Brownmillerite Redhammer G J, Tippelt G, Roth G, Amthauer G American Mineralogist 89 (2004) 405-420 Structural variations in the brownmillerite series Ca2(Fe2-xAlx)O5: Single-crystal X-ray diffraction at 25 deg C and high temperature X-ray powder diffraction (25 C <= T <= 1000 C) Sample: bht130_2 Locality: synthetic _database_code_amcsd 0003441 CELL PARAMETERS: 5.3093 14.4534 5.5230 90.000 90.000 90.000 SPACE GROUP: I2mb X-RAY WAVELENGTH: 1.541838 Cell Volume: 423.821 Density (g/cm3): 3.690 MAX. ABS. INTENSITY / VOLUME**2: 23.09524448 RIR: 2.038 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 12.25 38.93 7.2267 0 2 0 2 17.19 2.51 5.1592 0 1 1 4 23.24 2.69 3.8276 1 0 1 2 24.52 13.01 3.6306 0 3 1 4 24.64 1.83 3.6133 0 4 0 2 26.35 3.42 3.3824 1 2 1 4 32.42 35.78 2.7615 0 0 2 2 33.76 45.84 2.6546 2 0 0 1 34.12 100.00 2.6275 1 4 1 4 35.04 10.91 2.5611 0 5 1 4 37.22 3.38 2.4155 1 1 2 4 41.14 7.04 2.1941 0 4 2 4 42.17 5.60 2.1429 2 3 1 4 42.24 6.45 2.1393 2 4 0 2 44.44 27.94 2.0387 1 6 1 4 47.51 47.72 1.9138 2 0 2 2 48.72 2.42 1.8690 1 5 2 4 49.25 12.10 1.8500 2 2 2 4 50.52 19.38 1.8067 0 8 0 2 51.21 1.61 1.7839 2 6 0 2 53.27 7.67 1.7197 0 3 3 4 56.03 1.45 1.6413 3 2 1 4 56.31 1.41 1.6338 1 8 1 4 58.46 2.80 1.5788 1 7 2 4 58.93 18.05 1.5673 1 4 3 4 59.53 2.46 1.5528 0 5 3 4 60.63 20.09 1.5274 3 4 1 4 61.32 6.03 1.5119 0 8 2 4 62.15 8.01 1.4936 2 8 0 2 62.68 2.33 1.4822 3 1 2 4 64.57 4.17 1.4433 2 3 3 4 66.28 5.16 1.4102 1 6 3 4 67.87 5.88 1.3809 3 6 1 4 67.88 2.44 1.3807 0 0 4 2 69.28 4.09 1.3562 0 2 4 4 69.52 3.17 1.3521 1 10 1 4 70.22 3.50 1.3404 2 5 3 4 70.81 1.58 1.3306 1 1 4 4 71.01 5.15 1.3273 4 0 0 1 71.19 1.12 1.3244 3 5 2 4 71.86 13.45 1.3137 2 8 2 4 72.39 2.29 1.3055 4 2 0 2 74.03 1.09 1.2805 0 10 2 4 78.00 1.37 1.2250 2 0 4 2 79.29 1.79 1.2083 3 7 2 4 79.70 4.73 1.2031 3 4 3 4 80.24 3.40 1.1963 4 0 2 2 83.89 3.70 1.1534 2 10 2 4 84.29 3.45 1.1489 1 12 1 4 86.28 3.23 1.1275 3 6 3 4 86.82 2.70 1.1219 1 7 4 4 89.28 1.65 1.0971 3 10 1 4 89.29 1.25 1.0971 0 8 4 4 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.