Pseudobrookite
Pauling L
Zeitschrift fur Kristallographie 73 (1930) 97-113
The crystal structure of pseudobrookite
_cod_database_code 1011342
_database_code_amcsd 0018179
CELL PARAMETERS: 3.7250 9.7900 9.9300 90.000 90.000 90.000
SPACE GROUP: Cmcm
X-RAY WAVELENGTH: 1.541838
Cell Volume: 362.125
Density (g/cm3): 4.393
MAX. ABS. INTENSITY / VOLUME**2: 32.71253161
RIR: 2.424
RIR based on corundum from Acta Crystallographica A38 (1982) 733-739
2-THETA INTENSITY D-SPACING H K L Multiplicity
17.86 14.93 4.9650 0 0 2 2
18.12 36.56 4.8950 0 2 0 2
25.55 10.58 3.4858 0 2 2 4
25.59 100.00 3.4815 1 1 0 4
27.14 4.60 3.2854 1 1 1 8
31.38 16.35 2.8505 1 1 2 8
32.66 87.40 2.7420 0 2 3 4
36.61 19.50 2.4546 1 3 0 4
36.72 9.21 2.4475 0 4 0 2
37.49 26.07 2.3989 1 1 3 8
37.75 2.42 2.3829 1 3 1 8
40.75 6.89 2.2140 0 2 4 4
41.02 1.63 2.2004 1 3 2 8
41.12 18.49 2.1953 0 4 2 4
46.03 6.05 1.9716 1 3 3 8
46.13 24.29 1.9679 0 4 3 4
48.90 31.77 1.8625 2 0 0 2
49.53 7.58 1.8403 0 2 5 4
52.42 11.07 1.7455 1 3 4 8
52.47 1.51 1.7438 2 0 2 4
52.57 3.05 1.7408 2 2 0 4
52.82 1.43 1.7332 1 5 0 4
53.09 4.88 1.7251 1 1 5 8
53.68 1.09 1.7073 1 5 1 8
55.53 11.12 1.6550 0 0 6 2
55.98 1.55 1.6427 2 2 2 8
56.22 9.65 1.6363 1 5 2 8
56.39 2.02 1.6317 0 6 0 2
57.22 5.34 1.6101 0 6 1 4
58.91 2.23 1.5678 0 2 6 4
59.91 6.71 1.5439 1 3 5 8
60.05 23.25 1.5407 2 2 3 8
60.28 19.72 1.5354 1 5 3 8
62.10 4.70 1.4947 1 1 6 8
62.68 3.51 1.4822 2 4 0 4
63.57 1.49 1.4635 0 6 3 4
65.49 2.27 1.4253 2 2 4 8
65.71 1.71 1.4211 1 5 4 8
65.75 7.05 1.4202 2 4 2 8
68.36 3.22 1.3722 1 3 6 8
68.92 2.63 1.3625 0 2 7 4
69.49 9.70 1.3527 2 4 3 8
71.86 5.63 1.3137 1 1 7 8
72.14 2.84 1.3093 1 7 0 4
72.16 3.93 1.3091 2 2 5 8
72.37 2.49 1.3058 1 5 5 8
72.87 4.32 1.2981 1 7 1 8
75.02 4.49 1.2660 1 7 2 8
75.39 4.53 1.2607 0 6 5 4
77.09 6.27 1.2371 2 0 6 4
77.49 2.53 1.2318 3 1 0 4
77.83 1.24 1.2273 2 6 0 4
78.53 3.27 1.2180 2 6 1 8
79.99 1.38 1.1994 2 2 6 8
80.91 1.99 1.1882 0 8 2 4
83.26 1.64 1.1605 3 3 0 4
83.79 2.37 1.1544 3 1 3 8
84.12 1.16 1.1507 2 6 3 8
88.21 1.53 1.1077 1 3 8 8
88.28 2.61 1.1070 0 4 8 4
89.02 2.27 1.0997 2 2 7 8
89.70 1.88 1.0931 1 7 5 8
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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.