CsAlF4 Bentrup U, Le Bail A, Duroy H, Fourquet J European Journal of Solid State and Inorganic Chemistry 29 (1992) 371-381 Polymorphism of CsAlF4. Synthesis and structure of two new crystalline forms _cod_database_code 1000107 _database_code_amcsd 0012553 CELL PARAMETERS: 10.5576 6.7500 17.5954 90.000 90.000 90.000 SPACE GROUP: Pnma X-RAY WAVELENGTH: 1.541838 Cell Volume: 1253.915 Density (g/cm3): 3.748 MAX. ABS. INTENSITY / VOLUME**2: 26.12345876 RIR: 2.270 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 9.77 6.29 9.0530 1 0 1 4 13.10 2.17 6.7587 1 0 2 4 14.05 2.57 6.3022 0 1 1 4 16.38 5.88 5.4114 1 1 1 8 16.80 4.96 5.2788 2 0 0 2 17.30 22.57 5.1271 1 0 3 4 18.58 17.25 4.7760 1 1 2 8 20.06 2.12 4.4273 0 1 3 4 20.19 10.58 4.3988 0 0 4 2 21.77 1.92 4.0828 1 1 3 8 21.89 11.04 4.0605 1 0 4 4 21.96 61.87 4.0468 2 1 1 8 22.66 14.42 3.9236 2 0 3 4 23.67 100.00 3.7594 2 1 2 8 25.60 13.70 3.4795 1 1 4 8 25.82 5.62 3.4509 3 0 1 4 26.27 16.01 3.3922 2 1 3 8 26.37 22.60 3.3793 2 0 4 4 26.41 52.26 3.3750 0 2 0 2 26.70 12.33 3.3385 1 0 5 4 27.29 8.86 3.2675 3 0 2 4 28.22 6.56 3.1624 1 2 1 8 28.32 10.72 3.1511 0 2 2 4 28.61 61.44 3.1205 0 1 5 4 29.06 18.53 3.0726 3 1 1 8 29.58 1.89 3.0195 1 2 2 8 29.60 18.54 3.0177 3 0 3 4 29.86 35.39 2.9925 1 1 5 8 30.39 21.94 2.9410 3 1 2 8 31.46 2.87 2.8435 2 2 0 4 31.74 37.80 2.8190 1 2 3 8 32.50 5.52 2.7549 3 1 3 8 33.11 3.90 2.7057 2 2 2 8 33.47 11.58 2.6777 0 2 4 4 33.97 3.09 2.6394 4 0 0 2 34.36 30.32 2.6102 4 0 1 4 34.56 30.59 2.5955 1 2 4 8 35.00 7.04 2.5635 2 0 6 4 35.07 20.84 2.5587 2 2 3 8 35.26 1.48 2.5452 3 1 4 8 35.51 3.66 2.5281 4 0 2 4 36.75 1.93 2.4453 1 0 7 4 36.92 1.29 2.4345 4 1 1 8 37.36 6.04 2.4069 4 0 3 4 37.67 4.74 2.3880 2 2 4 8 37.91 5.48 2.3735 1 2 5 8 38.01 1.07 2.3675 4 1 2 8 38.21 1.29 2.3556 0 1 7 4 38.34 13.37 2.3475 3 2 2 8 38.56 2.08 2.3348 3 1 5 8 39.18 1.13 2.2991 1 1 7 8 39.72 28.36 2.2695 2 0 7 4 39.76 4.63 2.2671 4 1 3 8 40.02 12.99 2.2529 3 0 6 4 40.08 19.55 2.2496 3 2 3 8 41.04 3.23 2.1994 0 0 8 2 41.35 10.01 2.1836 1 3 1 8 41.69 2.23 2.1665 1 2 6 8 42.00 1.36 2.1511 2 1 7 8 42.11 5.08 2.1458 4 1 4 8 42.29 8.15 2.1370 3 1 6 8 42.42 1.36 2.1310 3 2 4 8 43.15 2.14 2.0965 5 0 1 4 43.85 15.15 2.0647 4 2 1 8 44.05 7.67 2.0557 2 3 1 8 44.15 6.87 2.0514 1 1 8 8 44.37 4.61 2.0414 2 2 6 8 44.63 4.98 2.0302 2 0 8 4 44.79 1.06 2.0234 4 2 2 8 44.98 4.99 2.0152 4 1 5 8 44.99 10.67 2.0148 2 3 2 8 45.28 1.31 2.0029 3 2 5 8 45.29 2.19 2.0021 5 1 1 8 45.82 1.43 1.9802 1 2 7 8 46.28 2.47 1.9618 4 0 6 4 46.33 12.36 1.9596 4 2 3 8 46.53 1.70 1.9518 2 3 3 8 47.28 4.15 1.9224 1 0 9 4 47.78 1.23 1.9036 5 0 4 4 47.99 7.49 1.8957 0 3 5 4 48.29 11.06 1.8848 3 3 1 8 48.31 5.49 1.8839 4 1 6 8 48.33 13.63 1.8833 2 2 7 8 48.43 4.47 1.8797 4 2 4 8 48.48 3.58 1.8779 0 1 9 4 48.59 15.26 1.8738 3 2 6 8 48.81 4.28 1.8658 1 3 5 8 49.17 6.58 1.8531 3 3 2 8 49.46 1.09 1.8427 0 2 8 4 49.77 10.07 1.8321 5 1 4 8 50.11 1.27 1.8202 4 0 7 4 50.40 1.06 1.8106 5 0 5 