K O5 P Ti Dahaoui S, Hansen N, Menaert B Acta Crystallographica C53 (1997) 1173-1176 Na Ti O P O4 and K Ti O P O4 at 110 K _cod_database_code 1008808 _database_code_amcsd 0016679 CELL PARAMETERS: 12.7982 6.3937 10.5853 90.000 90.000 90.000 SPACE GROUP: Pna2_1 X-RAY WAVELENGTH: 1.541838 Cell Volume: 866.172 Density (g/cm3): 3.035 MAX. ABS. INTENSITY / VOLUME**2: 7.183343553 RIR: 0.771 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 13.84 25.79 6.3991 2 0 0 2 15.49 39.75 5.7197 1 1 0 4 16.19 91.01 5.4762 2 0 1 2 16.20 100.00 5.4728 0 1 1 2 17.63 1.37 5.0320 1 1 1 4 21.36 11.31 4.1592 2 1 1 4 21.79 1.73 4.0784 2 0 2 2 22.89 1.41 3.8847 1 1 2 4 25.09 15.07 3.5487 3 1 0 4 25.91 61.05 3.4384 2 1 2 4 26.49 32.90 3.3646 3 1 1 4 28.90 75.09 3.0898 2 0 3 2 28.90 71.81 3.0892 0 1 3 2 29.16 10.55 3.0627 4 0 1 2 29.75 1.67 3.0030 1 1 3 4 30.02 12.82 2.9764 1 2 1 4 30.32 3.88 2.9475 3 1 2 4 31.26 1.48 2.8613 4 1 0 4 31.28 5.37 2.8598 2 2 0 4 32.41 91.89 2.7622 4 1 1 4 32.43 70.34 2.7608 2 2 1 4 32.71 54.19 2.7381 4 0 2 2 32.73 67.66 2.7364 0 2 2 2 33.49 6.71 2.6759 1 2 2 4 33.87 29.16 2.6463 0 0 4 1 35.69 17.60 2.5160 2 2 2 4 35.89 4.25 2.5021 3 1 3 4 36.12 2.15 2.4867 3 2 1 4 36.75 1.38 2.4455 2 0 4 2 37.45 5.72 2.4017 1 1 4 4 37.86 6.03 2.3763 5 1 0 4 37.96 1.59 2.3702 4 0 3 2 38.65 2.46 2.3295 1 2 3 4 38.84 2.35 2.3186 5 1 1 4 39.11 1.06 2.3033 3 2 2 4 39.86 9.82 2.2615 4 2 0 4 40.59 6.71 2.2224 4 1 3 4 40.61 6.01 2.2217 2 2 3 4 40.80 2.55 2.2116 4 2 1 4 41.66 15.20 2.1678 5 1 2 4 42.37 4.68 2.1330 6 0 0 2 42.62 1.15 2.1214 3 1 4 4 43.03 15.83 2.1023 1 3 0 4 43.27 1.27 2.0910 6 0 1 2 43.70 4.31 2.0712 3 2 3 4 44.43 27.71 2.0392 4 0 4 2 44.44 27.17 2.0385 0 2 4 2 45.11 4.03 2.0099 2 0 5 2 45.11 5.39 2.0098 0 1 5 2 45.65 4.10 1.9874 6 1 1 4 45.68 1.60 1.9861 2 3 1 4 45.87 1.88 1.9784 6 0 2 2 46.05 1.01 1.9710 5 1 3 4 46.24 4.37 1.9634 5 2 1 4 46.48 6.34 1.9538 1 3 2 4 46.77 1.67 1.9423 2 2 4 4 47.70 4.99 1.9066 3 3 0 4 47.77 2.81 1.9040 4 2 3 4 48.15 4.98 1.8900 6 