BaFe11Ti3O23 Vanderah T A, Wong-Ng W, Toby B H, Browning V M, Shull R D, Geyer R G, Roth R S Journal of Solid State Chemistry 143 (1999) 182-197 Characterization of ternary compounds in the BaO:Fe2O3:TiO2 system: Ba6Fe45Ti17O106 and BaFe11Ti3O23 Note: data from single-crystal X-ray diffraction _database_code_amcsd 0013968 CELL PARAMETERS: 19.5610 8.6614 10.1200 90.000 105.620 90.000 SPACE GROUP: C2/c X-RAY WAVELENGTH: 1.541838 Cell Volume: 1651.266 Density (g/cm3): 5.082 MAX. ABS. INTENSITY / VOLUME**2: 14.85194566 RIR: 0.952 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 15.25 1.41 5.8116 1 1 1 4 17.44 3.14 5.0840 3 1 0 4 18.10 8.53 4.9000 -2 0 2 2 18.20 3.67 4.8731 0 0 2 2 18.84 6.14 4.7096 4 0 0 2 20.51 5.59 4.3307 0 2 0 2 22.35 3.10 3.9777 -3 1 2 4 22.47 5.87 3.9576 0 2 1 4 22.51 6.44 3.9490 1 1 2 4 22.69 1.04 3.9189 2 0 2 2 23.41 29.78 3.8000 -2 2 1 4 25.13 1.62 3.5436 -5 1 1 4 25.35 23.44 3.5140 2 2 1 4 25.79 13.81 3.4550 5 1 0 4 27.49 21.73 3.2450 -2 2 2 4 27.72 3.35 3.2182 -5 1 2 4 27.81 19.11 3.2075 -4 2 1 4 27.99 3.45 3.1878 4 2 0 4 28.43 3.99 3.1398 6 0 0 2 28.52 15.52 3.1296 -1 1 3 4 29.22 4.07 3.0565 -3 1 3 4 29.40 53.23 3.0379 -6 0 2 2 29.49 57.36 3.0294 5 1 1 4 29.72 1.09 3.0061 4 0 2 2 30.77 72.32 2.9058 2 2 2 4 30.94 18.40 2.8904 1 1 3 4 31.07 100.00 2.8788 4 2 1 4 31.34 7.36 2.8538 1 3 0 4 32.33 2.30 2.7695 -1 3 1 4 32.85 90.74 2.7264 -5 1 3 4 33.06 3.97 2.7092 1 3 1 4 33.70 47.29 2.6594 -7 1 1 4 33.74 26.38 2.6562 -2 2 3 4 34.18 39.00 2.6232 3 3 0 4 34.91 9.88 2.5700 7 1 0 4 35.31 2.55 2.5420 6 2 0 4 35.36 8.89 2.5383 5 1 2 4 35.48 1.79 2.5298 -2 0 4 2 35.68 5.65 2.5161 -4 2 3 4 35.81 12.20 2.5076 -1 3 2 4 35.90 15.58 2.5013 3 1 3 4 36.12 11.45 2.4870 -6 2 2 4 36.38 4.43 2.4695 4 2 2 4 36.68 2.45 2.4500 -4 0 4 2 36.89 18.38 2.4366 0 0 4 2 37.05 43.30 2.4265 -3 3 2 4 37.39 19.86 2.4052 -1 1 4 4 37.84 31.43 2.3773 2 2 3 4 38.04 4.71 2.3653 6 0 2 2 38.22 3.82 2.3548 8 0 0 2 38.45 5.74 2.3411 7 1 1 4 38.50 4.77 2.3384 6 2 1 4 38.87 1.55 2.3170 -5 3 1 4 39.32 3.01 2.2917 5 3 0 4 39.65 7.55 2.2730 -5 1 4 4 39.99 1.09 2.2547 -6 2 3 4 40.28 16.05 2.2389 -6 0 4 2 40.67 30.62 2.2185 2 0 4 2 40.67 41.00 2.2184 -5 3 2 4 40.86 24.23 2.2084 3 3 2 4 41.71 1.29 2.1653 0 4 0 2 42.39 3.19 2.1324 -4 2 4 4 42.65 1.09 2.1199 5 1 3 4 42.78 4.94 2.1138 0 4 1 4 42.97 