B3 K3 O6
Zachariasen W
Journal of Chemical Physics 5 (1937) 919-922
The Crystal Structure of Potassium Metaborate K3 (B3 O6)
_cod_database_code 1010521
_database_code_amcsd 0017432
CELL PARAMETERS: 7.7600 7.7600 7.7600 110.600 110.600 110.600
SPACE GROUP: R-3c
X-RAY WAVELENGTH: 1.541838
Cell Volume: 343.866
Density (g/cm3): 2.373
MAX. ABS. INTENSITY / VOLUME**2: 11.60385841
RIR: 1.592
RIR based on corundum from Acta Crystallographica A38 (1982) 733-739
2-THETA INTENSITY D-SPACING H K L Multiplicity
24.54 5.15 3.6272 0 -1 2 12
25.65 30.92 3.4729 1 1 0 6
27.97 5.67 3.1899 0 -2 2 6
29.28 93.15 3.0502 2 0 0 6
31.65 100.00 2.8268 2 -2 1 12
32.54 9.08 2.7519 2 -1 1 12
37.29 2.29 2.4114 2 -3 1 12
37.55 19.60 2.3954 0 -2 3 12
38.31 19.93 2.3493 0 -1 3 12
39.56 31.83 2.2780 2 1 0 12
40.94 8.11 2.2046 2 -2 2 6
42.51 26.76 2.1266 0 -3 3 6
45.15 17.93 2.0081 3 -3 1 12
47.47 16.04 1.9155 -1 -2 4 12
48.10 9.44 1.8916 -1 -1 4 6
50.31 2.51 1.8136 0 -2 4 12
50.58 2.41 1.8046 2 1 1 6
51.66 3.48 1.7694 3 -4 1 12
51.86 7.84 1.7631 0 -3 4 12
52.45 5.42 1.7445 3 -3 2 12
52.71 11.96 1.7364 2 2 0 6
53.43 9.07 1.7147 3 -2 2 12
53.43 9.07 1.7147 0 -1 4 12
54.79 1.37 1.6755 3 1 0 12
57.50 2.38 1.6028 4 -2 1 12
57.81 1.34 1.5950 0 -4 4 6
58.79 3.98 1.5707 3 -1 2 12
59.95 5.06 1.5431 4 -4 1 12
60.49 1.63 1.5306 -1 -2 5 12
60.73 1.69 1.5251 4 0 0 6
64.27 5.34 1.4494 3 -4 3 6
64.27 2.74 1.4494 0 -3 5 12
66.11 1.94 1.4134 4 -4 2 12
66.34 2.51 1.4091 3 -2 3 6
69.94 1.74 1.3450 0 -1 5 12
70.55 5.39 1.3348 5 -3 1 12
71.44 5.02 1.3205 4 1 0 12
71.50 2.29 1.3196 5 -4 1 12
74.93 1.08 1.2673 4 -1 2 12
76.23 4.53 1.2489 5 -5 1 12
78.43 3.16 1.2194 2 2 2 2
80.08 1.50 1.1984 5 -1 1 12
81.77 1.39 1.1778 4 -2 3 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.