Carbonate-hydroxylapatite
Fleet M E, Liu X, King P L
American Mineralogist 89 (2004) 1422-1432
Accommodation of the carbonate ion in apatite: An FTIR and X-ray structure study
of crystals synthesized at 2-4 GPa
Sample: xt373
_database_code_amcsd 0003647
CELL PARAMETERS: 9.4817 9.4817 6.8843 90.000 90.000 120.000
SPACE GROUP: P6_3/m
X-RAY WAVELENGTH: 1.541838
Cell Volume: 535.998
Density (g/cm3): 3.139
MAX. ABS. INTENSITY / VOLUME**2: 13.24694739
RIR: 1.374
RIR based on corundum from Acta Crystallographica A38 (1982) 733-739
2-THETA INTENSITY D-SPACING H K L Multiplicity
10.77 12.08 8.2114 1 0 0 6
16.81 3.46 5.2755 1 0 1 12
18.72 1.81 4.7408 1 1 0 6
21.65 4.46 4.1057 2 0 0 6
22.77 3.76 3.9046 1 1 1 12
25.26 1.63 3.5262 2 0 1 12
25.88 27.24 3.4422 0 0 2 2
28.11 2.77 3.1745 1 0 2 12
28.76 15.98 3.1036 1 2 0 6
31.62 70.44 2.8294 1 2 1 12
31.62 29.56 2.8294 2 1 1 12
32.14 63.56 2.7854 1 1 2 12
32.72 62.11 2.7371 3 0 0 6
33.99 15.98 2.6378 2 0 2 12
35.29 3.36 2.5435 3 0 1 12
39.08 2.02 2.3050 2 1 2 12
39.08 2.62 2.3050 1 2 2 12
39.57 5.20 2.2774 1 3 0 6
39.57 14.48 2.2774 3 1 0 6
41.78 4.91 2.1622 3 1 1 12
42.18 1.68 2.1424 3 0 2 12
43.83 4.95 2.0655 1 1 3 12
45.27 3.56 2.0031 2 0 3 12
46.52 29.80 1.9523 2 2 2 12
47.89 4.00 1.8993 1 3 2 12
47.89 8.14 1.8993 3 1 2 12
48.31 4.57 1.8838 3 2 0 6
49.39 19.96 1.8452 1 2 3 12
49.39 9.47 1.8452 2 1 3 12
50.21 9.41 1.8170 2 3 1 12
50.21 7.26 1.8170 3 2 1 12
50.96 4.80 1.7919 1 4 0 6
50.96 5.97 1.7919 4 1 0 6
51.86 10.98 1.7631 4 0 2 12
53.22 13.73 1.7211 0 0 4 2
54.47 1.13 1.6845 1 0 4 12
55.62 4.44 1.6525 2 3 2 12
56.97 1.94 1.6165 1 3 3 12
56.97 1.77 1.6165 3 1 3 12
57.71 1.27 1.5975 5 0 1 12
58.03 1.41 1.5894 1 4 2 12
59.58 4.48 1.5518 4 2 0 6
60.07 2.56 1.5402 3 3 1 12
61.23 2.84 1.5138 4 2 1 12
61.62 2.75 1.5051 2 1 4 12
61.62 1.71 1.5051 1 2 4 12
62.68 5.96 1.4822 5 0 2 12
63.03 1.96 1.4748 1 5 0 6
63.89 6.84 1.4570 3 0 4 12
63.94 4.79 1.4560 2 3 3 12
64.63 6.99 1.4421 1 5 1 12
64.93 1.87 1.4362 3 3 2 12
69.32 1.15 1.3556 1 5 2 12
71.18 3.04 1.3247 3 4 1 12
71.79 2.15 1.3149 2 5 0 6
73.70 3.20 1.2855 4 2 3 12
74.63 1.36 1.2717 6 0 2 12
74.71 1.10 1.2706 3 2 4 12
75.55 1.26 1.2586 2 1 5 12
75.55 3.03 1.2586 1 2 5 12
75.67 2.37 1.2568 4 3 2 12
76.79 2.99 1.2413 4 1 4 12
76.79 1.38 1.2413 1 4 4 12
76.83 3.46 1.2407 1 5 3 12
77.75 4.79 1.2283 5 2 2 12
82.99 2.64 1.1635 3 4 3 12
83.97 1.42 1.1525 2 4 4 12
83.97 2.19 1.1525 4 2 4 12
87.01 2.28 1.1199 1 5 4 12
87.46 3.40 1.1152 1 1 6 12
87.82 1.11 1.1116 3 2 5 12
87.94 1.11 1.1103 7 0 2 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.