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 #022 at P = 4.11 GPa, T = 525 K _database_code_amcsd 0002545 CELL PARAMETERS: 6.9540 8.6603 6.4674 90.000 113.348 90.000 SPACE GROUP: A2/a X-RAY WAVELENGTH: 1.541838 Cell Volume: 357.597 Density (g/cm3): 3.641 MAX. ABS. INTENSITY / VOLUME**2: 13.74303099 RIR: 1.229 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 18.11 24.97 4.8973 0 1 1 4 20.51 1.45 4.3302 0 2 0 2 26.31 2.28 3.3877 1 1 1 4 27.93 100.00 3.1942 -2 1 1 4 27.95 1.03 3.1923 2 0 0 2 30.10 89.31 2.9689 0 0 2 2 32.01 8.15 2.7957 -2 0 2 2 34.55 88.90 2.5962 0 3 1 4 34.68 1.16 2.5863 -1 2 2 4 34.92 49.53 2.5695 2 2 0 4 38.32 3.94 2.3487 -2 2 2 4 38.36 5.61 2.3464 2 1 1 4 39.68 29.14 2.2715 1 3 1 4 40.31 12.68 2.2374 -3 1 1 4 40.82 7.66 2.2104 -2 3 1 4 41.72 5.79 2.1651 0 4 0 2 43.44 9.74 2.0833 -1 1 3 4 43.71 7.68 2.0711 1 2 2 4 44.17 8.36 2.0504 1 4 0 4 44.50 24.10 2.0358 -2 1 3 4 47.10 9.11 1.9295 0 1 3 4 47.61 1.31 1.9100 3 2 0 4 48.90 1.88 1.8624 2 3 1 4 49.53 3.73 1.8405 2 0 2 2 50.52 1.42 1.8065 -3 3 1 4 50.97 8.16 1.7918 2 4 0 4 52.16 1.65 1.7536 3 1 1 4 52.30 3.84 1.7493 0 4 2 4 53.32 15.16 1.7183 -4 0 2 2 53.53 13.44 1.7118 -2 4 2 4 54.10 2.32 1.6953 -2 3 3 4 54.15 21.43 1.6938 2 2 2 4 54.32 5.31 1.6889 -4 1 1 4 55.24 1.46 1.6628 0 5 1 4 55.54 2.88 1.6545 -1 5 1 4 56.36 29.58 1.6324 0 3 3 4 57.76 6.96 1.5961 4 0 0 2 59.79 14.05 1.5467 -2 5 1 4 60.88 1.03 1.5217 3 3 1 4 61.05 1.10 1.5177 3 4 0 4 61.36 8.61 1.5110 -2 2 4 4 61.96 1.14 1.4976 4 2 0 4 62.57 4.90 1.4845 0 0 4 2 62.84 18.73 1.4789 -4 3 1 4 63.24 2.41 1.4704 1 3 3 4 64.57 1.92 1.4434 0 6 0 2 65.48 5.22 1.4254 2 1 3 4 66.19 8.74 1.4119 2 5 1 4 66.40 1.21 1.4079 1 6 0 4 66.70 1.31 1.4023 2 4 2 4 66.94 14.23 1.3978 -4 0 4 2 67.32 9.08 1.3909 -4 3 3 4 69.89 1.55 1.3459 -4 4 2 4 70.56 7.14 1.3348 -2 5 3 4 71.63 3.19 1.3174 -1 6 2 4 72.87 7.13 1.2981 0 6 2 4 73.19 1.87 1.2932 -2 4 4 4 75.07 9.63 1.2654 4 3 1 4 77.35 1.22 1.2336 -5 3 1 4 78.48 4.64 1.2188 4 0 2 2 78.60 1.93 1.2172 -5 3 3 4 79.56 1.91 1.2049 -3 6 2 4 80.39 1.50 1.1946 3 6 0 4 81.65 1.17 1.1792 2 0 4 2 82.83 1.58 1.1654 -3 3 5 4 85.31 2.27 1.1377 2 2 4 4 87.42 4.11 1.1157 -4 3 5 4 88.02 1.45 1.1096 2 5 3 4 88.46 1.87 1.1052 -4 -6 2 4 88.66 2.47 1.1032 2 7 1 4 89.17 5.52 1.0983 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.