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 #033 at P = 4.36 GPa, T = 301 K _database_code_amcsd 0002556 CELL PARAMETERS: 6.9414 8.6521 6.4553 90.000 113.357 90.000 SPACE GROUP: A2/a X-RAY WAVELENGTH: 1.541838 Cell Volume: 355.920 Density (g/cm3): 3.658 MAX. ABS. INTENSITY / VOLUME**2: 13.82198678 RIR: 1.230 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 18.14 23.85 4.8893 0 1 1 4 20.53 1.05 4.3260 0 2 0 2 26.36 2.37 3.3815 1 1 1 4 27.98 100.00 3.1889 -2 1 1 4 28.00 1.33 3.1863 2 0 0 2 30.16 85.03 2.9632 0 0 2 2 32.07 8.17 2.7906 -2 0 2 2 34.59 96.52 2.5933 0 3 1 4 34.97 47.97 2.5655 2 2 0 4 38.38 3.96 2.3451 -2 2 2 4 38.44 5.88 2.3420 2 1 1 4 39.73 30.51 2.2685 1 3 1 4 40.38 12.73 2.2335 -3 1 1 4 40.88 7.82 2.2075 -2 3 1 4 41.76 5.34 2.1630 0 4 0 2 43.52 10.09 2.0795 -1 1 3 4 43.79 7.59 2.0675 1 2 2 4 44.22 7.46 2.0483 1 4 0 4 44.59 22.93 2.0322 -2 1 3 4 47.19 8.78 1.9259 0 1 3 4 47.70 1.73 1.9067 3 2 0 4 48.98 1.61 1.8596 2 3 1 4 49.63 3.91 1.8369 2 0 2 2 50.60 1.19 1.8038 -3 3 1 4 51.03 7.69 1.7896 2 4 0 4 52.27 1.39 1.7502 3 1 1 4 52.37 3.94 1.7471 0 4 2 4 53.42 15.32 1.7152 -4 0 2 2 53.61 15.42 1.7096 -2 4 2 4 54.19 2.38 1.6927 -2 3 3 4 54.25 21.27 1.6908 2 2 2 4 54.42 5.18 1.6859 -4 1 1 4 55.31 1.65 1.6611 0 5 1 4 55.61 2.39 1.6528 -1 5 1 4 56.46 28.84 1.6298 0 3 3 4 57.88 6.70 1.5931 4 0 0 2 59.87 12.44 1.5450 -2 5 1 4 60.99 1.13 1.5192 3 3 1 4 61.47 8.85 1.5084 -2 2 4 4 62.08 1.31 1.4950 4 2 0 4 62.71 4.92 1.4816 0 0 4 2 62.95 18.22 1.4765 -4 3 1 4 63.36 2.12 1.4679 1 3 3 4 64.64 1.73 1.4420 0 6 0 2 65.62 5.39 1.4226 2 1 3 4 66.28 8.74 1.4101 2 5 1 4 66.48 1.19 1.4065 1 6 0 4 66.73 1.07 1.4017 0 2 4 4 66.82 1.12 1.4001 2 4 2 4 67.08 14.13 1.3953 -4 0 4 2 67.44 9.58 1.3887 -4 3 3 4 70.01 1.63 1.3439 -4 4 2 4 70.66 6.41 1.3330 -2 5 3 4 71.72 3.05 1.3160 -1 6 2 4 72.96 7.65 1.2966 0 6 2 4 73.32 1.67 1.2912 -2 4 4 4 75.22 9.68 1.2632 4 3 1 4 77.51 1.23 1.2315 -5 3 1 4 78.66 4.81 1.2164 4 0 2 2 78.75 1.89 1.2152 -5 3 3 4 79.67 1.83 1.2035 -3 6 2 4 80.51 1.68 1.1931 3 6 0 4 81.85 1.05 1.1769 2 0 4 2 83.00 1.71 1.1635 -3 3 5 4 85.51 2.12 1.1356 2 2 4 4 87.60 4.40 1.1138 -4 3 5 4 88.19 1.36 1.1079 2 5 3 4 88.61 1.91 1.1038 -4 -6 2 4 88.79 2.55 1.1019 2 7 1 4 89.37 5.49 1.0963 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.