Baddeleyite Swamy V, Dubrovinsky L S, Dubrovinskaia N A, Langenhorst F, Simionovici A S, Drakopoulos M, Dmitriev V, Weber H P Solid State Communications 134 (2005) 541-546 Size effects on the structure and phase transition behavior of baddeleyite TiO2 Locality: synthetic _database_code_amcsd 0015497 CELL PARAMETERS: 4.5890 4.8490 4.7360 90.000 98.600 90.000 SPACE GROUP: P2_1/c X-RAY WAVELENGTH: 1.541838 Cell Volume: 104.201 Density (g/cm3): 5.090 MAX. ABS. INTENSITY / VOLUME**2: 22.13352272 RIR: 1.416 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 19.56 37.25 4.5374 1 0 0 2 26.46 23.06 3.3684 0 1 1 4 26.91 10.76 3.3131 1 1 0 4 31.32 93.42 2.8556 -1 1 1 4 34.84 100.00 2.5753 1 1 1 4 37.08 8.32 2.4245 0 2 0 2 38.45 41.19 2.3414 0 0 2 2 39.73 3.37 2.2687 2 0 0 2 41.96 4.15 2.1530 0 2 1 4 42.26 1.18 2.1384 1 2 0 4 42.89 1.51 2.1084 0 1 2 4 44.07 3.81 2.0549 2 1 0 4 44.90 2.04 2.0188 -1 1 2 4 45.37 18.11 1.9991 -1 2 1 4 45.75 37.35 1.9831 -2 1 1 4 46.21 5.52 1.9644 1 0 2 2 48.00 7.52 1.8953 1 2 1 4 50.10 19.74 1.8207 1 1 2 4 50.89 15.92 1.7944 2 1 1 4 51.74 2.73 1.7667 -2 0 2 2 54.48 25.98 1.6842 0 2 2 4 55.35 2.80 1.6599 -2 1 2 4 55.47 20.93 1.6566 2 2 0 4 56.17 25.32 1.6375 -1 2 2 4 56.90 9.55 1.6183 -2 2 1 4 60.84 13.95 1.5226 1 3 0 4 60.97 7.15 1.5197 2 0 2 2 61.29 9.40 1.5125 3 0 0 2 61.37 5.76 1.5107 2 2 1 4 62.51 6.50 1.4858 0 1 3 4 63.00 6.62 1.4755 -1 1 3 4 63.27 8.64 1.4698 -1 3 1 4 64.80 2.27 1.4388 -3 1 1 4 65.40 7.42 1.4271 1 3 1 4 68.66 11.91 1.3670 -3 0 2 2 69.29 7.49 1.3561 1 1 3 4 70.67 10.98 1.3330 -2 1 3 4 71.01 6.05 1.3274 3 1 1 4 71.69 4.67 1.3164 2 3 0 4 71.74 1.24 1.3157 -3 1 2 4 72.31 2.92 1.3068 -1 3 2 4 72.40 4.67 1.3053 -1 2 3 4 72.94 2.45 1.2969 -2 3 1 4 73.55 6.14 1.2876 2 2 2 4 73.85 5.40 1.2832 3 2 0 4 74.09 1.69 1.2797 -3 2 1 4 76.29 3.08 1.2481 1 3 2 4 80.55 2.18 1.1925 -2 3 2 4 80.61 1.28 1.1918 3 0 2 2 80.69 2.76 1.1908 -3 2 2 4 81.84 2.87 1.1769 -1 0 4 2 82.13 6.94 1.1736 0 4 1 4 82.33 1.90 1.1712 1 4 0 4 82.37 3.51 1.1707 0 0 4 2 87.80 3.65 1.1118 -4 1 1 4 88.53 2.80 1.1045 4 1 0 4 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.