Chondrodite
Friedrich A, Lager G A, Ulmer P, Kunz M, Marshall W G
American Mineralogist 87 (2002) 931-939
High-pressure single-crystal X-ray and powder neutron study of
F,OH/OD-chondrodite: Compressibility, structure, and hydrogen bonding
Sample: P = 4.952 GPa, X-ray
_database_code_amcsd 0002861
CELL PARAMETERS: 4.6881 10.1222 7.7660 108.989 90.000 90.000
SPACE GROUP: P2_1/b
X-RAY WAVELENGTH: 1.541838
Cell Volume: 348.472
Density (g/cm3): 3.281
MAX. ABS. INTENSITY / VOLUME**2: 4.867588715
RIR: 0.483
RIR based on corundum from Acta Crystallographica A38 (1982) 733-739
2-THETA INTENSITY D-SPACING H K L Multiplicity
12.05 11.32 7.3434 0 0 1 2
18.55 58.20 4.7842 0 -2 1 2
21.10 1.18 4.2102 1 1 0 4
22.50 17.73 3.9515 1 0 1 4
22.79 1.92 3.9014 1 -1 1 4
24.24 17.49 3.6717 0 0 2 2
25.30 26.99 3.5196 0 2 1 2
25.32 22.55 3.5179 0 -2 2 2
25.86 28.56 3.4459 1 1 1 4
26.62 23.50 3.3490 1 2 0 4
26.62 5.17 3.3485 1 -2 1 4
29.91 59.54 2.9871 1 -1 2 4
30.94 6.41 2.8907 1 0 2 4
31.80 10.06 2.8138 1 -2 2 4
32.85 47.48 2.7266 1 -3 1 4
33.99 56.91 2.6376 1 3 0 4
34.64 74.64 2.5897 1 1 2 4
35.32 2.13 2.5410 0 2 2 2
35.34 1.09 2.5399 0 -2 3 2
36.20 58.70 2.4817 1 -3 2 4
36.71 6.11 2.4478 0 0 3 2
37.59 9.12 2.3928 0 4 0 2
37.60 6.59 2.3921 0 -4 2 2
39.28 32.45 2.2938 1 3 1 4
39.58 18.01 2.2768 2 1 0 4
39.86 39.36 2.2614 1 -1 3 4
40.37 40.25 2.2340 1 2 2 4
40.39 43.46 2.2332 1 -2 3 4
40.51 46.33 2.2268 1 -4 1 4
40.57 3.45 2.2239 2 -1 1 4
42.47 10.96 2.1285 2 1 1 4
43.13 1.79 2.0975 1 -3 3 4
43.44 7.25 2.0831 0 -4 3 2
45.21 6.07 2.0057 2 -1 2 4
45.45 4.66 1.9957 1 1 3 4
47.32 3.84 1.9209 2 -3 1 4
49.12 5.90 1.8549 1 -5 1 4
49.66 1.17 1.8358 0 0 4 2
49.95 4.98 1.8258 1 -5 2 4
50.98 4.33 1.7914 1 2 3 4
51.00 1.18 1.7909 1 -2 4 4
51.37 4.95 1.7787 1 -1 4 4
51.57 4.82 1.7722 1 5 0 4
51.99 1.24 1.7590 0 -4 4 2
52.52 4.82 1.7425 1 -3 4 4
53.16 50.77 1.7229 2 2 2 4
53.17 49.23 1.7226 2 -2 3 4
53.27 41.08 1.7197 2 -4 1 4
54.18 4.79 1.6930 2 0 3 4
54.77 1.36 1.6759 0 -6 2 2
54.83 10.46 1.6745 2 4 0 4
54.83 4.14 1.6742 2 -4 2 4
55.42 2.05 1.6579 2 -3 3 4
57.01 4.26 1.6154 1 5 1 4
57.36 2.32 1.6063 2 1 3 4
57.57 1.46 1.6010 1 1 4 4
57.80 9.05 1.5952 0 6 0 2
