Baddeleyite Diffraction data computed using the structure from the paper listed below, along with the cell parameters refined from the powder pattern for R060016 McCullough J D, Trueblood K N Acta Crystallographica 12 (1959) 507-511 The crystal structure of baddeleyite (monoclinic ZrO2) CELL PARAMETERS: 5.169000 5.232000 5.341000 90.00000 99.25000 90.00000 SPACE GROUP: P2_1/c X-RAY WAVELENGTH: 1.541838 2-THETA INTENSITY D-SPACING H K L 17.49 5.95 5.0783 1 0 0 24.09 16.08 3.6961 0 1 1 24.49 11.54 3.6368 1 1 0 28.22 100.00 3.1634 -1 1 1 31.52 67.78 2.8396 1 1 1 34.21 20.60 2.6218 0 0 2 34.43 13.60 2.6054 0 2 0 35.36 15.40 2.5391 2 0 0 35.95 3.28 2.4987 -1 0 2 38.59 5.80 2.3333 0 2 1 40.78 13.46 2.2129 -2 1 1 41.21 4.71 2.1908 1 0 2 41.42 4.89 2.1800 -1 2 1 44.88 6.47 2.0196 1 1 2 45.57 6.76 1.9905 -2 0 2 48.98 1.87 1.8594 -2 1 2 49.30 18.25 1.8481 0 2 2 50.16 21.52 1.8184 2 2 0 50.61 11.76 1.8034 -1 2 2 51.24 5.66 1.7826 -2 2 1 54.16 11.06 1.6933 2 0 2 54.17 1.47 1.6928 3 0 0 55.33 4.07 1.6600 2 2 1 55.44 9.01 1.6571 0 1 3 55.65 6.34 1.6511 -1 1 3 55.94 8.16 1.6435 1 3 0 57.23 8.00 1.6095 -3 1 1 57.91 5.15 1.5920 -1 3 1 58.32 3.32 1.5817 -2 2 2 59.83 8.70 1.5455 1 3 1 60.10 6.96 1.5390 -3 0 2 61.42 6.06 1.5091 1 1 3 62.03 6.82 1.4957 -2 1 3 62.90 10.37 1.4771 3 1 1 64.14 1.35 1.4515 0 2 3 64.34 1.63 1.4475 -1 2 3 65.42 2.37 1.4262 -1 3 2 65.75 4.91 1.4198 2 2 2 65.77 1.95 1.4195 3 2 0 65.96 1.04 1.4159 -2 3 1 68.97 2.64 1.3611 1 3 2 71.12 2.33 1.3251 -3 2 2 71.34 3.96 1.3216 -1 0 4 72.15 1.45 1.3087 -2 3 2 72.53 1.02 1.3027 0 4 0 74.74 1.89 1.2696 4 0 0 75.11 4.41 1.2643 0 4 1 76.50 2.61 1.2447 -4 1 1 78.94 1.19 1.2123 3 3 0 78.95 1.08 1.2121 -3 3 1 81.65 2.02 1.1786 -1 2 4 82.61 1.80 1.1675 1 3 3 83.15 2.24 1.1612 -2 3 3 83.92 1.44 1.1524 3 3 1 84.18 1.65 1.1496 -2 4 1 84.93 1.70 1.1413 4 2 0 86.20 1.64 1.1277 -3 0 4 87.46 2.41 1.1147 2 4 1 88.24 2.11 1.1069 1 2 4 88.60 2.97 1.1033 3 1 3 89.41 1.10 1.0954 2 0 4 89.86 3.09 1.0911 -4 1 3 89.86 3.09 1.0911 -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.