Celestine
Hawthorne F C, Ferguson R B
The Canadian Mineralogist 13 (1975) 181-187
Anhydrous sulphates. I: Refinement of the crystal structure of celestite
with an appendix on the structure of thenardite
_database_code_amcsd 0005112
CELL PARAMETERS: 8.3600 5.3520 6.8580 90.000 90.000 90.000
SPACE GROUP: Pnma
X-RAY WAVELENGTH: 1.541838
Cell Volume: 306.846
Density (g/cm3): 3.976
MAX. ABS. INTENSITY / VOLUME**2: 24.88175930
RIR: 2.038
RIR based on corundum from Acta Crystallographica A38 (1982) 733-739
2-THETA INTENSITY D-SPACING H K L Multiplicity
21.06 9.59 4.2192 0 1 1 4
21.26 4.67 4.1800 2 0 0 2
23.62 34.11 3.7667 1 1 1 8
24.95 1.54 3.5693 2 0 1 4
25.98 26.04 3.4290 0 0 2 2
27.07 93.95 3.2943 2 1 0 4
28.13 52.98 3.1725 1 0 2 4
30.09 100.00 2.9695 2 1 1 8
32.82 63.70 2.7291 1 1 2 8
33.49 49.98 2.6760 0 2 0 2
33.81 1.25 2.6511 2 0 2 4
34.75 5.92 2.5817 3 0 1 4
37.65 3.53 2.3890 1 2 1 8
37.87 15.91 2.3756 2 1 2 8
40.01 13.81 2.2537 2 2 0 4
40.93 4.13 2.2050 1 0 3 4
41.77 6.23 2.1626 3 0 2 4
42.21 25.49 2.1411 2 2 1 8
43.29 1.36 2.0900 4 0 0 2
44.28 47.65 2.0455 1 2 2 8
44.44 38.33 2.0388 1 1 3 8
45.21 3.35 2.0057 2 0 3 4
45.22 32.48 2.0051 3 1 2 8
45.36 38.38 1.9992 4 0 1 4
46.66 13.97 1.9468 4 1 0 4
49.03 5.37 1.8580 3 2 1 8
51.72 17.42 1.7674 3 0 3 4
53.04 3.36 1.7265 0 3 1 4
53.44 3.02 1.7145 0 0 4 2
54.25 2.92 1.6909 1 3 1 8
54.65 4.18 1.6795 1 0 4 4
54.69 8.20 1.6783 3 1 3 8
56.05 7.18 1.6408 2 3 0 4
56.66 1.86 1.6244 5 0 1 4
57.51 3.91 1.6025 1 1 4 8
57.55 12.92 1.6016 4 2 1 8
57.78 9.97 1.5958 2 3 1 8
58.16 1.16 1.5863 2 0 4 4
59.44 11.75 1.5550 1 3 2 8
59.47 1.82 1.5544 5 1 1 8
60.91 2.04 1.5209 2 1 4 8
62.78 1.80 1.4801 2 3 2 8
63.03 19.25 1.4748 3 2 3 8
64.39 5.72 1.4469 5 1 2 8
64.55 3.49 1.4436 0 2 4 4
65.63 9.59 1.4226 1 2 4 8
66.35 2.21 1.4088 3 1 4 8
67.45 3.93 1.3886 5 2 1 8
67.54 7.48 1.3869 1 3 3 8
68.14 7.62 1.3762 3 3 2 8
68.80 1.23 1.3645 2 2 4 8
69.24 4.76 1.3569 4 3 0 4
69.67 4.18 1.3495 5 0 3 4
69.74 5.43 1.3484 6 1 0 4
70.36 8.19 1.3380 0 4 0 2
70.93 4.11 1.3287 0 1 5 4
71.28 8.81 1.3231 6 1 1 8
72.19 5.57 1.3086 5 1 3 8
72.53 1.49 1.3032 2 0 5 4
73.62 3.39 1.2867 4 1 4 8
73.94 1.89 1.2818 3 2 4 8
75.01 5.77 1.2662 2 1 5 8
75.76 4.38 1.2556 3 3 3 8
76.41 1.56 1.2465 0 4 2 4
77.19 1.99 1.2358 6 2 0 4
77.41 5.27 1.2328 1 4 2 8
78.16 2.75 1.2229 1 3 4 8
79.55 10.56 1.2050 5 2 3 8
80.00 1.29 1.1993 3 1 5 8
80.93 1.17 1.1879 3 4 1 8
82.29 2.99 1.1717 2 2 5 8
82.59 1.66 1.1682 5 1 4 8
84.25 1.91 1.1494 5 3 2 8
84.49 4.89 1.1467 4 0 5 4
84.83 2.27 1.1430 0 0 6 2
86.24 3.71 1.1278 7 0 2 4
87.78 8.13 1.1120 4 4 1 8
88.62 1.32 1.1036 7 1 2 8
89.18 2.42 1.0981 6 3 0 4
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XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs
For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.