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 #015 at P = 3.13 GPa, T = 448 K _database_code_amcsd 0002538 CELL PARAMETERS: 6.9736 8.6716 6.4889 90.000 113.487 90.000 SPACE GROUP: A2/a X-RAY WAVELENGTH: 1.541838 Cell Volume: 359.889 Density (g/cm3): 3.617 MAX. ABS. INTENSITY / VOLUME**2: 13.77782823 RIR: 1.240 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 18.08 26.27 4.9069 0 1 1 4 20.48 2.32 4.3358 0 2 0 2 26.27 1.82 3.3919 1 1 1 4 27.85 100.00 3.2036 -2 1 1 4 30.03 90.80 2.9756 0 0 2 2 31.89 8.10 2.8065 -2 0 2 2 34.49 84.88 2.6001 0 3 1 4 34.59 1.11 2.5933 -1 2 2 4 34.86 47.45 2.5736 2 2 0 4 38.20 3.50 2.3560 -2 2 2 4 38.31 6.02 2.3492 2 1 1 4 39.63 28.37 2.2744 1 3 1 4 40.20 12.39 2.2432 -3 1 1 4 40.74 8.22 2.2150 -2 3 1 4 41.66 5.34 2.1679 0 4 0 2 43.30 9.56 2.0896 -1 1 3 4 43.64 7.70 2.0741 1 2 2 4 44.11 7.79 2.0532 1 4 0 4 44.33 24.66 2.0432 -2 1 3 4 46.99 9.02 1.9338 0 1 3 4 48.84 2.39 1.8647 2 3 1 4 49.46 3.80 1.8428 2 0 2 2 50.41 1.73 1.8104 -3 3 1 4 50.89 9.26 1.7944 2 4 0 4 52.09 1.90 1.7558 3 1 1 4 52.20 3.45 1.7522 0 4 2 4 53.04 1.16 1.7267 -1 3 3 4 53.13 15.11 1.7238 -4 0 2 2 53.40 12.88 1.7157 -2 4 2 4 53.93 2.51 1.7002 -2 3 3 4 54.07 19.23 1.6959 2 2 2 4 54.18 5.22 1.6930 -4 1 1 4 55.16 1.62 1.6651 0 5 1 4 55.45 2.90 1.6570 -1 5 1 4 56.24 29.62 1.6356 0 3 3 4 57.65 7.75 1.5990 4 0 0 2 59.68 14.34 1.5493 -2 5 1 4 60.95 1.30 1.5201 3 4 0 4 61.14 8.12 1.5158 -2 2 4 4 61.84 1.15 1.5002 4 2 0 4 62.42 5.34 1.4878 0 0 4 2 62.69 18.76 1.4820 -4 3 1 4 63.13 2.38 1.4727 1 3 3 4 64.47 2.30 1.4453 0 6 0 2 65.38 5.51 1.4274 2 1 3 4 66.09 8.40 1.4137 2 5 1 4 66.30 1.29 1.4097 1 6 0 4 66.61 1.73 1.4041 2 4 2 4 66.65 14.28 1.4033 -4 0 4 2 67.08 8.90 1.3953 -4 3 3 4 69.69 1.35 1.3492 -4 4 2 4 70.37 7.31 1.3378 -2 5 3 4 71.49 3.25 1.3196 -1 6 2 4 72.74 7.33 1.3000 0 6 2 4 72.96 2.20 1.2966 -2 4 4 4 74.95 9.58 1.2671 4 3 1 4 77.16 1.13 1.2362 -5 3 1 4 78.31 1.90 1.2209 -5 3 3 4 78.36 4.23 1.2202 4 0 2 2 79.37 1.94 1.2073 -3 6 2 4 80.25 1.47 1.1963 3 6 0 4 81.51 1.27 1.1809 2 0 4 2 82.50 1.53 1.1693 -3 3 5 4 85.16 2.43 1.1394 2 2 4 4 87.04 3.98 1.1195 -4 3 5 4 87.87 1.30 1.1111 2 5 3 4 88.23 1.96 1.1075 -4 -6 2 4 88.52 2.45 1.1046 2 7 1 4 88.93 5.56 1.1006 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.