Zoisite
Liebscher A, Gottschalk M, Franz G
American Mineralogist 87 (2002) 909-921
The substitution Fe-Al and the isosymmetric displacive phase transition
in synthetic zoisite: A powder X-ray and infrared spectroscopic study
Sample: Zo2, X(Fe/(Fe+Al-2)) = 0.062
_database_code_amcsd 0002857
CELL PARAMETERS: 16.2009 5.5536 10.0336 90.000 90.000 90.000
SPACE GROUP: Pnma
X-RAY WAVELENGTH: 1.541838
Cell Volume: 902.756
Density (g/cm3): 3.356
MAX. ABS. INTENSITY / VOLUME**2: 6.881927307
RIR: 0.668
RIR based on corundum from Acta Crystallographica A38 (1982) 733-739
2-THETA INTENSITY D-SPACING H K L Multiplicity
10.92 15.63 8.1004 2 0 0 2
17.68 27.21 5.0168 0 0 2 2
18.51 2.34 4.7923 1 0 2 4
19.07 7.34 4.6541 1 1 1 8
20.83 3.08 4.2651 2 0 2 4
21.95 15.22 4.0502 4 0 0 2
23.69 7.28 3.7558 4 0 1 4
24.21 13.05 3.6755 3 0 2 4
24.54 1.27 3.6282 1 1 2 8
24.65 31.30 3.6121 3 1 1 8
28.32 11.73 3.1514 4 0 2 4
28.69 4.72 3.1111 4 1 1 8
28.88 9.66 3.0914 2 0 3 4
28.96 17.24 3.0834 5 0 1 4
31.22 100.00 2.8651 0 1 3 4
31.72 17.69 2.8213 1 1 3 8
32.24 42.22 2.7768 0 2 0 2
32.91 33.40 2.7218 5 0 2 4
33.17 10.35 2.7011 2 1 3 8
33.18 23.81 2.7001 6 0 0 2
33.23 70.58 2.6958 5 1 1 8
33.95 2.43 2.6404 1 2 1 8
34.13 18.15 2.6268 2 2 0 4
34.40 1.23 2.6074 6 0 1 4
35.47 23.00 2.5309 3 1 3 8
35.80 1.77 2.5084 0 0 4 2
36.24 5.28 2.4789 1 0 4 4
36.77 1.68 2.4441 5 1 2 8
37.00 7.61 2.4295 0 2 2 4
37.43 27.09 2.4026 1 2 2 8
37.54 4.24 2.3961 2 0 4 4
37.84 1.68 2.3776 6 0 2 4
38.13 5.60 2.3602 6 1 1 8
38.49 16.34 2.3390 4 1 3 8
38.69 1.01 2.3272 5 0 3 4
38.69 27.38 2.3271 2 2 2 8
39.82 3.82 2.2636 1 1 4 8
39.98 4.81 2.2552 7 0 1 4
40.40 12.27 2.2328 4 2 1 8
40.72 4.10 2.2156 3 2 2 8
42.69 6.64 2.1181 1 2 3 8
42.96 2.60 2.1052 3 1 4 8
43.05 10.10 2.1009 6 0 3 4
43.82 26.24 2.0658 2 2 3 8
43.88 22.64 2.0634 5 2 1 8
44.75 14.52 2.0251 8 0 0 2
45.57 1.78 1.9908 4 1 4 8
45.67 2.23 1.9866 3 2 3 8
45.70 5.42 1.9851 8 0 1 4
45.74 7.81 1.9835 5 0 4 4
46.19 4.11 1.9655 7 1 2 8
46.63 6.10 1.9478 2 0 5 4
46.73 13.87 1.9438 5 2 2 8
47.81 3.19 1.9026 8 1 0 4
48.39 1.19 1.8810 3 0 5 4
48.48 4.63 1.8779 8 0 2 4
48.71 1.09 1.8693 8 1 1 8
48.75 3.78 1.8679 5 1 4 8
48.93 1.43 1.8614 0 2 4 4
49.28 25.14 1.8492 1 2 4 8
49.60 4.38 1.8381 2 1 5 8
50.30 1.13 1.8141 2 2 4 8
51.96 2.26 1.7598 3 2 4 8
52.45 1.93 1.7447 6 1 4 8
53.09 3.65 1.7251 3 3 1 8
53.57 5.59 1.7107 4 1 5 8
54.13 2.19 1.6943 9 0 2 4
54.23 1.15 1.6913 4 2 4 8
