Forsterite Heuer M Journal of Applied Crystallography 34 (2001) 271-279 The determination of site occupancies using a new strategy in Rietveld refinements Note: results of the conventional refinement on single-crystal data Locality: synthetic _database_code_amcsd 0020682 CELL PARAMETERS: 4.7620 10.2350 5.9980 90.000 90.000 90.000 SPACE GROUP: Pbnm X-RAY WAVELENGTH: 1.541838 Cell Volume: 292.337 Density (g/cm3): 3.361 MAX. ABS. INTENSITY / VOLUME**2: 8.483931810 RIR: 0.822 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 17.33 20.33 5.1175 0 2 0 2 22.84 52.54 3.8931 0 2 1 4 23.86 17.97 3.7295 1 0 1 4 25.42 20.89 3.5041 1 1 1 8 25.55 12.89 3.4862 1 2 0 4 29.64 5.84 3.0140 1 2 1 8 29.79 15.06 2.9990 0 0 2 2 32.28 68.53 2.7734 1 3 0 4 34.67 2.94 2.5874 0 2 2 4 35.67 76.98 2.5173 1 3 1 8 36.48 100.00 2.4631 1 1 2 8 37.78 1.56 2.3810 2 0 0 2 38.24 12.67 2.3535 0 4 1 4 38.83 9.37 2.3191 2 1 0 4 39.64 36.47 2.2735 1 2 2 8 40.00 26.14 2.2540 1 4 0 4 41.76 16.53 2.1630 2 1 1 8 44.50 4.97 2.0362 1 3 2 8 46.51 2.51 1.9525 2 3 0 4 46.66 2.52 1.9465 0 4 2 4 48.40 5.80 1.8806 1 5 0 4 48.84 1.27 1.8648 2 0 2 4 50.29 4.34 1.8143 1 1 3 8 50.89 4.00 1.7945 1 5 1 8 52.21 66.08 1.7521 2 2 2 8 52.50 19.47 1.7431 2 4 0 4 52.78 4.02 1.7344 1 2 3 8 54.85 12.96 1.6738 2 4 1 8 56.05 12.78 1.6408 0 6 1 4 56.22 2.42 1.6363 2 3 2 8 56.76 17.78 1.6218 1 3 3 8 57.88 4.99 1.5933 1 5 2 8 58.59 8.71 1.5754 0 4 3 4 58.88 3.32 1.5686 3 1 0 4 60.32 1.22 1.5345 3 0 1 4 61.06 3.32 1.5175 3 1 1 8 61.13 2.22 1.5161 3 2 0 4 61.21 3.13 1.5143 2 1 3 8 61.53 4.59 1.5070 2 4 2 8 61.73 4.64 1.5027 2 5 1 8 61.88 26.14 1.4995 0 0 4 2 62.65 36.15 1.4828 0 6 2 4 63.27 1.16 1.4698 3 2 1 8 63.41 1.26 1.4669 2 2 3 8 64.78 3.26 1.4392 3 3 0 4 64.79 1.08 1.4390 0 2 4 4 66.85 7.09 1.3995 3 3 1 8 66.95 10.55 1.3977 1 7 0 4 67.37 7.74 1.3899 3 1 2 8 69.47 16.34 1.3530 3 2 2 8 69.59 1.09 1.3510 2 6 1 8 69.71 5.70 1.3489 3 4 0 4 71.53 9.12 1.3190 1 3 4 8 71.72 3.99 1.3160 3 4 1 8 71.85 1.67 1.3139 2 4 3 8 72.89 4.29 1.2977 0 6 3 4 74.83 2.06 1.2688 2 0 4 4 75.50 1.41 1.2592 2 1 4 8 75.54 1.60 1.2586 2 6 2 8 76.27 1.93 1.2485 1 4 4 8 76.65 1.98 1.2432 3 0 3 4 77.61 1.08 1.2302 3 4 2 8 77.92 2.58 1.2261 2 5 3 8 80.72 4.47 1.1905 4 0 0 2 82.23 2.24 1.1724 1 5 4 8 82.60 3.40 1.1680 3 3 3 8 82.61 1.80 1.1679 0 2 5 4 83.02 1.09 1.1633 1 0 5 4 83.54 4.49 1.1572 3 5 2 8 84.14 2.25 1.1506 2 7 2 8 84.88 1.75 1.1424 1 8 2 8 85.02 2.59 1.1408 3 6 1 8 85.40 5.05 1.1368 2 4 4 8 86.32 2.69 1.1270 2 8 0 4 87.17 3.46 1.1182 3 4 3 8 88.88 4.26 1.1010 1 3 5 8 88.98 2.29 1.1001 4 1 2 8 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.