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 #039 at P = 2.65 GPa, T = 576 K _database_code_amcsd 0002562 CELL PARAMETERS: 6.9915 8.6849 6.5051 90.000 113.497 90.000 SPACE GROUP: A2/a X-RAY WAVELENGTH: 1.541838 Cell Volume: 362.240 Density (g/cm3): 3.594 MAX. ABS. INTENSITY / VOLUME**2: 16.04910125 RIR: 1.454 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 18.04 24.37 4.9174 0 1 1 4 20.45 1.90 4.3425 0 2 0 2 26.21 1.71 3.3996 1 1 1 4 27.78 100.00 3.2115 -2 1 1 4 27.83 3.79 3.2059 2 0 0 2 29.96 78.89 2.9829 0 0 2 2 31.80 6.83 2.8138 -2 0 2 2 34.43 65.30 2.6045 0 3 1 4 34.51 1.20 2.5989 -1 2 2 4 34.78 46.74 2.5792 2 2 0 4 38.11 4.12 2.3614 -2 2 2 4 38.22 4.07 2.3548 2 1 1 4 39.55 16.91 2.2787 1 3 1 4 40.10 10.22 2.2488 -3 1 1 4 40.65 5.31 2.2194 -2 3 1 4 41.59 3.63 2.1712 0 4 0 2 43.19 8.53 2.0946 -1 1 3 4 43.54 5.74 2.0786 1 2 2 4 44.03 10.70 2.0565 1 4 0 4 44.22 19.16 2.0483 -2 1 3 4 46.22 1.58 1.9639 -3 2 2 4 46.87 7.75 1.9384 0 1 3 4 48.73 1.39 1.8686 2 3 1 4 49.33 2.70 1.8472 2 0 2 2 50.79 7.64 1.7977 2 4 0 4 51.95 1.25 1.7600 3 1 1 4 52.10 2.32 1.7554 0 4 2 4 52.98 12.59 1.7282 -4 0 2 2 53.29 9.67 1.7190 -2 4 2 4 53.80 2.95 1.7039 -2 3 3 4 53.94 19.73 1.6998 2 2 2 4 54.03 3.84 1.6972 -4 1 1 4 55.35 1.88 1.6597 -1 5 1 4 56.11 25.93 1.6391 0 3 3 4 57.49 4.36 1.6029 4 0 0 2 59.57 13.42 1.5520 -2 5 1 4 60.64 1.30 1.5270 3 3 1 4 60.98 6.92 1.5195 -2 2 4 4 62.25 4.48 1.4914 0 0 4 2 62.53 18.74 1.4854 -4 3 1 4 62.98 1.64 1.4759 1 3 3 4 64.36 2.61 1.4475 0 6 0 2 65.21 3.93 1.4307 2 1 3 4 65.96 7.31 1.4163 2 5 1 4 66.45 1.80 1.4069 2 4 2 4 66.45 11.74 1.4069 -4 0 4 2 66.90 7.60 1.3986 -4 3 3 4 70.22 8.71 1.3404 -2 5 3 4 71.35 1.57 1.3219 -1 6 2 4 72.60 6.45 1.3023 0 6 2 4 72.78 2.24 1.2994 -2 4 4 4 74.75 8.56 1.2700 4 3 1 4 78.14 4.30 1.2232 4 0 2 2 79.19 1.64 1.2096 -3 6 2 4 81.27 1.01 1.1838 2 0 4 2 82.26 1.11 1.1720 -3 3 5 4 84.91 1.86 1.1421 2 2 4 4 86.78 3.14 1.1222 -4 3 5 4 87.64 1.58 1.1134 2 5 3 4 88.01 1.49 1.1097 -4 -6 2 4 88.33 2.40 1.1065 2 7 1 4 88.67 4.88 1.1031 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.