Bixbyite-(Mn) Cockayne E, Levin I, Wu H, Llobet A Physical Review B87 (2013) 184413 Magnetic structure of bixbyite alpha-Mn2O3: A combined DFT+U and neutron diffraction study Locality: theoretical _database_code_amcsd 0021109 CELL PARAMETERS: 9.4090 9.4090 9.4090 90.000 90.000 90.000 SPACE GROUP: Ia3 X-RAY WAVELENGTH: 1.541838 Cell Volume: 832.972 Density (g/cm3): 5.035 MAX. ABS. INTENSITY / VOLUME**2: 82.46544798 RIR: 5.333 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 18.86 1.21 4.7045 2 0 0 6 23.16 16.15 3.8412 2 1 1 24 32.98 100.00 2.7161 2 2 2 8 35.71 1.02 2.5147 3 2 1 24 38.26 17.88 2.3523 4 0 0 6 40.68 1.43 2.2177 4 1 1 24 45.20 9.21 2.0060 3 3 2 24 47.33 1.30 1.9206 4 2 2 24 49.39 6.26 1.8453 4 3 1 24 49.39 6.14 1.8453 4 1 3 24 53.33 1.73 1.7178 5 2 1 24 53.33 1.05 1.7178 5 1 2 24 55.23 36.32 1.6633 4 4 0 12 57.08 1.67 1.6136 4 3 3 24 60.67 3.15 1.5263 6 1 1 24 64.15 3.47 1.4518 5 4 1 24 64.15 2.90 1.4518 5 1 4 24 65.84 20.12 1.4185 6 2 2 24 67.52 2.75 1.3873 6 3 1 24 67.52 2.20 1.3873 6 1 3 24 69.17 3.21 1.3581 4 4 4 8 72.43 1.38 1.3048 6 4 0 12 74.04 1.91 1.2804 7 1 2 24 81.91 2.71 1.1761 8 0 0 6 83.46 1.83 1.1582 8 1 1 24 85.01 1.04 1.1410 8 0 2 12 86.55 1.13 1.1246 6 3 5 24 88.09 1.02 1.1089 8 2 2 24 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.