57.82 6.16 1.5947 0 -6 3 2
57.88 12.07 1.5932 1 3 3 4
58.48 1.31 1.5783 1 -6 1 4
59.16 1.41 1.5618 2 3 2 4
59.35 8.66 1.5571 2 -4 3 4
59.51 2.91 1.5533 0 2 4 2
59.53 3.12 1.5529 0 -2 5 2
59.98 2.48 1.5423 3 1 0 4
60.58 1.65 1.5285 3 0 1 4
60.71 2.83 1.5255 3 -1 1 4
60.73 3.06 1.5251 1 -5 4 4
61.24 1.10 1.5136 2 -5 2 4
62.14 3.14 1.4937 3 1 1 4
62.48 2.67 1.4864 2 -1 4 4
62.49 5.40 1.4863 0 4 3 2
62.52 3.51 1.4856 0 -4 5 2
62.52 1.68 1.4855 3 2 0 4
62.66 3.43 1.4827 2 5 0 4
63.32 36.43 1.4687 0 0 5 2
63.59 28.39 1.4632 0 6 1 2
63.62 30.08 1.4626 0 -6 4 2
63.69 12.60 1.4610 1 -3 5 4
64.27 2.47 1.4493 3 -1 2 4
64.47 1.17 1.4453 2 0 4 4
64.79 1.55 1.4390 2 -5 3 4
65.34 1.52 1.4281 3 -2 2 4
65.95 3.52 1.4163 3 -3 1 4
66.43 1.69 1.4073 2 4 2 4
66.64 3.38 1.4034 3 3 0 4
67.04 4.67 1.3960 3 1 2 4
67.91 16.11 1.3802 1 -7 2 4
68.02 6.40 1.3783 3 -3 2 4
69.85 3.92 1.3465 1 3 4 4
70.04 2.44 1.3435 3 3 1 4
70.43 3.60 1.3369 3 -1 3 4
70.78 13.97 1.3311 3 2 2 4
70.79 12.80 1.3310 3 -2 3 4
70.87 9.17 1.3296 3 -4 1 4
70.93 1.09 1.3287 2 -5 4 4
71.54 1.58 1.3188 2 6 0 4
71.65 1.11 1.3172 3 0 3 4
71.78 2.66 1.3151 0 6 2 2
71.82 2.29 1.3144 0 -6 5 2
72.20 2.16 1.3084 3 4 0 4
72.21 3.26 1.3083 3 -4 2 4
73.08 1.27 1.2948 2 2 4 4
73.32 1.07 1.2911 0 2 5 2
75.04 4.16 1.2657 1 5 3 4
75.81 1.14 1.2548 2 -4 5 4
76.14 1.74 1.2503 3 4 1 4
76.48 1.39 1.2455 1 -3 6 4
76.55 1.25 1.2446 2 0 5 4
77.90 1.73 1.2263 1 4 4 4
77.94 1.66 1.2258 1 -4 6 4
78.26 1.00 1.2216 1 -8 2 4
79.43 1.56 1.2065 2 -5 5 4
80.23 1.28 1.1964 0 8 0 2
80.53 1.86 1.1928 2 1 5 4
80.76 1.79 1.1900 3 0 4 4
80.90 2.18 1.1883 1 -5 6 4
81.23 1.05 1.1842 1 0 6 4
81.70 1.85 1.1786 1 -7 5 4
82.26 7.55 1.1720 4 0 0 2
82.58 1.08 1.1682 3 -4 4 4
83.51 2.11 1.1576 1 3 5 4
83.58 2.59 1.1568 3 5 1 4
84.05 1.83 1.1515 3 1 4 4
84.07 1.59 1.1514 2 -7 4 4
84.32 2.51 1.1486 3 3 3 4
86.77 2.10 1.1223 3 -5 4 4
87.20 1.87 1.1179 2 7 1 4
87.29 4.38 1.1170 2 4 4 4
87.32 4.84 1.1166 2 -4 6 4
87.35 1.23 1.1163 3 6 0 4
87.37 1.29 1.1162 3 -6 3 4
87.64 3.91 1.1134 2 -8 2 4
88.82 1.06 1.1017 3 2 4 4
88.83 1.36 1.1015 3 -2 5 4
89.40 3.15 1.0960 3 -3 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.