1.67 2.1049 -9 1 1 4 43.32 12.63 2.0887 -2 4 1 4 43.48 1.92 2.0811 -9 1 2 4 43.60 1.22 2.0759 6 2 2 4 43.76 1.30 2.0688 8 2 0 4 44.16 2.51 2.0510 -7 1 4 4 44.47 1.56 2.0373 2 4 1 4 45.81 3.60 1.9806 -8 0 4 2 45.81 1.44 1.9806 -2 4 2 4 45.96 1.38 1.9745 2 2 4 4 46.09 1.14 1.9692 -3 1 5 4 46.11 2.37 1.9686 7 3 0 4 46.21 34.05 1.9646 -7 3 2 4 46.34 16.35 1.9595 4 0 4 2 46.47 9.06 1.9542 5 3 2 4 46.73 5.02 1.9438 -1 1 5 4 46.78 2.88 1.9417 -10 0 2 2 47.01 4.73 1.9329 8 2 1 4 47.17 4.73 1.9267 8 0 2 2 47.57 1.81 1.9117 -5 1 5 4 48.00 2.29 1.8953 2 4 2 4 48.01 1.14 1.8949 9 1 1 4 48.10 6.41 1.8915 -1 3 4 4 48.21 18.63 1.8877 4 4 1 4 48.31 1.16 1.8839 10 0 0 2 49.42 1.22 1.8443 1 1 5 4 50.10 1.17 1.8206 -2 4 3 4 50.35 2.01 1.8124 -9 1 4 4 50.64 1.42 1.8026 7 1 3 4 50.68 1.12 1.8012 -8 2 4 4 51.01 10.41 1.7905 -7 1 5 4 51.39 7.20 1.7781 -10 2 1 4 51.94 2.67 1.7604 8 2 2 4 52.79 2.24 1.7341 -11 1 1 4 52.82 2.99 1.7332 -10 0 4 2 53.13 1.23 1.7240 9 1 2 4 53.16 11.25 1.7229 2 4 3 4 53.22 43.73 1.7213 -9 3 2 4 53.45 17.24 1.7143 6 0 4 2 53.53 13.91 1.7119 7 3 2 4 53.67 3.02 1.7079 6 4 1 4 54.18 13.59 1.6928 3 3 4 4 54.23 2.95 1.6915 1 5 1 4 54.58 3.13 1.6815 -4 0 6 2 54.63 2.94 1.6801 11 1 0 4 54.99 3.46 1.6699 3 5 0 4 55.48 1.85 1.6563 -3 3 5 4 56.12 1.29 1.6389 -1 5 2 4 56.33 4.47 1.6333 -6 0 6 2 56.67 2.78 1.6244 0 0 6 2 56.71 19.62 1.6232 -8 2 5 4 56.74 1.57 1.6225 -4 4 4 4 57.08 1.46 1.6137 1 5 2 4 57.17 1.89 1.6114 9 3 1 4 58.13 3.22 1.5870 11 1 1 4 58.52 1.17 1.5773 7 1 4 4 58.66 10.55 1.5739 5 5 0 4 58.82 2.89 1.5699 12 0 0 2 58.92 1.10 1.5675 -4 2 6 4 58.94 2.71 1.5671 -7 1 6 4 59.03 2.26 1.5648 -2 2 6 4 59.24 1.98 1.5597 -9 3 4 4 59.51 1.08 1.5535 7 3 3 4 59.67 2.52 1.5496 2 4 4 4 59.82 1.21 1.5461 3 5 2 4 59.97 8.83 1.5426 4 2 5 4 60.11 3.03 1.5394 -1 5 3 4 60.59 1.09 1.5283 -6 2 6 4 60.65 6.85 1.5270 5 5 1 4 61.00 24.21 1.5190 -12 0 4 2 61.19 3.93 1.5147 10 2 2 4 61.39 18.43 1.5101 -11 3 2 4 61.48 2.73 1.5082 1 5 3 4 61.71 9.23 1.5031 8 0 4 2 61.75 34.19 1.5023 9 3 2 4 62.62 8.39 1.4834 -5 5 3 4 62.75 1.67 1.4806 -11 1 5 4 63.15 3.98 1.4723 -7 5 1 4 63.20 2.00 1.4713 -13 1 1 4 63.22 1.29 1.4708 6 4 3 4 63.80 1.36 1.4588 -13 1 3 4 63.91 4.28 1.4566 7 5 0 4 63.93 58.77 1.4563 -3 3 6 4 63.95 3.03 1.4558 -8 2 6 4 64.09 1.11 1.4529 4 4 4 4 64.47 3.53 1.4452 2 2 6 4 64.55 2.22 