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 = 516 C
_database_code_amcsd 0003457
CELL PARAMETERS: 8.6671 8.6671 8.8857 90.000 90.000 90.000
SPACE GROUP: I-4
X-RAY WAVELENGTH: 1.541838
Cell Volume: 667.482
Density (g/cm3): 2.327
MAX. ABS. INTENSITY / VOLUME**2: 16.32613698
RIR: 2.285
RIR based on corundum from Acta Crystallographica A38 (1982) 733-739
2-THETA INTENSITY D-SPACING H K L Multiplicity
14.28 37.84 6.2044 1 0 1 4
14.45 6.37 6.1286 1 1 0 4
19.98 6.28 4.4429 0 0 2 2
20.49 1.68 4.3335 2 0 0 4
24.75 31.76 3.5971 1 1 2 4
25.06 46.59 3.5527 2 1 1 4
25.06 53.41 3.5527 1 2 1 4
29.14 1.76 3.0643 2 2 0 4
31.93 4.43 2.8028 1 0 3 4
32.59 4.92 2.7475 3 0 1 4
32.67 2.94 2.7408 3 1 0 4
35.59 17.58 2.5225 2 2 2 4
38.24 5.75 2.3534 2 1 3 4
38.24 2.62 2.3534 1 2 3 4
38.60 1.94 2.3326 3 1 2 4
38.60 2.55 2.3326 1 3 2 4
38.81 2.47 2.3204 3 2 1 4
38.81 5.23 2.3204 2 3 1 4
41.68 1.14 2.1668 4 0 0 4
43.32 8.03 2.0885 1 1 4 4
43.77 11.52 2.0681 3 0 3 4
44.28 5.48 2.0456 4 1 1 4
44.28 6.00 2.0456 1 4 1 4
44.34 7.40 2.0429 3 3 0 4
46.64 3.12 1.9475 4 0 2 4
48.79 3.24 1.8665 3 2 3 4
50.76 1.49 1.7985 2 2 4 4
51.44 2.12 1.7764 4 2 2 4
53.45 1.70 1.7142 1 4 3 4
53.89 4.07 1.7013 4 3 1 4
57.01 1.26 1.6154 1 2 5 4
58.26 1.14 1.5837 5 2 1 4
59.61 5.58 1.5511 4 0 4 4
60.42 2.30 1.5321 4 4 0 4
61.23 1.21 1.5137 3 0 5 4
62.04 1.06 1.4960 3 4 3 4
62.74 1.36 1.4809 0 0 6 2
63.73 1.62 1.4604 4 2 4 4
63.73 1.85 1.4604 2 4 4 4
64.31 3.12 1.4484 4 4 2 4
64.51 1.40 1.4445 6 0 0 4
65.30 1.50 1.4290 3 2 5 4
65.30 1.36 1.4290 2 3 5 4
66.07 1.94 1.4142 2 5 3 4
66.31 1.98 1.4096 5 3 2 4
70.64 1.35 1.3334 2 2 6 4
72.13 1.47 1.3095 6 2 2 4
75.36 2.54 1.2612 4 4 4 4
79.44 1.19 1.2063 2 1 7 4
80.52 1.01 1.1929 2 5 5 4
81.23 1.06 1.1842 3 6 3 4
81.45 1.26 1.1816 1 7 2 4
81.59 1.01 1.1800 7 2 1 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.