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 #043 at P = 2.16 GPa, T = 399 K _database_code_amcsd 0002566 CELL PARAMETERS: 6.9990 8.6860 6.5073 90.000 113.521 90.000 SPACE GROUP: P2_1/a X-RAY WAVELENGTH: 1.541838 Cell Volume: 362.731 Density (g/cm3): 3.589 MAX. ABS. INTENSITY / VOLUME**2: 14.94312531 RIR: 1.356 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 17.18 1.74 5.1615 1 1 0 4 18.04 25.49 4.9181 0 1 1 4 20.45 2.15 4.3430 0 2 0 2 25.91 1.57 3.4392 -1 2 1 4 26.21 1.42 3.4007 1 1 1 4 27.75 100.00 3.2145 -2 1 1 4 27.80 4.06 3.2087 2 0 0 2 29.95 79.55 2.9833 0 0 2 2 31.78 8.53 2.8160 -2 0 2 2 33.10 2.89 2.7062 -2 2 1 4 33.45 3.52 2.6788 -2 1 2 4 34.43 67.05 2.6048 0 3 1 4 34.50 1.83 2.5997 -1 2 2 4 34.76 51.00 2.5808 2 2 0 4 38.09 3.25 2.3628 -2 2 2 4 38.20 4.83 2.3560 2 1 1 4 39.54 17.38 2.2792 1 3 1 4 40.05 11.74 2.2511 -3 1 1 4 40.63 5.93 2.2205 -2 3 1 4 41.59 2.25 2.1715 0 4 0 2 43.18 9.78 2.0952 -1 1 3 4 43.53 6.01 2.0791 1 2 2 4 44.02 11.24 2.0569 1 4 0 4 44.10 1.70 2.0537 -3 2 1 4 44.20 15.99 2.0493 -2 1 3 4 46.18 1.11 1.9656 -3 2 2 4 46.86 6.35 1.9387 0 1 3 4 47.96 3.35 1.8970 -2 2 3 4 48.71 1.09 1.8693 2 3 1 4 49.32 2.71 1.8479 2 0 2 2 49.56 1.81 1.8393 -2 4 1 4 50.77 8.27 1.7984 2 4 0 4 51.92 1.02 1.7611 3 1 1 4 52.09 1.68 1.7557 0 4 2 4 52.85 2.47 1.7324 -4 0 1 2 52.90 1.50 1.7307 -1 3 3 4 52.92 8.58 1.7301 -4 0 2 2 53.27 9.42 1.7196 -2 4 2 4 53.78 3.60 1.7046 -2 3 3 4 53.92 20.97 1.7003 2 2 2 4 53.97 2.32 1.6989 -4 1 1 4 54.05 1.30 1.6967 -4 1 2 4 55.34 1.85 1.6600 -1 5 1 4 56.10 25.69 1.6394 0 3 3 4 57.25 1.03 1.6091 -4 2 1 4 57.44 3.06 1.6044 4 0 0 2 57.65 2.44 1.5989 -4 0 3 2 57.80 3.78 1.5951 -2 1 4 4 58.50 1.15 1.5777 4 1 0 4 59.55 12.45 1.5525 -2 5 1 4 60.78 1.01 1.5239 3 4 0 4 60.95 5.14 1.5200 -2 2 4 4 62.24 4.29 1.4917 0 0 4 2 62.47 14.97 1.4866 -4 3 1 4 62.54 3.48 1.4851 -4 3 2 4 62.85 1.61 1.4785 -2 5 2 4 62.97 1.20 1.4762 1 3 3 4 64.35 2.68 1.4477 0 6 0 2 65.19 4.95 1.4311 2 1 3 4 65.94 7.71 1.4167 2 5 1 4 66.39 8.21 1.4080 -4 0 4 2 66.43 2.41 1.4073 2 4 2 4 66.65 1.58 1.4033 4 3 0 4 66.84 4.60 1.3997 -4 3 3 4 67.38 1.22 1.3899 -4 1 4 4 70.19 7.49 1.3408 -2 5 3 4 71.34 1.43 1.3221 -1 6 2 4 72.59 6.51 1.3024 0 6 2 4 72.75 2.00 1.2998 -2 4 4 4 73.56 1.04 1.2875 -4 4 3 4 74.70 7.20 1.2708 4 3 1 4 75.01 2.07 1.2662 -4 3 4 4 76.43 1.10 1.2462 -2 2 5 4 78.09 3.78 1.2239 4 0 2 2 78.52 1.42 1.2182 -4 0 5 2 84.89 2.17 1.1423 2 2 4 4 86.72 1.47 1.1229 -4 3 5 4 87.62 1.68 1.1136 2 5 3 4 87.95 1.13 1.1103 -4 -6 2 4 88.30 2.48 1.1068 2 7 1 4 88.65 4.45 1.1033 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.