Ba F7 Fe Mn Lacorre P, Pannetier J, Pebler J, Nagel J, Babel D, de Kozak A, Samouel M, Ferey G Journal of Solid State Chemistry 101 (1992) 296-308 Ordered magnetic frustration: XVII. Is Ba Mn Fe F7 frustrated? Mossbauer spectrocopy, magnetic susceptibility, and magnetic structure at 2 K _cod_database_code 1000498 _database_code_amcsd 0013757 CELL PARAMETERS: 5.5075 10.9584 9.1427 90.000 94.568 90.000 SPACE GROUP: P2_1/c X-RAY WAVELENGTH: 1.541838 Cell Volume: 550.040 Density (g/cm3): 4.601 MAX. ABS. INTENSITY / VOLUME**2: 22.83435649 RIR: 1.616 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 12.63 9.48 7.0071 0 1 1 4 16.14 1.42 5.4900 1 0 0 2 16.18 1.53 5.4792 0 2 0 2 18.07 14.17 4.9085 1 1 0 4 18.90 2.55 4.6959 0 2 1 4 19.48 5.19 4.5568 0 0 2 2 19.93 2.33 4.4560 -1 1 1 4 21.12 2.30 4.2076 0 1 2 4 21.16 11.86 4.1985 1 1 1 4 24.37 72.29 3.6522 -1 0 2 2 24.43 27.63 3.6431 -1 2 1 4 25.42 12.36 3.5035 0 2 2 4 25.46 100.00 3.4983 1 2 1 4 25.71 70.59 3.4649 -1 1 2 4 26.28 63.83 3.3906 0 3 1 4 26.39 16.50 3.3767 1 0 2 2 27.64 53.17 3.2270 1 1 2 4 29.37 35.44 3.0412 1 3 0 4 30.54 5.98 2.9275 0 1 3 4 30.58 27.39 2.9238 -1 3 1 4 31.39 6.54 2.8501 0 3 2 4 31.42 8.98 2.8473 1 3 1 4 32.62 41.49 2.7450 2 0 0 2 32.69 12.21 2.7396 0 4 0 2 33.66 2.87 2.6627 2 1 0 4 33.74 40.99 2.6568 0 2 3 4 34.35 15.31 2.6108 -2 1 1 4 34.73 3.75 2.5827 -1 3 2 4 36.53 1.20 2.4596 -1 2 3 4 36.62 4.40 2.4542 2 2 0 4 36.86 3.35 2.4387 -2 0 2 2 37.66 9.29 2.3886 -1 4 1 4 37.79 15.02 2.3805 -2 1 2 4 38.34 13.05 2.3479 0 4 2 4 38.36 25.18 2.3464 1 4 1 4 38.54 5.24 2.3357 0 3 3 4 38.66 4.71 2.3288 1 2 3 4 38.67 1.20 2.3285 2 2 1 4 39.55 15.92 2.2784 0 0 4 2 39.66 32.06 2.2727 2 0 2 2 40.44 30.28 2.2307 0 1 4 4 41.06 18.59 2.1983 -1 3 3 4 41.13 3.72 2.1944 2 3 0 4 41.19 5.81 2.1916 -1 4 2 4 41.69 2.34 2.1664 -1 0 4 2 41.72 23.34 2.1651 -2 3 1 4 42.42 8.16 2.1309 0 5 1 4 42.54 1.31 2.1252 -1 1 4 4 42.99 2.51 2.1038 0 2 4 4 43.00 4.39 2.1034 1 3 3 4 43.01 15.42 2.1032 2 3 1 4 43.43 6.77 2.0838 -2 1 3 4 44.24 7.20 2.0474 1 0 4 2 44.51 12.05 2.0355 1 5 0 4 44.53 1.75 2.0345 0 4 3 4 44.68 6.49 2.0283 -2 3 2 4 45.00 4.16 2.0146 -1 2 4 4 45.04 1.43 2.0126 1 1 4 4 45.85 9.56 1.9792 -2 2 3 4 45.95 13.70 1.9751 0 5 2 4 45.97 2.58 1.9742 1 5 1 4 46.78 18.73 1.9418 -1 4 3 4 46.85 21.08 1.9391 2 4 0 4 47.09 3.28 1.9299 2 1 3 4 48.44 5.34 1.8793 -1 5 2 4 48.54 6.54 1.8754 1 4 3 4 49.37 15.38 1.8459 2 2 3 4 49.59 13.17 1.8384 1 5 2 4 49.93 1.11 1.8264 0 6 0 2 50.57 2.61 1.8050 3 1 0 4 50.68 11.95 1.8013 -2 1 4 4 50.78 5.38 1.7980 0 1 5 4 51.00 4.90 1.7908 0 6 1 4 52.22 2.23 1.7518 0 4 4 4 52.28 11.77 1.7499 -1 1 5 4 52.37 9.08 1.7470 -3 0 2 2 52.45 1.38 1.7447 3 1 1 4 52.85 3.20 1.7324 -2 2 4 4 53.01 5.37 1.7274 2 3 3 4 53.08 4.30 1.7252 -3 1 2 4 53.44 7.60 1.7146 -1 5 3 4 53.50 8.43 1.7127 2 5 0 4 53.58 2.36 1.7104 -1 6 1 4 54.10 4.44 1.6953 0 6 2 4 54.34 1.51 1.6883 2 0 4 2 54.40 3.32 1.6865 -1 2 5 4 54.56 18.93 1.6819 3 2 1 4 54.70 3.63 1.6779 -2 4 3 4 54.97 7.53 1.6703 1 1 5 4 