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 #020 at P = 4.29 GPa, T = 618 K _database_code_amcsd 0002543 CELL PARAMETERS: 6.9560 8.6644 6.4713 90.000 113.358 90.000 SPACE GROUP: A2/a X-RAY WAVELENGTH: 1.541838 Cell Volume: 358.058 Density (g/cm3): 3.636 MAX. ABS. INTENSITY / VOLUME**2: 13.45574234 RIR: 1.205 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 18.10 25.70 4.8998 0 1 1 4 20.50 1.01 4.3322 0 2 0 2 26.30 1.89 3.3888 1 1 1 4 27.92 100.00 3.1954 -2 1 1 4 30.08 89.44 2.9705 0 0 2 2 32.00 8.33 2.7971 -2 0 2 2 34.53 90.80 2.5975 0 3 1 4 34.66 1.46 2.5877 -1 2 2 4 34.91 53.16 2.5703 2 2 0 4 38.30 4.31 2.3499 -2 2 2 4 38.35 5.74 2.3470 2 1 1 4 39.66 28.85 2.2725 1 3 1 4 40.30 13.55 2.2380 -3 1 1 4 40.81 7.25 2.2113 -2 3 1 4 41.70 6.19 2.1661 0 4 0 2 43.41 10.48 2.0845 -1 1 3 4 43.69 6.77 2.0720 1 2 2 4 44.15 8.90 2.0513 1 4 0 4 44.48 24.14 2.0370 -2 1 3 4 47.07 9.38 1.9305 0 1 3 4 47.60 1.12 1.9105 3 2 0 4 48.89 1.97 1.8630 2 3 1 4 49.51 4.02 1.8411 2 0 2 2 50.50 1.17 1.8071 -3 3 1 4 50.94 8.68 1.7925 2 4 0 4 52.15 1.70 1.7540 3 1 1 4 52.27 3.73 1.7502 0 4 2 4 53.30 15.41 1.7189 -4 0 2 2 53.51 14.04 1.7126 -2 4 2 4 54.06 2.18 1.6962 -2 3 3 4 54.13 22.27 1.6944 2 2 2 4 54.30 5.46 1.6893 -4 1 1 4 55.52 2.51 1.6553 -1 5 1 4 56.33 30.15 1.6333 0 3 3 4 57.75 7.30 1.5965 4 0 0 2 59.76 15.77 1.5474 -2 5 1 4 61.32 9.30 1.5119 -2 2 4 4 61.95 1.13 1.4980 4 2 0 4 62.54 5.11 1.4852 0 0 4 2 62.82 19.03 1.4793 -4 3 1 4 63.21 2.08 1.4711 1 3 3 4 64.53 1.87 1.4441 0 6 0 2 65.45 5.53 1.4259 2 1 3 4 66.16 9.77 1.4125 2 5 1 4 66.67 1.35 1.4028 2 4 2 4 66.90 14.51 1.3986 -4 0 4 2 67.28 9.29 1.3916 -4 3 3 4 69.86 1.55 1.3464 -4 4 2 4 70.52 7.98 1.3355 -2 5 3 4 71.59 2.70 1.3181 -1 6 2 4 72.82 7.31 1.2987 0 6 2 4 73.14 1.94 1.2939 -2 4 4 4 75.04 9.58 1.2658 4 3 1 4 77.33 1.08 1.2339 -5 3 1 4 78.45 4.71 1.2191 4 0 2 2 78.56 1.86 1.2177 -5 3 3 4 79.51 1.58 1.2055 -3 6 2 4 80.35 1.16 1.1950 3 6 0 4 81.61 1.16 1.1796 2 0 4 2 82.01 1.01 1.1749 -4 4 4 4 82.77 1.53 1.1661 -3 3 5 4 85.27 2.37 1.1382 2 2 4 4 87.36 4.23 1.1163 -4 3 5 4 87.97 1.74 1.1101 2 5 3 4 88.41 1.90 1.1057 -4 -6 2 4 88.61 2.51 1.1037 2 7 1 4 89.11 5.50 1.0988 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.