1.4438 3 5 3 4 64.56 25.96 1.4436 0 6 0 2 64.77 1.59 1.4394 8 4 2 4 65.53 3.56 1.4245 -1 5 4 4 65.54 1.13 1.4243 -3 1 7 4 65.75 1.60 1.4202 -2 6 1 4 65.84 2.64 1.4185 -5 1 7 4 66.20 1.92 1.4117 -10 4 3 4 66.24 1.47 1.4109 7 5 1 4 66.42 1.23 1.4075 12 2 1 4 66.51 1.17 1.4059 6 2 5 4 66.92 1.35 1.3983 -1 1 7 4 67.07 6.57 1.3955 -5 5 4 4 67.22 1.58 1.3927 9 1 4 4 67.33 1.25 1.3907 2 4 5 4 67.34 1.38 1.3904 7 1 5 4 67.42 2.10 1.3891 12 0 2 2 68.88 3.96 1.3632 -10 2 6 4 68.98 5.63 1.3615 -8 4 5 4 69.44 4.15 1.3536 11 1 3 4 69.92 8.44 1.3453 1 1 7 4 70.29 3.25 1.3391 -7 5 4 4 70.61 1.94 1.3339 -13 3 2 4 70.63 2.89 1.3336 3 5 4 4 70.87 5.69 1.3297 -14 2 2 4 70.97 1.09 1.3281 -4 4 6 4 71.01 1.15 1.3274 10 0 4 2 71.01 2.26 1.3274 11 3 2 4 71.06 1.33 1.3265 -2 6 3 4 71.07 1.09 1.3265 -2 4 6 4 71.55 4.80 1.3187 -14 2 1 4 71.70 1.56 1.3163 -14 2 3 4 71.92 4.23 1.3128 4 4 5 4 72.49 4.77 1.3039 -6 6 2 4 72.87 1.07 1.2980 -5 5 5 4 72.93 1.02 1.2971 -12 4 1 4 73.06 1.19 1.2951 13 3 0 4 74.05 1.18 1.2803 -15 1 3 4 74.19 1.21 1.2782 -13 3 4 4 74.31 1.65 1.2763 -15 1 1 4 74.34 1.05 1.2760 8 2 5 4 74.91 1.12 1.2677 9 3 4 4 75.05 1.18 1.2656 -9 5 4 4 75.58 2.22 1.2580 -7 5 5 4 75.76 2.39 1.2555 -6 0 8 2 76.55 1.57 1.2445 -10 2 7 4 76.74 2.72 1.2420 0 6 4 4 77.03 1.51 1.2380 -11 5 1 4 77.36 1.33 1.2335 14 2 1 4 77.37 1.13 1.2334 5 3 6 4 77.51 1.71 1.2315 12 2 3 4 77.80 1.30 1.2277 -14 2 5 4 78.00 1.30 1.2250 -8 0 8 2 78.00 2.42 1.2250 -1 1 8 4 78.54 2.13 1.2179 11 5 0 4 78.90 2.98 1.2132 -6 6 4 4 79.16 3.53 1.2100 2 6 4 4 80.08 1.06 1.1983 4 2 7 4 80.24 2.13 1.1964 13 1 3 4 81.77 2.50 1.1778 -10 0 8 2 81.80 7.07 1.1774 16 0 0 2 82.30 2.13 1.1715 -16 2 3 4 82.32 1.04 1.1713 6 6 3 4 82.39 1.15 1.1705 14 2 2 4 82.74 2.06 1.1664 -14 4 1 4 83.11 3.34 1.1622 4 6 4 4 83.52 2.58 1.1575 -15 3 4 4 84.00 1.49 1.1521 8 2 6 4 84.04 1.43 1.1517 15 3 0 4 85.03 1.68 1.1408 -10 6 3 4 85.33 1.11 1.1375 -17 1 3 4 85.44 2.64 1.1364 -5 7 3 4 85.55 1.67 1.1351 -11 5 5 4 85.91 1.91 1.1314 -7 7 1 4 86.39 1.25 1.1263 -17 1 1 4 87.05 4.14 1.1195 -12 0 8 2 87.57 1.70 1.1141 -10 4 7 4 87.92 2.47 1.1106 -9 3 8 4 88.05 2.40 1.1093 4 0 8 2 88.35 1.30 1.1062 14 4 1 4 88.56 4.88 1.1042 6 6 4 4 88.78 1.41 1.1020 -14 4 5 4 89.61 1.16 1.0940 9 5 4 4 89.72 1.47 1.0929 7 5 5 4 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.