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 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.