2 0 1    1.36006 68.995    2.0
16 1 0 8    1.34057 70.144    5.0
17 2 0 3    1.29822 72.790    7.0
18 1 1 6    1.25142 75.982    7.0
19 0 0 10    1.22970 77.572    2.0
20 1 0 9    1.22245 78.119    2.0
21 2 0 5    1.19611 80.182    4.0
22 2 0 6    1.13836 85.169    1.0
23 1 0 10    1.12200 86.714    1.0
24 1 1 8    1.10182 88.712    10.0
25 2 0 7    1.07990 91.009    1.0
26 1 0 11    1.03503 96.186    9.0
27 2 0 8    1.02215 97.808    3.0
28 2 1 3    1.00321 100.320    6.0
29 1 1 10    0.97069 105.039    2.0
30 2 0 9    0.96697 105.616    1.0
31 2 1 5    0.95373 107.738    5.0
32 3 0 0    0.91255 115.155    3.0
33 3 0 2    0.90263 117.165    1.0
34 1 0 13    0.89415 118.969    5.0
35 3 0 3    0.89081 119.702    1.0
36 0 0 14    0.87846 122.534    1.0
37 2 0 11    0.86579 125.674    4.0
38 2 1 8    0.85837 127.636    2.0
39 1 0 14    0.83651 134.102    1.0
40 3 0 6    0.83373 135.011    1.0

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