Ferrocolumbite Tarantino S C, Zema M American Mineralogist 90 (2005) 1291-1300 Mixing and ordering behavior in manganocolumbite-ferrocolumbite solid solution: A single-crystal X-ray diffraction study Sample: BRA n18 Qm=0.988 from S. Jose de Safira, Minas Gerais, Brazil Sample: Annealed at T = 950 C for t = 3 h Note: Occupancies calculated assuming complete Fe/Mn disorder _database_code_amcsd 0003838 CELL PARAMETERS: 14.2852 5.7361 5.0574 90.000 90.000 90.000 SPACE GROUP: Pbcn X-RAY WAVELENGTH: 1.541838 Cell Volume: 414.410 Density (g/cm3): 5.552 MAX. ABS. INTENSITY / VOLUME**2: 127.8867438 RIR: 7.500 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 12.39 4.45 7.1426 2 0 0 2 16.65 1.25 5.3230 1 1 0 4 24.28 7.49 3.6664 1 1 1 8 24.29 25.80 3.6638 3 1 0 4 24.93 3.84 3.5713 4 0 0 2 30.12 100.00 2.9670 3 1 1 8 31.19 9.48 2.8681 0 2 0 2 35.50 13.33 2.5287 0 0 2 2 36.00 14.01 2.4948 0 2 1 4 37.79 6.74 2.3809 6 0 0 2 40.39 2.76 2.2333 3 0 2 4 40.83 5.20 2.2099 3 2 1 8 43.48 7.69 2.0811 3 1 2 8 43.87 1.17 2.0637 4 0 2 4 44.29 1.14 2.0452 4 2 1 8 47.96 6.89 1.8967 0 2 2 4 49.77 6.23 1.8319 6 2 0 4 50.80 1.99 1.7972 7 1 1 8 51.50 13.09 1.7743 3 3 0 4 52.81 15.95 1.7334 6 0 2 4 53.18 20.60 1.7224 6 2 1 8 54.83 1.16 1.6743 3 3 1 8 60.45 13.42 1.5315 3 1 3 8 62.62 4.91 1.4835 6 2 2 8 63.54 10.96 1.4642 9 1 1 8 64.07 7.49 1.4533 0 2 3 4 64.12 11.98 1.4524 3 3 2 8 67.94 5.42 1.3796 0 4 1 4 72.17 1.96 1.3089 9 1 2 8 75.14 1.50 1.2644 0 0 4 2 76.85 2.02 1.2405 6 2 3 8 78.28 2.79 1.2213 9 3 0 4 80.33 1.18 1.1952 3 1 4 8 80.45 5.59 1.1937 6 4 1 8 80.72 2.15 1.1904 12 0 0 2 83.57 1.17 1.1569 0 2 4 4 85.77 3.62 1.1329 9 1 3 8 87.32 3.21 1.1167 6 0 4 4 87.45 1.44 1.1153 3 5 0 4 89.02 4.78 1.0997 9 3 2 8 89.79 2.07 1.0923 0 4 3 4 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.