Ba2 Ca1.17 Co0.83 F14 Fe2 Le Lirzin A, Quiang X, Darriet J, Soubeyroux J, Kaiser V, Pebler J, Babel D European Journal of Solid State and Inorganic Chemistry 27 (1990) 791-803 Structural and magnetic properties of 1D bimetallic chains in Ba2CaCoFe2F14 and Ba2CaCoCr2F14 _cod_database_code 1008493 _database_code_amcsd 0016386 CELL PARAMETERS: 13.7800 5.3950 14.9700 90.000 91.220 90.000 SPACE GROUP: C2/c X-RAY WAVELENGTH: 1.541838 Cell Volume: 1112.664 Density (g/cm3): 4.465 MAX. ABS. INTENSITY / VOLUME**2: 36.42995281 RIR: 2.656 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 11.83 3.64 7.4833 0 0 2 2 12.85 3.64 6.8884 2 0 0 2 17.66 12.49 5.0236 1 1 0 4 18.59 3.14 4.7736 -1 1 1 4 18.68 3.49 4.7513 1 1 1 4 21.23 9.02 4.1860 -1 1 2 4 21.38 18.98 4.1560 1 1 2 4 23.78 30.85 3.7417 0 0 4 2 25.06 4.72 3.5537 -1 1 3 4 25.47 100.00 3.4970 3 1 0 4 26.27 3.99 3.3931 3 1 1 4 26.87 24.54 3.3177 -2 0 4 2 27.37 15.45 3.2589 2 0 4 2 27.99 30.66 3.1880 -3 1 2 4 28.29 11.10 3.1544 -4 0 2 2 28.35 13.50 3.1486 3 1 2 4 28.76 16.08 3.1037 4 0 2 2 29.66 31.89 3.0120 -1 1 4 4 29.89 29.45 2.9897 1 1 4 4 33.21 23.22 2.6975 0 2 0 2 33.76 1.57 2.6547 0 2 1 4 34.83 10.59 2.5758 -3 1 4 4 35.01 3.63 2.5627 1 1 5 4 35.37 1.07 2.5377 0 2 2 4 35.42 10.18 2.5344 3 1 4 4 35.81 3.00 2.5076 4 0 4 2 36.22 2.74 2.4803 -2 2 1 4 36.31 2.01 2.4740 2 2 1 4 36.62 1.96 2.4539 5 1 0 4 37.24 1.38 2.4142 5 1 1 4 37.69 1.10 2.3868 -2 2 2 4 37.87 3.64 2.3757 2 2 2 4 37.92 4.32 2.3728 0 2 3 4 38.39 1.91 2.3449 -5 1 2 4 38.65 13.55 2.3296 2 0 6 2 39.24 4.36 2.2961 6 0 0 2 39.30 3.79 2.2924 -3 1 5 4 40.24 3.49 2.2411 -1 1 6 4 40.33 12.76 2.2365 2 2 3 4 40.50 3.78 2.2273 1 1 6 4 40.67 3.21 2.2186 -5 1 3 4 40.86 10.91 2.2084 -6 0 2 2 41.26 24.00 2.1881 0 2 4 4 41.38 22.44 2.1821 6 0 2 2 42.57 3.26 2.1237 4 2 0 4 42.94 6.02 2.1065 -4 2 1 4 43.10 2.63 2.0988 4 2 1 4 43.23 8.68 2.0930 -2 2 4 4 43.55 8.23 2.0780 2 2 4 4 43.73 16.37 2.0700 -5 1 4 4 44.18 5.65 2.0501 -4 2 2 4 44.26 12.69 2.0465 -3 1 6 4 44.38 4.88 2.0410 -4 0 6 2 44.50 8.84 2.0360 4 2 2 4 44.54 6.78 2.0343 5 1 4 4 44.98 4.08 2.0153 3 1 6 4 45.34 3.70 2.0001 4 0 6 2 46.24 3.03 1.9633 -4 2 3 4 47.05 4.18 1.9315 -2 2 5 4 48.67 11.77 1.8708 0 0 8 2 49.04 4.09 1.8574 -4 2 4 4 49.28 2.28 1.8489 7 1 0 4 49.56 2.04 1.8395 -7 1 1 4 49.64 4.27 1.8366 4 2 4 4 50.62 7.03 1.8034 -7 1 2 4 51.12 13.56 1.7867 7 1 2 4 51.43 1.65 1.7768 -2 2 6 4 51.64 1.22 1.7701 1 3 1 4 52.32 2.17 1.7485 6 2 0 4 