55.04 4.41 1.6684 1 5 3 4 55.05 6.46 1.6683 2 5 1 4 56.22 1.89 1.6362 3 3 0 4 56.27 4.28 1.6348 3 1 2 4 56.33 4.63 1.6334 -2 3 4 4 56.43 8.36 1.6307 -3 3 1 4 56.45 2.26 1.6301 -2 5 2 4 57.08 1.74 1.6135 2 2 4 4 57.29 1.56 1.6082 -3 1 3 4 57.82 4.80 1.5948 -1 3 5 4 58.43 4.25 1.5795 0 5 4 4 58.51 2.93 1.5776 2 5 2 4 59.17 1.13 1.5614 -2 1 5 4 59.95 1.92 1.5429 0 7 1 4 60.34 11.90 1.5339 1 3 5 4 60.40 3.03 1.5326 2 3 4 4 60.87 1.37 1.5219 -1 6 3 4 60.93 1.11 1.5206 2 6 0 4 61.00 1.01 1.5189 0 0 6 2 61.06 6.20 1.5175 0 4 5 4 61.07 4.65 1.5174 -3 4 1 4 61.37 2.93 1.5107 -2 6 1 4 61.60 6.51 1.5055 1 7 0 4 61.65 2.00 1.5046 0 1 6 4 62.09 3.46 1.4949 -1 0 6 2 62.29 5.55 1.4906 -1 7 1 4 62.53 2.05 1.4853 -3 3 3 4 63.12 3.26 1.4730 -3 4 2 4 63.65 3.79 1.4619 -2 6 2 4 63.73 1.73 1.4603 3 2 3 4 64.63 1.72 1.4422 -1 2 6 4 64.82 5.29 1.4384 1 4 5 4 64.87 7.54 1.4373 2 4 4 4 65.04 2.17 1.4339 -3 2 4 4 65.50 1.26 1.4251 0 6 4 4 65.57 2.55 1.4237 2 6 2 4 65.62 1.12 1.4227 1 1 6 4 66.57 2.29 1.4047 3 5 0 4 66.67 4.54 1.4029 -2 5 4 4 66.76 1.41 1.4013 -3 5 1 4 66.92 1.52 1.3982 -3 4 3 4 67.02 2.73 1.3964 -1 6 4 4 67.48 2.07 1.3881 1 2 6 4 68.24 3.03 1.3743 3 0 4 2 68.35 1.26 1.3725 4 0 0 2 68.66 7.16 1.3670 -2 4 5 4 68.74 2.24 1.3656 -2 1 6 4 68.89 1.07 1.3629 1 6 4 4 68.90 5.15 1.3627 -4 1 1 4 68.95 2.83 1.3619 4 1 0 4 70.39 2.23 1.3375 2 5 4 4 70.48 1.29 1.3361 -3 1 5 4 70.51 1.14 1.3355 1 3 6 4 70.56 1.56 1.3348 -2 2 6 4 70.72 2.38 1.3322 -4 2 1 4 71.10 2.52 1.3259 3 4 3 4 71.48 5.50 1.3199 3 5 2 4 71.55 5.68 1.3188 -1 8 1 4 71.63 1.25 1.3174 -2 7 2 4 71.96 2.19 1.3122 -1 4 6 4 71.98 3.13 1.3118 0 8 2 4 72.00 1.36 1.3115 1 8 1 4 72.27 1.82 1.3073 -3 2 5 4 72.37 1.17 1.3058 -3 5 3 4 72.40 2.40 1.3054 -4 2 2 4 73.21 1.24 1.2929 0 1 7 4 73.25 1.89 1.2923 2 4 5 4 73.38 1.05 1.2903 0 7 4 4 73.65 1.50 1.2862 4 0 2 2 73.69 2.58 1.2855 -4 3 1 4 73.89 1.17 1.2826 -1 8 2 4 74.05 1.18 1.2803 -2 5 5 4 74.23 2.41 1.2776 2 1 6 4 74.83 1.64 1.2689 -1 7 4 4 74.98 1.04 1.2667 0 2 7 4 75.23 1.81 1.2631 -3 3 5 4 75.49 1.82 1.2593 4 3 1 4 76.62 2.43 1.2436 1 7 4 4 76.90 1.49 1.2398 2 6 4 4 77.12 1.56 1.2368 1 1 7 4 77.25 1.32 1.2350 3 1 5 4 78.58 1.52 1.2174 -3 0 6 2 78.65 1.46 1.2165 -1 3 7 4 79.01 3.34 1.2119 -4 1 4 4 79.23 3.52 1.2091 1 8 3 4 79.39 1.06 1.2070 -2 1 7 4 80.79 1.96 1.1896 3 7 0 4 81.87 2.57 1.1766 3 3 5 4 81.93 3.20 1.1759 0 4 7 4 82.16 2.02 1.1732 2 8 2 4 82.69 2.35 1.1670 -4 4 3 4 83.02 1.90 1.1632 4 5 0 4 83.58 1.90 1.1568 -1 6 6 4 83.60 1.09 1.1566 -4 3 4 4 83.93 3.41 1.1529 4 3 3 4 83.96 2.56 1.1525 -3 6 4 4 84.71 1.01 1.1442 4 5 1 4 85.24 1.31 1.1385 1 8 4 4 85.44 1.51 1.1363 4 0 4 2 85.74 2.42 1.1331 0 1 8 4 86.02 2.03 1.1302 0 9 3 4 86.20 1.66 1.1283 1 6 6 4 87.22 1.18 1.1177 2 2 7 4 87.29 1.17 1.1170 -4 2 5 4 87.45 1.01 1.1154 0 2 8 4 87.63 1.19 1.1135 -1 9 3 4 87.73 1.91 1.1125 -3 4 6 4 87.96 1.39 1.1102 -2 4 7 4 89.27 1.44 1.0972 4 6 0 4 89.34 1.67 1.0966 3 8 0 4 89.50 1.40 1.0950 0 8 5 4 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.