Tugtupite
Antao S M, Hassan I, Parise J B
American Mineralogist 89 (2004) 492-497
Tugtupite: High-temperature structures obtained from in situ synchrotron
diffraction and Rietveld refinements
T = 210 C
_database_code_amcsd 0003454
CELL PARAMETERS: 8.6381 8.6381 8.8644 90.000 90.000 90.000
SPACE GROUP: I-4
X-RAY WAVELENGTH: 1.541838
Cell Volume: 661.436
Density (g/cm3): 2.348
MAX. ABS. INTENSITY / VOLUME**2: 16.92006411
RIR: 2.346
RIR based on corundum from Acta Crystallographica A38 (1982) 733-739
2-THETA INTENSITY D-SPACING H K L Multiplicity
14.32 35.67 6.1865 1 0 1 4
14.50 5.81 6.1081 1 1 0 4
20.03 6.10 4.4322 0 0 2 2
20.56 1.69 4.3191 2 0 0 4
24.82 31.19 3.5873 1 1 2 4
25.15 46.55 3.5414 2 1 1 4
25.15 53.45 3.5414 1 2 1 4
29.24 1.66 3.0540 2 2 0 4
32.01 4.26 2.7958 1 0 3 4
32.70 4.59 2.7385 3 0 1 4
32.79 2.96 2.7316 3 1 0 4
35.70 17.36 2.5148 2 2 2 4
38.35 6.18 2.3470 2 1 3 4
38.35 2.84 2.3470 1 2 3 4
38.72 2.24 2.3254 3 1 2 4
38.72 2.99 2.3254 1 3 2 4
38.94 2.61 2.3128 3 2 1 4
38.94 5.66 2.3128 2 3 1 4
43.44 8.53 2.0832 1 1 4 4
43.91 11.85 2.0622 3 0 3 4
44.43 5.45 2.0389 4 1 1 4
44.43 6.50 2.0389 1 4 1 4
44.50 7.58 2.0360 3 3 0 4
46.79 3.62 1.9414 4 0 2 4
48.95 3.61 1.8609 3 2 3 4
50.91 1.65 1.7936 2 2 4 4
51.62 2.37 1.7707 4 2 2 4
53.63 1.69 1.7090 1 4 3 4
54.08 4.30 1.6957 4 3 1 4
57.17 1.25 1.6113 1 2 5 4
58.47 1.19 1.5784 5 2 1 4
59.80 6.31 1.5466 4 0 4 4
60.64 2.55 1.5270 4 4 0 4
61.42 1.36 1.5097 3 0 5 4
62.25 1.06 1.4914 3 4 3 4
62.25 1.08 1.4914 5 0 3 4
62.91 1.46 1.4774 0 0 6 2
63.94 1.89 1.4561 4 2 4 4
63.94 1.98 1.4561 2 4 4 4
64.55 3.32 1.4437 4 4 2 4
64.75 1.54 1.4397 6 0 0 4
65.50 1.70 1.4251 3 2 5 4
65.50 1.61 1.4251 2 3 5 4
66.30 2.23 1.4097 2 5 3 4
66.55 2.32 1.4050 5 3 2 4
69.45 1.02 1.3533 1 4 5 4
70.85 1.30 1.3300 2 2 6 4
72.40 1.46 1.3052 6 2 2 4
72.77 1.06 1.2995 1 3 6 4
75.63 2.64 1.2574 4 4 4 4
79.68 1.37 1.2033 2 1 7 4
80.80 1.10 1.1895 2 5 5 4
81.55 1.21 1.1805 3 6 3 4
81.78 1.47 1.1777 1 7 2 4
81.92 1.22 1.1760 7 2 1 4
88.14 1.20 1.1084 6 1 5 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.