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 #006 at P = 1.23 GPa, T = 628 K _database_code_amcsd 0002529 CELL PARAMETERS: 7.0411 8.7106 6.5441 90.000 113.682 90.000 SPACE GROUP: P2_1/a X-RAY WAVELENGTH: 1.541838 Cell Volume: 367.565 Density (g/cm3): 3.542 MAX. ABS. INTENSITY / VOLUME**2: 15.57707237 RIR: 1.432 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 17.11 1.85 5.1826 1 1 0 4 17.97 23.55 4.9373 0 1 1 4 20.39 2.67 4.3553 0 2 0 2 25.58 1.73 3.4822 -2 0 1 2 26.11 1.12 3.4127 1 1 1 4 27.59 100.00 3.2334 -2 1 1 4 27.67 4.42 3.2241 2 0 0 2 29.82 77.43 2.9965 0 0 2 2 31.56 6.78 2.8350 -2 0 2 2 34.32 62.97 2.6130 0 3 1 4 34.33 1.27 2.6121 -1 2 2 4 34.62 49.83 2.5913 2 2 0 4 37.87 3.75 2.3760 -2 2 2 4 38.05 4.22 2.3649 2 1 1 4 39.41 17.30 2.2864 1 3 1 4 39.82 10.80 2.2639 -3 1 1 4 40.45 3.83 2.2300 -2 3 1 4 41.47 1.86 2.1776 0 4 0 2 42.02 2.04 2.1503 -3 1 2 4 42.60 1.84 2.1221 -2 0 3 2 42.94 7.56 2.1061 -1 1 3 4 43.36 1.61 2.0868 3 1 0 4 43.37 4.91 2.0864 1 2 2 4 43.88 10.49 2.0632 1 4 0 4 43.91 17.83 2.0618 -2 1 3 4 45.90 2.30 1.9771 -3 2 2 4 46.65 7.01 1.9471 0 1 3 4 46.76 1.61 1.9426 -1 2 3 4 49.12 3.00 1.8546 2 0 2 2 50.58 9.67 1.8046 2 4 0 4 51.90 1.33 1.7616 0 4 2 4 52.56 8.41 1.7411 -4 0 2 2 52.65 1.52 1.7384 -1 3 3 4 52.80 1.20 1.7338 -3 2 3 4 53.03 10.74 1.7270 -2 4 2 4 53.48 2.42 1.7133 -2 3 3 4 53.65 3.50 1.7083 -4 1 1 4 53.72 18.11 1.7064 2 2 2 4 55.15 2.00 1.6653 -1 5 1 4 55.86 25.24 1.6458 0 3 3 4 57.14 3.67 1.6120 4 0 0 2 57.79 1.55 1.5955 -3 4 1 4 59.31 11.84 1.5580 -2 5 1 4 60.36 1.33 1.5334 3 3 1 4 60.39 1.43 1.5327 -3 1 4 4 60.58 5.72 1.5284 -2 2 4 4 61.93 5.19 1.4983 0 0 4 2 62.14 16.91 1.4938 -4 3 1 4 62.71 1.41 1.4815 1 3 3 4 64.15 2.86 1.4518 0 6 0 2 64.92 4.60 1.4364 2 1 3 4 65.38 1.70 1.4274 -3 4 3 4 65.70 6.61 1.4212 2 5 1 4 65.89 8.56 1.4175 -4 0 4 2 66.19 2.87 1.4120 2 4 2 4 66.41 5.87 1.4078 -4 3 3 4 67.40 1.19 1.3895 -5 1 2 4 69.85 7.88 1.3465 -2 5 3 4 71.07 1.08 1.3265 -1 6 2 4 72.32 6.44 1.3065 0 6 2 4 72.35 2.82 1.3060 -2 4 4 4 74.35 7.14 1.2758 4 3 1 4 76.45 1.46 1.2459 -5 1 4 4 77.73 4.26 1.2286 4 0 2 2 78.78 1.51 1.2149 -3 6 2 4 84.50 1.74 1.1465 2 2 4 4 86.08 2.03 1.1296 -4 3 5 4 87.25 1.61 1.1173 2 5 3 4 87.48 1.20 1.1150 -4 -6 2 4 87.96 3.03 1.1101 2 7 1 4 88.19 4.28 1.1079 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.