Baddeleyite Kudoh Y, Takeda H, Arashi H Physics and Chemistry of Minerals 13 (1986) 233-237 In situ determination of crystal structure for high pressure phase of ZrO2 using a diamond anvil and single crystal X-ray diffraction method Sample: P = 51 kbar, post baddeleyite structure _database_code_amcsd 0007417 CELL PARAMETERS: 4.9920 5.2290 5.0460 90.000 90.000 90.000 SPACE GROUP: Pbcm X-RAY WAVELENGTH: 1.541838 Cell Volume: 131.717 Density (g/cm3): 6.213 MAX. ABS. INTENSITY / VOLUME**2: 173.3040350 RIR: 9.083 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 17.77 2.17 4.9920 1 0 0 2 24.66 4.59 3.6108 1 1 0 4 30.44 100.00 2.9364 1 1 1 8 34.30 11.05 2.6145 0 2 0 2 35.58 13.25 2.5230 0 0 2 2 35.98 8.93 2.4960 2 0 0 2 38.79 2.17 2.3214 0 2 1 4 42.97 1.22 2.1049 1 2 1 8 43.77 2.72 2.0681 1 1 2 8 44.02 4.02 2.0569 2 1 1 8 50.25 15.64 1.8155 0 2 2 4 50.56 13.95 1.8054 2 2 0 4 51.50 14.97 1.7744 2 0 2 4 53.72 1.57 1.7062 1 2 2 8 53.94 4.64 1.6999 2 2 1 8 55.87 4.28 1.6456 1 3 0 4 59.04 11.33 1.5645 1 3 1 8 60.75 14.52 1.5247 1 1 3 8 61.28 13.78 1.5127 3 1 1 8 63.35 7.33 1.4682 2 2 2 8 66.05 1.33 1.4146 0 2 3 4 66.62 1.04 1.4038 3 2 0 4 67.42 1.16 1.3891 3 0 2 4 68.02 3.01 1.3783 1 3 2 8 75.06 2.06 1.2655 0 4 1 4 75.34 1.86 1.2615 0 0 4 2 76.30 1.47 1.2480 4 0 0 2 81.90 3.56 1.1763 1 3 3 8 82.37 2.69 1.1707 3 3 1 8 83.47 1.07 1.1580 2 4 0 4 83.85 4.04 1.1538 3 1 3 8 85.46 1.62 1.1362 0 2 4 4 86.16 2.63 1.1287 2 4 1 8 86.39 1.40 1.1263 4 2 0 4 86.43 2.24 1.1259 2 0 4 4 87.13 1.65 1.1186 4 0 2 4 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.