54.35 7.89 1.6880 9 1 1 8
54.78 5.93 1.6757 7 2 2 8
54.79 1.01 1.6754 6 2 3 8
54.90 2.21 1.6723 0 0 6 2
55.22 3.74 1.6634 1 0 6 4
56.22 3.74 1.6362 8 2 0 4
56.42 7.86 1.6308 5 1 5 8
56.81 8.98 1.6206 9 1 2 8
56.85 13.33 1.6197 0 3 3 4
57.06 26.48 1.6140 5 2 4 8
57.16 3.67 1.6116 1 3 3 8
57.19 2.10 1.6106 6 0 5 4
57.71 18.85 1.5974 3 0 6 4
58.08 1.74 1.5882 2 3 3 8
58.12 10.90 1.5871 5 3 1 8
59.42 2.21 1.5556 8 2 2 8
59.43 7.46 1.5553 10 1 0 4
59.59 4.18 1.5514 3 3 3 8
59.78 3.30 1.5469 6 1 5 8
59.83 6.00 1.5457 4 0 6 4
60.21 7.13 1.5369 10 1 1 8
61.14 1.20 1.5159 8 1 4 8
61.42 1.28 1.5094 6 3 1 8
61.68 3.42 1.5039 4 3 3 8
62.15 1.08 1.4936 9 2 1 8
63.62 2.68 1.4626 7 1 5 8
63.62 5.15 1.4625 9 0 4 4
63.84 3.02 1.4580 10 0 3 4
64.06 1.04 1.4536 5 2 5 8
64.21 16.10 1.4505 7 2 4 8
64.42 5.70 1.4463 9 2 2 8
65.12 2.74 1.4325 0 2 6 4
65.40 10.76 1.4270 1 2 6 8
66.12 1.85 1.4132 11 0 2 4
66.25 1.04 1.4107 2 2 6 8
66.86 1.31 1.3993 10 2 0 4
67.46 26.39 1.3884 0 4 0 2
67.48 1.04 1.3879 0 1 7 4
67.66 2.06 1.3847 3 2 6 8
68.11 1.17 1.3766 9 2 3 8
68.46 1.04 1.3704 8 2 4 8
68.60 1.33 1.3680 2 1 7 8
69.45 1.32 1.3533 5 3 4 8
69.77 17.17 1.3479 10 2 2 8
70.13 1.25 1.3419 2 3 5 8
70.24 1.40 1.3400 9 0 5 4
72.09 2.32 1.3102 5 2 6 8
73.34 10.03 1.2909 10 2 3 8
73.38 2.88 1.2903 11 2 1 8
73.41 1.57 1.2898 4 3 5 8
74.07 2.58 1.2800 9 3 1 8
74.35 1.86 1.2758 5 1 7 8
74.74 1.45 1.2701 11 0 4 4
74.76 1.24 1.2698 1 2 7 8
74.88 6.08 1.2681 8 2 5 8
75.03 1.41 1.2660 5 4 1 8
75.06 1.28 1.2655 6 2 6 8
75.41 1.25 1.2606 10 0 5 4
75.83 2.42 1.2545 5 3 5 8
75.86 2.62 1.2542 0 0 8 2
76.17 3.49 1.2499 9 3 2 8
76.92 2.56 1.2394 2 0 8 4
77.12 4.98 1.2368 5 4 2 8
77.27 2.97 1.2347 6 4 0 4
77.30 2.16 1.2344 6 1 7 8
78.22 1.92 1.2220 10 2 4 8
78.45 2.88 1.2191 10 3 0 4
78.76 1.64 1.2151 6 3 5 8
78.95 1.94 1.2126 11 2 3 8
79.14 3.54 1.2102 10 3 1 8
79.41 2.99 1.2068 9 2 5 8
80.03 1.03 1.1990 6 4 2 8
80.73 1.30 1.1903 7 1 7 8
81.14 4.90 1.1854 5 2 7 8
82.18 1.19 1.1730 7 3 5 8
83.45 1.24 1.1583 6 4 3 8
84.01 1.10 1.1520 6 2 7 8
84.63 2.51 1.1451 8 4 0 4
85.21 1.33 1.1389 10 1 6 8
85.34 1.43 1.1374 5 4 4 8
85.77 3.15 1.1329 14 1 0 4
85.98 1.08 1.1306 2 4 5 8
87.35 1.15 1.1164 8 4 2 8
87.55 1.68 1.1143 6 1 8 8
88.98 3.35 1.1000 4 2 8 8
89.08 2.26 1.0991 9 1 7 8
89.65 1.04 1.0936 14 0 3 4
89.97 2.76 1.0906 1 1 9 8
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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.