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 #018 at P = 3.56 GPa, T = 658 K _database_code_amcsd 0002541 CELL PARAMETERS: 6.9737 8.6760 6.4902 90.000 113.434 90.000 SPACE GROUP: A2/a X-RAY WAVELENGTH: 1.541838 Cell Volume: 360.293 Density (g/cm3): 3.613 MAX. ABS. INTENSITY / VOLUME**2: 13.68958995 RIR: 1.234 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 18.07 25.97 4.9097 0 1 1 4 20.47 1.23 4.3380 0 2 0 2 26.25 1.40 3.3945 1 1 1 4 27.85 100.00 3.2036 -2 1 1 4 30.01 93.09 2.9774 0 0 2 2 31.89 8.09 2.8060 -2 0 2 2 34.48 83.49 2.6014 0 3 1 4 34.58 1.69 2.5940 -1 2 2 4 34.84 54.04 2.5748 2 2 0 4 38.20 4.19 2.3561 -2 2 2 4 38.29 5.68 2.3509 2 1 1 4 39.60 25.01 2.2759 1 3 1 4 40.20 13.89 2.2434 -3 1 1 4 40.72 6.83 2.2156 -2 3 1 4 41.64 5.48 2.1690 0 4 0 2 43.29 10.14 2.0902 -1 1 3 4 43.61 6.13 2.0756 1 2 2 4 44.08 9.50 2.0542 1 4 0 4 44.33 24.47 2.0432 -2 1 3 4 46.96 9.37 1.9350 0 1 3 4 48.81 2.17 1.8659 2 3 1 4 49.42 3.77 1.8443 2 0 2 2 50.66 1.01 1.8018 -1 4 2 4 50.86 9.53 1.7953 2 4 0 4 52.05 1.89 1.7570 3 1 1 4 52.17 3.28 1.7531 0 4 2 4 53.14 14.19 1.7236 -4 0 2 2 53.39 13.55 1.7161 -2 4 2 4 53.92 2.46 1.7005 -2 3 3 4 54.03 21.26 1.6972 2 2 2 4 54.17 5.19 1.6932 -4 1 1 4 55.42 2.20 1.6578 -1 5 1 4 56.21 29.19 1.6366 0 3 3 4 57.62 7.09 1.5996 4 0 0 2 59.66 16.66 1.5499 -2 5 1 4 61.13 8.08 1.5161 -2 2 4 4 61.82 1.06 1.5008 4 2 0 4 62.37 5.38 1.4887 0 0 4 2 62.67 19.55 1.4824 -4 3 1 4 63.08 2.01 1.4737 1 3 3 4 64.44 2.21 1.4460 0 6 0 2 65.32 5.44 1.4285 2 1 3 4 66.05 9.86 1.4145 2 5 1 4 66.55 1.74 1.4050 2 4 2 4 66.66 14.39 1.4030 -4 0 4 2 67.08 9.14 1.3953 -4 3 3 4 69.68 1.08 1.3494 -4 4 2 4 70.35 9.09 1.3382 -2 5 3 4 71.46 2.04 1.3202 -1 6 2 4 72.70 7.25 1.3007 0 6 2 4 72.94 2.53 1.2970 -2 4 4 4 74.90 9.42 1.2679 4 3 1 4 78.29 4.47 1.2211 4 0 2 2 78.31 1.65 1.2209 -5 3 3 4 79.34 1.42 1.2077 -3 6 2 4 81.43 1.27 1.1819 2 0 4 2 82.49 1.30 1.1694 -3 3 5 4 85.07 2.53 1.1403 2 2 4 4 87.04 3.83 1.1195 -4 3 5 4 87.79 1.80 1.1119 2 5 3 4 88.20 1.97 1.1078 -4 -6 2 4 88.45 2.58 1.1052 2 7 1 4 88.86 5.49 1.1012 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.