Baddeleyite Diffraction data computed using the structure from the paper listed below, along with the cell parameters refined from the powder pattern for R060078 Smith D K, Newkirk H W Acta Crystallographica 18 (1965) 983-991 The crystal structure of baddeleyite (monoclinic ZrO2) and its relation to the polymorphism of ZrO2 CELL PARAMETERS: 5.145000 5.207500 5.310700 90.00000 99.23000 90.00000 SPACE GROUP: P2_1/c X-RAY WAVELENGTH: 1.541838 2-THETA INTENSITY D-SPACING H K L 17.52 5.72 5.0807 1 0 0 24.13 16.60 3.6978 0 1 1 24.53 11.53 3.6385 1 1 0 28.26 100.00 3.1646 -1 1 1 31.54 70.83 2.8411 1 1 1 34.23 21.62 2.6231 0 0 2 34.46 13.14 2.6065 0 2 0 35.38 16.44 2.5403 2 0 0 35.98 3.26 2.4997 -1 0 2 38.62 6.27 2.3343 0 2 1 39.51 1.10 2.2836 2 1 0 40.81 14.43 2.2137 -2 1 1 41.23 5.28 2.1921 1 0 2 41.45 5.40 2.1809 -1 2 1 44.90 7.72 2.0207 1 1 2 45.60 6.80 1.9911 -2 0 2 49.01 2.29 1.8601 -2 1 2 49.32 19.37 1.8489 0 2 2 50.18 23.51 1.8192 2 2 0 50.63 13.67 1.8041 -1 2 2 51.26 6.46 1.7833 -2 2 1 54.16 12.05 1.6943 2 0 2 54.19 1.77 1.6936 3 0 0 55.34 4.68 1.6609 2 2 1 55.45 10.27 1.6579 0 1 3 55.67 6.89 1.6518 -1 1 3 55.95 9.48 1.6442 1 3 0 57.24 9.09 1.6101 -3 1 1 57.93 5.83 1.5927 -1 3 1 58.34 3.86 1.5823 -2 2 2 59.84 9.79 1.5462 1 3 1 60.12 8.01 1.5396 -3 0 2 61.43 6.64 1.5100 1 1 3 62.05 8.01 1.4963 -2 1 3 62.91 12.01 1.4779 3 1 1 64.15 1.49 1.4522 0 2 3 64.33 1.03 1.4486 0 3 2 64.35 2.09 1.4481 -1 2 3 65.05 1.01 1.4342 2 3 0 65.43 2.82 1.4268 -1 3 2 65.75 5.68 1.4206 2 2 2 65.78 2.10 1.4201 3 2 0 65.97 1.18 1.4164 -2 3 1 68.98 2.95 1.3617 1 3 2 69.68 1.03 1.3497 1 2 3 71.13 2.73 1.3256 -3 2 2 71.35 4.80 1.3222 -1 0 4 72.01 1.06 1.3115 0 0 4 72.16 1.67 1.3092 -2 3 2 72.54 1.22 1.3033 0 4 0 72.69 1.17 1.3009 2 1 3 74.75 2.14 1.2702 4 0 0 75.12 5.76 1.2648 0 4 1 76.51 3.18 1.2452 -4 1 1 78.13 1.03 1.2234 1 0 4 78.94 1.48 1.2128 3 3 0 78.96 1.17 1.2126 -3 3 1 81.65 2.48 1.1792 -1 2 4 82.60 2.38 1.1680 1 3 3 83.15 2.84 1.1617 -2 3 3 83.92 1.70 1.1530 3 3 1 83.98 1.07 1.1523 -3 3 2 84.18 1.99 1.1501 -2 4 1 84.93 2.35 1.1418 4 2 0 86.21 2.23 1.1281 -3 0 4 87.45 3.22 1.1152 2 4 1 88.22 2.92 1.1075 1 2 4 88.58 3.90 1.1039 3 1 3 89.38 1.52 1.0960 2 0 4 89.86 4.02 1.0914 -4 1 3 89.86 4.02 1.0914 -4 1 3 XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.