4 50.60 2.98 1.8038 3 3 3 8 51.30 4.06 1.7809 5 2 1 8 52.04 3.78 1.7575 4 1 7 8 52.30 1.58 1.7493 3 2 7 8 52.61 2.76 1.7397 2 2 8 8 52.74 8.07 1.7356 1 0 10 4 53.52 2.25 1.7121 5 2 3 8 53.84 9.14 1.7027 6 1 0 4 54.11 4.53 1.6948 6 1 1 8 54.29 1.19 1.6897 4 0 8 4 54.37 11.84 1.6875 0 4 0 2 54.60 2.05 1.6809 1 1 10 8 54.97 3.83 1.6704 1 2 9 8 55.42 6.71 1.6580 5 2 4 8 55.50 1.71 1.6557 1 3 7 8 56.11 8.09 1.6391 4 1 8 8 56.26 1.36 1.6352 6 1 3 8 56.82 2.74 1.6204 2 1 10 8 57.49 2.41 1.6029 1 4 3 8 57.93 4.06 1.5920 3 3 6 8 58.09 4.07 1.5879 6 1 4 8 58.59 1.97 1.5755 0 4 4 4 58.66 4.77 1.5738 6 0 5 4 59.30 3.14 1.5583 1 4 4 8 59.41 6.28 1.5556 1 3 8 8 59.64 2.89 1.5502 2 4 3 8 59.93 10.94 1.5435 1 2 10 8 60.35 2.15 1.5338 5 3 1 8 60.51 2.21 1.5301 4 1 9 8 60.81 1.37 1.5232 5 0 8 4 61.10 1.70 1.5166 5 3 2 8 61.24 2.88 1.5135 3 3 7 8 61.41 3.05 1.5097 2 4 4 8 61.45 2.18 1.5088 6 0 6 4 61.58 2.08 1.5060 1 4 5 8 61.88 2.03 1.4993 3 4 2 8 62.51 1.15 1.4858 5 1 8 8 62.85 2.65 1.4787 4 3 6 8 62.98 1.91 1.4758 0 3 9 4 63.12 4.85 1.4729 3 4 3 8 63.24 2.28 1.4705 6 2 4 8 63.67 1.53 1.4616 1 3 9 8 63.93 1.10 1.4562 3 0 11 4 64.08 4.25 1.4532 5 3 4 8 64.12 1.17 1.4523 1 0 12 4 65.37 2.28 1.4277 7 1 3 8 65.43 3.22 1.4264 6 2 5 8 65.58 6.04 1.4235 3 1 11 8 65.77 2.05 1.4198 1 1 12 8 65.91 5.38 1.4171 4 4 1 8 66.02 1.30 1.4151 4 3 7 8 66.65 3.29 1.4032 5 1 9 8 67.59 3.29 1.3861 6 3 0 4 67.77 3.13 1.3828 2 1 12 8 67.82 2.85 1.3818 6 3 1 8 67.83 2.70 1.3817 4 4 3 8 68.33 1.99 1.3728 7 2 1 8 69.04 1.05 1.3604 7 2 2 8 69.40 5.58 1.3542 2 4 7 8 69.58 3.14 1.3511 4 3 8 8 69.61 4.53 1.3506 3 4 6 8 69.86 1.63 1.3464 6 1 8 8 70.09 1.58 1.3425 1 0 13 4 70.42 5.07 1.3371 3 2 11 8 70.60 1.65 1.3341 1 2 12 8 71.34 1.84 1.3220 6 3 4 8 71.45 5.21 1.3202 5 2 9 8 71.67 1.20 1.3167 1 1 13 8 71.75 1.61 1.3155 7 1 6 8 71.81 1.66 1.3146 5 4 1 8 72.23 1.70 1.3079 6 0 9 4 72.41 4.57 1.3051 8 0 2 4 72.46 2.00 1.3043 2 5 1 8 72.89 1.90 1.2977 2 4 8 8 73.15 3.84 1.2937 2 5 2 8 73.52 1.51 1.2881 4 3 9 8 73.91 3.22 1.2823 7 2 5 8 74.87 2.32 1.2682 1 4 9 8 75.12 2.96 1.2647 8 1 3 8 75.25 1.80 1.2628 5 4 4 8 75.41 3.46 1.2604 0 5 5 4 76.05 2.11 1.2515 1 5 5 8 76.32 1.07 1.2477 3 5 2 8 76.34 1.23 1.2474 1 2 13 8 76.41 1.46 1.2464 7 2 6 8 77.83 1.42 1.2272 1 1 14 8 77.99 1.69 1.2252 7 3 3 8 78.19 2.54 1.2225 3 3 11 8 78.42 2.16 1.2195 6 2 9 8 78.59 3.45 1.2173 8 2 2 8 79.16 3.78 1.2099 1 4 10 8 79.19 2.31 1.2096 5 3 9 8 80.23 1.24 1.1965 2 3 12 8 81.77 1.05 1.1778 0 2 14 4 82.68 1.09 1.1671 7 2 8 8 84.00 1.55 1.1521 7 3 6 8 84.07 3.38 1.1513 8 1 7 8 84.10 2.14 1.1510 6 4 5 8 84.63 1.70 1.1451 2 0 15 4 85.15 1.36 1.1395 5 0 13 4 86.13 1.80 1.1290 7 1 10 8 86.51 2.72 1.1250 0 6 0 2 86.53 1.17 1.1248 6 4 6 8 86.65 1.64 1.1236 5 1 13 8 88.74 1.34 1.1025 3 4 11 8 88.87 1.57 1.1012 5 5 4 8 89.11 1.10 1.0989 1 6 3 8 89.19 1.01 1.0980 3 1 15 8 89.71 1.10 1.0930 5 4 9 8 89.88 1.78 1.0914 1 3 14 8 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.