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1樓 2012-04-24 22:22:03

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PDF#42-1300: QM=Star(S); d=Calculated; I=(Unknown)
Cobalt Oxide
Co O
Radiation=CuKa1 Lambda=1.5406 Filter=
Calibration= 2T=34.148-123.485 I/Ic(RIR)=
Ref: Grimes, R., Fitch, A.
J. Mater. Chem., v1 p461 (1991)
Cubic - (Unknown), F-43m (216) Z=4 mp=
CELL: 4.544 x 4.544 x 4.544 <90.0 x 90.0 x 90.0> P.S=cF8 (S Zn)
Density(c)=5.305 Density(m)=7.78A Mwt=74.93 Vol=93.82 F(10)=999.9(.0001,10/0)
Ref: Ibid.

Strong Lines: 2.62/X 1.61/3 1.37/2 2.27/2 0.93/1 1.02/1 0.87/1 1.14/1 1.04/1 1.31/1
NOTE: Prepared by decomposition of cobalt acetate between 275 C and 310 C.
Above 310 C this form transforms to a rock salt structure oxide.
D-values calculated using cell parameter reported in reference.
2-Theta d(?) I(v) ( h k l ) Theta 1/(2d) 2pi/d n^2
34.148 2.6235 100.0 ( 1 1 1) 17.074 0.1906 2.3950 3
39.636 2.2720 17.0 ( 2 0 0) 19.818 0.2201 2.7655 4
57.301 1.6065 49.0 ( 2 2 0) 28.650 0.3112 3.9110 8
68.419 1.3701 33.0 ( 3 1 1) 34.209 0.3649 4.5860 11
71.920 1.3117 2.0 ( 2 2 2) 35.960 0.3812 4.7900 12
85.385 1.1360 5.0 ( 4 0 0) 42.692 0.4401 5.5310 16
95.275 1.0425 5.0 ( 3 3 1) 47.638 0.4796 6.0272 19
98.593 1.0161 8.0 ( 4 2 0) 49.297 0.4921 6.1838 20
112.291 0.9275 14.0 ( 4 2 2) 56.145 0.5391 6.7740 24
123.485 0.8745 9.0 ( 5 1 1) 61.743 0.5718 7.1849 27

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3樓2012-04-25 10:49:55

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gyliu

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感謝參與，應(yīng)助指數(shù) +1

PDF#43-1004: QM=Calculated(C); d=Calculated; I=Calculated
Cobalt Oxide
Co O
Radiation=CuKa1 Lambda=1.54056 Filter=
Calibration= 2T=36.503-139.967 I/Ic(RIR)=4.55
Ref: Grier, D., McCarthy, G., North Dakota State University, Fargo, North Dakota, USA.
ICDD Grant-in-Aid (1991)
Cubic - (Unknown), Fm-3m (225) Z=4 mp=
CELL: 4.26 x 4.26 x 4.26 <90.0 x 90.0 x 90.0> P.S=cF8 (Cl Na)
Density(c)=6.437 Density(m)=7.78A Mwt=74.93 Vol=77.31 F(10)=249.9(.0040,10/0)
Ref: Ibid.

Strong Lines: 2.13/X 2.46/7 1.51/5 1.28/2 0.95/2 1.23/1 0.87/1 0.98/1 0.82/1 1.07/1
NOTE: Calculation of diffractometer peak intensities done with MICRO-POWD v.
2.2 (D.
Smith and K.
Smith) using default instrument broadening function (NBS Table), diffracted beam monochromator polarization correction, and atomic scattering factors corrected for anomalous dispersion.
Cell parameters from 9-402.
Atomic positions from Sasaki, S.
et al., Proc.
Jpn.
Acad., 55 43-48 (1979): Co in 4a, O in 4b.
Isotropic thermal parameters from same source: Co, B=.509; O, B=.67.
2-Theta d(?) I(v) ( h k l ) Theta 1/(2d) 2pi/d n^2
36.503 2.4595 58.0 ( 1 1 1) 18.251 0.2033 2.5547 3
42.401 2.1300 100.0 ( 2 0 0) 21.201 0.2347 2.9499 4
61.520 1.5061 71.0 ( 2 2 0) 30.760 0.3320 4.1718 8
73.700 1.2844 33.0 ( 3 1 1) 36.850 0.3893 4.8919 11
77.562 1.2298 23.0 ( 2 2 2) 38.781 0.4066 5.1091 12
92.650 1.0650 12.0 ( 4 0 0) 46.325 0.4695 5.8997 16
104.030 0.9773 15.0 ( 3 3 1) 52.015 0.5116 6.4291 19
107.920 0.9526 36.0 ( 4 2 0) 53.960 0.5249 6.5958 20
124.697 0.8696 32.0 ( 4 2 2) 62.348 0.5750 7.2254 24
139.967 0.8198 18.0 ( 5 1 1) 69.984 0.6099 7.6643 27

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2樓2012-04-25 10:49:18

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4樓2012-04-25 10:57:52

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