Titanite Kunz M, Arlt T, Stolz J American Mineralogist 85 (2000) 1465-1473 In situ powder diffraction study of titanite (CaTiOSiO4) at high pressure and high temperature Sample #023 at P = 4.10 GPa, T = 483 K _database_code_amcsd 0002546 CELL PARAMETERS: 6.9527 8.6576 6.4666 90.000 113.349 90.000 SPACE GROUP: A2/a X-RAY WAVELENGTH: 1.541838 Cell Volume: 357.372 Density (g/cm3): 3.643 MAX. ABS. INTENSITY / VOLUME**2: 14.41176922 RIR: 1.288 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 18.12 24.16 4.8963 0 1 1 4 20.52 1.76 4.3288 0 2 0 2 26.31 1.77 3.3870 1 1 1 4 27.94 100.00 3.1936 -2 1 1 4 27.96 1.04 3.1917 2 0 0 2 30.10 85.38 2.9685 0 0 2 2 32.02 7.68 2.7953 -2 0 2 2 34.56 92.18 2.5955 0 3 1 4 34.93 44.58 2.5689 2 2 0 4 38.33 3.23 2.3482 -2 2 2 4 38.37 5.91 2.3459 2 1 1 4 39.69 23.90 2.2710 1 3 1 4 40.32 12.18 2.2370 -3 1 1 4 40.84 8.15 2.2098 -2 3 1 4 41.73 4.97 2.1644 0 4 0 2 43.44 9.86 2.0830 -1 1 3 4 43.71 6.55 2.0707 1 2 2 4 44.18 7.61 2.0498 1 4 0 4 44.51 21.60 2.0355 -2 1 3 4 47.11 8.42 1.9293 0 1 3 4 47.62 1.11 1.9096 3 2 0 4 48.92 2.36 1.8620 2 3 1 4 49.53 3.70 1.8402 2 0 2 2 50.98 8.64 1.7913 2 4 0 4 52.17 1.71 1.7532 3 1 1 4 52.31 3.54 1.7489 0 4 2 4 53.33 14.62 1.7180 -4 0 2 2 53.55 14.47 1.7113 -2 4 2 4 54.11 2.91 1.6950 -2 3 3 4 54.16 19.00 1.6935 2 2 2 4 54.33 4.89 1.6886 -4 1 1 4 55.26 1.52 1.6623 0 5 1 4 55.56 1.67 1.6540 -1 5 1 4 56.37 28.57 1.6321 0 3 3 4 57.77 6.55 1.5958 4 0 0 2 59.81 12.30 1.5463 -2 5 1 4 61.07 1.01 1.5173 3 4 0 4 61.37 7.59 1.5108 -2 2 4 4 61.98 1.21 1.4973 4 2 0 4 62.58 5.30 1.4843 0 0 4 2 62.85 18.77 1.4785 -4 3 1 4 63.25 1.64 1.4701 1 3 3 4 64.59 2.40 1.4429 0 6 0 2 65.49 5.43 1.4252 2 1 3 4 66.21 8.30 1.4115 2 5 1 4 66.61 1.03 1.4040 0 2 4 4 66.72 1.51 1.4020 2 4 2 4 66.95 13.62 1.3976 -4 0 4 2 67.33 9.43 1.3907 -4 3 3 4 69.91 1.16 1.3456 -4 4 2 4 70.58 6.94 1.3345 -2 5 3 4 71.65 2.09 1.3171 -1 6 2 4 72.89 8.48 1.2977 0 6 2 4 73.21 2.17 1.2929 -2 4 4 4 74.16 1.02 1.2787 -2 1 5 4 75.09 9.63 1.2651 4 3 1 4 78.49 4.31 1.2185 4 0 2 2 78.61 1.35 1.2170 -5 3 3 4 79.58 1.44 1.2046 -3 6 2 4 80.41 1.03 1.1942 3 6 0 4 81.67 1.16 1.1790 2 0 4 2 82.84 1.39 1.1653 -3 3 5 4 85.33 2.26 1.1376 2 2 4 4 87.44 4.18 1.1155 -4 3 5 4 88.04 1.25 1.1094 2 5 3 4 88.49 2.14 1.1049 -4 -6 2 4 88.69 2.62 1.1029 2 7 1 4 89.18 5.52 1.0981 0 3 5 4 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.