Hexacelsian
Kremenovic A, Colomban P, Piriou B, Massiot D, Florian P
Journal of Physics and Chemistry of Solids 64 (2003) 2253-2268
Structural and spectroscopic characterization of the quenched hexacelsian
_database_code_amcsd 0013253
CELL PARAMETERS: 5.2920 5.2920 15.5570 90.000 90.000 120.000
SPACE GROUP: P6_3/mcm
X-RAY WAVELENGTH: 1.541838
Cell Volume: 377.308
Density (g/cm3): 3.306
MAX. ABS. INTENSITY / VOLUME**2: 54.20519722
RIR: 5.339
RIR based on corundum from Acta Crystallographica A38 (1982) 733-739
2-THETA INTENSITY D-SPACING H K L Multiplicity
11.38 28.86 7.7785 0 0 2 2
22.52 100.00 3.9486 1 0 2 12
30.14 71.03 2.9654 1 0 4 12
33.88 42.49 2.6460 1 1 0 6
34.59 2.56 2.5928 0 0 6 2
35.85 4.36 2.5050 1 1 2 12
39.32 9.22 2.2915 2 0 0 6
39.95 13.97 2.2567 1 0 6 12
41.06 25.94 2.1981 2 0 2 12
41.27 5.93 2.1877 1 1 4 12
45.97 5.02 1.9743 2 0 4 12
46.71 5.79 1.9446 0 0 8 2
49.20 16.45 1.8519 1 1 6 12
51.02 1.99 1.7901 1 0 8 12
54.25 14.27 1.6908 2 1 2 24
58.31 16.16 1.5824 2 1 4 24
58.94 9.96 1.5670 1 1 8 12
60.61 6.61 1.5277 3 0 0 6
62.66 2.39 1.4827 2 0 8 12
63.11 5.70 1.4731 1 0 10 12
64.72 4.42 1.4404 2 1 6 24
71.28 6.08 1.3230 2 2 0 6
71.71 4.32 1.3162 3 0 6 12
73.17 1.21 1.2935 2 1 8 24
73.59 6.29 1.2871 2 0 10 12
75.84 4.26 1.2545 3 1 2 24
76.34 1.30 1.2475 1 0 12 12
79.30 5.29 1.2082 3 1 4 24
79.84 3.42 1.2013 3 0 8 12
81.71 1.70 1.1785 2 2 6 12
82.93 1.45 1.1642 1 1 12 12
83.53 4.52 1.1574 2 1 10 24
84.98 1.55 1.1413 3 1 6 24
85.70 1.72 1.1335 4 0 2 12
89.09 1.00 1.0991 4 0 4 12
89.62 3.07 1.0939 2 2 8 12
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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.