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 #030 at P = 4.75 GPa, T = 469 K _database_code_amcsd 0002553 CELL PARAMETERS: 6.9395 8.6529 6.4550 90.000 113.338 90.000 SPACE GROUP: A2/a X-RAY WAVELENGTH: 1.541838 Cell Volume: 355.890 Density (g/cm3): 3.658 MAX. ABS. INTENSITY / VOLUME**2: 14.27087038 RIR: 1.270 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 18.14 23.02 4.8898 0 1 1 4 20.53 1.30 4.3264 0 2 0 2 26.35 2.23 3.3819 1 1 1 4 27.99 100.00 3.1881 -2 1 1 4 28.01 1.44 3.1859 2 0 0 2 30.16 81.91 2.9634 0 0 2 2 32.08 7.88 2.7899 -2 0 2 2 34.59 90.88 2.5935 0 3 1 4 34.98 46.56 2.5654 2 2 0 4 38.39 3.71 2.3447 -2 2 2 4 38.44 5.73 2.3421 2 1 1 4 39.73 29.74 2.2687 1 3 1 4 40.39 12.27 2.2329 -3 1 1 4 40.88 7.52 2.2074 -2 3 1 4 41.76 4.56 2.1632 0 4 0 2 43.52 9.89 2.0795 -1 1 3 4 43.78 7.29 2.0678 1 2 2 4 44.22 7.48 2.0484 1 4 0 4 44.59 22.23 2.0319 -2 1 3 4 47.19 8.30 1.9261 0 1 3 4 47.70 1.51 1.9066 3 2 0 4 48.98 1.49 1.8597 2 3 1 4 49.62 3.81 1.8371 2 0 2 2 50.61 1.22 1.8036 -3 3 1 4 51.03 8.12 1.7897 2 4 0 4 52.27 1.32 1.7502 3 1 1 4 52.36 3.32 1.7472 0 4 2 4 53.26 1.10 1.7198 -1 3 3 4 53.44 14.88 1.7147 -4 0 2 2 53.61 15.23 1.7095 -2 4 2 4 54.19 2.33 1.6926 -2 3 3 4 54.25 20.45 1.6909 2 2 2 4 54.44 4.91 1.6855 -4 1 1 4 55.30 1.64 1.6612 0 5 1 4 55.60 2.34 1.6529 -1 5 1 4 56.46 28.22 1.6299 0 3 3 4 57.89 6.36 1.5929 4 0 0 2 59.86 12.20 1.5450 -2 5 1 4 60.99 1.21 1.5192 3 3 1 4 61.15 1.02 1.5155 3 4 0 4 61.48 8.56 1.5083 -2 2 4 4 62.09 1.26 1.4948 4 2 0 4 62.70 4.83 1.4817 0 0 4 2 62.96 17.86 1.4763 -4 3 1 4 63.35 2.06 1.4681 1 3 3 4 64.63 1.75 1.4421 0 6 0 2 65.62 5.27 1.4228 2 1 3 4 66.28 8.25 1.4102 2 5 1 4 66.47 1.18 1.4066 1 6 0 4 66.73 1.07 1.4018 0 2 4 4 66.81 1.31 1.4003 2 4 2 4 67.10 13.69 1.3950 -4 0 4 2 67.46 9.05 1.3884 -4 3 3 4 70.02 1.34 1.3437 -4 4 2 4 70.66 6.41 1.3330 -2 5 3 4 71.72 3.07 1.3161 -1 6 2 4 72.95 7.36 1.2967 0 6 2 4 73.32 1.80 1.2911 -2 4 4 4 75.22 9.39 1.2632 4 3 1 4 77.52 1.22 1.2313 -5 3 1 4 78.66 4.70 1.2164 4 0 2 2 78.77 1.79 1.2149 -5 3 3 4 79.67 1.89 1.2034 -3 6 2 4 80.50 1.64 1.1931 3 6 0 4 81.84 1.01 1.1770 2 0 4 2 83.01 1.71 1.1634 -3 3 5 4 85.50 2.00 1.1357 2 2 4 4 87.62 4.19 1.1136 -4 3 5 4 88.18 1.30 1.1080 2 5 3 4 88.61 1.83 1.1037 -4 -6 2 4 88.78 2.73 1.1020 2 7 1 4 89.36 5.32 1.0964 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.