52.81 1.23 1.7334 6 2 1 4 53.17 1.22 1.7225 7 1 3 4 53.21 2.01 1.7214 4 2 5 4 53.64 9.30 1.7088 -6 2 2 4 53.68 2.89 1.7076 -6 0 6 2 54.05 3.31 1.6965 6 2 2 4 54.61 4.80 1.6806 -1 3 3 4 54.79 1.30 1.6756 0 2 7 4 54.82 7.00 1.6745 3 3 0 4 54.92 3.22 1.6717 6 0 6 2 55.14 1.79 1.6656 -3 3 1 4 55.25 3.66 1.6627 3 3 1 4 55.31 11.24 1.6608 -3 1 8 4 56.13 12.01 1.6386 3 1 8 4 56.20 3.89 1.6368 -3 3 2 4 56.54 3.40 1.6276 -4 2 6 4 57.16 3.89 1.6115 -1 3 4 4 57.30 3.50 1.6080 1 3 4 4 57.35 2.23 1.6066 4 2 6 4 57.96 1.31 1.5912 -3 3 3 4 58.52 1.93 1.5772 -8 0 4 2 59.57 1.38 1.5519 8 0 4 2 60.20 10.49 1.5373 0 2 8 4 60.39 1.33 1.5329 -3 3 4 4 60.51 1.71 1.5301 1 3 5 4 60.77 1.09 1.5240 3 3 4 4 61.86 4.39 1.4998 -7 1 6 4 61.99 1.52 1.4969 4 2 7 4 63.19 4.63 1.4714 7 1 6 4 64.11 1.05 1.4525 -1 3 6 4 64.21 4.31 1.4506 -9 1 2 4 64.60 3.47 1.4428 -6 2 6 4 64.77 3.09 1.4393 9 1 2 4 64.88 1.27 1.4371 5 3 3 4 64.97 1.34 1.4355 6 0 8 2 65.71 7.15 1.4210 6 2 6 4 65.75 1.12 1.4203 -9 1 3 4 67.63 1.09 1.3853 3 3 6 4 67.70 5.14 1.3841 -3 1 10 4 67.73 1.07 1.3835 -4 0 10 2 67.92 2.54 1.3800 -9 1 4 4 68.05 1.95 1.3777 10 0 0 2 68.41 1.56 1.3713 -1 3 7 4 68.81 1.06 1.3644 -6 2 7 4 69.66 1.40 1.3498 10 0 2 2 69.72 1.37 1.3487 0 4 0 2 69.93 1.49 1.3452 8 2 4 4 70.04 1.70 1.3433 0 4 1 4 70.95 1.41 1.3284 -7 1 8 4 71.22 2.70 1.3241 -7 3 1 4 71.26 1.63 1.3233 -3 3 7 4 71.53 2.19 1.3189 -2 4 1 4 71.73 1.12 1.3159 -1 1 11 4 72.07 2.02 1.3104 -7 3 2 4 72.49 2.12 1.3040 7 3 2 4 72.67 1.06 1.3010 4 2 9 4 74.02 1.11 1.2807 -2 4 3 4 74.09 2.39 1.2797 -9 1 6 4 74.20 1.33 1.2781 2 4 3 4 74.94 1.40 1.2672 6 2 8 4 75.01 1.60 1.2662 -6 0 10 2 75.66 2.25 1.2569 9 1 6 4 75.97 1.35 1.2526 -3 3 8 4 76.23 1.08 1.2489 -7 1 9 4 76.36 1.06 1.2472 0 0 12 2 76.67 2.05 1.2429 3 3 8 4 76.75 1.28 1.2418 6 0 10 2 77.10 1.03 1.2370 4 4 2 4 77.48 1.13 1.2319 -2 0 12 2 77.85 2.20 1.2269 10 2 0 4 78.37 1.96 1.2201 -7 3 5 4 78.70 1.44 1.2159 4 2 10 4 78.72 1.10 1.2157 4 4 3 4 78.97 1.59 1.2124 -2 4 5 4 79.29 1.67 1.2083 1 1 12 4 82.54 1.48 1.1688 3 1 12 4 82.69 1.07 1.1671 -11 1 4 4 82.88 1.50 1.1648 4 0 12 2 83.24 1.70 1.1607 9 3 1 4 83.43 1.25 1.1585 6 4 1 4 83.75 2.05 1.1549 4 4 5 4 83.78 1.55 1.1546 -9 3 2 4 83.93 1.51 1.1529 11 1 4 4 84.00 2.03 1.1521 7 1 10 4 84.10 1.04 1.1511 -6 4 2 4 84.53 1.82 1.1462 -6 2 10 4 85.03 1.58 1.1407 0 4 7 4 86.92 1.40 1.1208 -10 0 8 2 86.95 1.19 1.1205 -5 1 12 4 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.