1 2 4 48.18 4.50 1.8889 2 3 2 4 48.52 3.19 1.8764 3 3 1 4 49.96 11.75 1.8254 6 0 3 2 50.00 10.57 1.8243 0 3 3 2 50.18 1.43 1.8181 3 1 5 4 50.54 1.30 1.8060 1 3 3 4 51.51 7.61 1.7743 6 2 0 4 51.70 7.78 1.7681 5 1 4 4 52.02 1.87 1.7579 7 1 0 4 52.11 6.65 1.7553 6 1 3 4 52.13 4.75 1.7544 2 3 3 4 52.28 3.45 1.7499 6 2 1 4 52.30 2.53 1.7494 4 3 1 4 52.32 1.98 1.7486 1 2 5 4 52.64 4.33 1.7387 5 2 3 4 52.79 2.61 1.7341 7 1 1 4 53.28 31.80 1.7192 4 2 4 4 53.87 13.35 1.7019 4 1 5 4 53.88 11.79 1.7016 2 2 5 4 54.72 7.84 1.6773 3 3 3 4 55.94 1.27 1.6436 2 1 6 4 56.16 11.09 1.6378 5 3 0 4 56.89 1.22 1.6186 5 3 1 4 57.62 15.35 1.5998 8 0 0 2 57.67 11.23 1.5984 0 4 0 2 58.20 1.85 1.5852 6 2 3 4 58.22 4.50 1.5848 4 3 3 4 58.68 4.63 1.5734 7 1 3 4 58.84 1.75 1.5695 7 2 1 4 58.87 1.07 1.5686 1 4 1 4 59.04 1.67 1.5646 5 3 2 4 59.62 3.38 1.5508 2 4 0 4 59.78 5.00 1.5469 3 3 4 4 59.87 7.44 1.5449 4 0 6 2 59.88 9.81 1.5446 0 2 6 2 60.27 1.49 1.5355 8 1 1 4 60.32 3.57 1.5344 2 4 1 4 60.45 1.50 1.5313 8 0 2 2 60.94 1.30 1.5202 7 2 2 4 60.98 2.52 1.5193 1 4 2 4 61.76 1.66 1.5020 0 3 5 2 62.20 1.35 1.4926 6 3 1 4 62.23 1.95 1.4917 1 3 5 4 62.35 1.25 1.4892 8 1 2 4 62.52 2.41 1.4856 5 3 3 4 63.08 8.47 1.4737 6 2 4 4 63.18 10.48 1.4717 2 0 7 2 63.18 11.16 1.4716 0 1 7 2 63.54 2.95 1.4642 7 1 4 4 63.64 2.57 1.4622 2 3 5 4 64.24 1.88 1.4500 6 3 2 4 64.37 1.59 1.4474 7 2 3 4 65.21 1.34 1.4306 8 2 0 4 65.73 4.87 1.4206 8 1 3 4 65.78 5.55 1.4197 2 4 3 4 65.92 1.08 1.4170 4 4 1 4 65.95 3.40 1.4165 5 1 6 4 67.22 19.98 1.3927 5 3 4 4 67.47 2.26 1.3881 9 1 0 4 67.57 4.49 1.3864 6 3 3 4 67.86 3.95 1.3811 8 2 2 4 67.90 2.54 1.3804 4 4 2 4 68.04 1.53 1.3779 3 4 3 4 68.13 1.54 1.3763 9 1 1 4 68.54 1.94 1.3691 8 0 4 2 68.59 1.41 1.3682 0 4 4 2 69.07 2.66 1.3599 6 2 5 4 69.08 4.70 1.3596 4 3 5 4 69.09 2.09 1.3595 6 0 6 2 69.50 4.21 1.3524 7 1 5 4 69.56 1.19 1.3514 1 3 6 4 70.11 3.10 1.3423 7 3 2 4 70.37 2.63 1.3380 2 4 4 4 70.87 1.21 1.3297 6 1 6 4 71.27 4.05 1.3232 0 0 8 1 72.63 1.26 1.3018 3 2 7 4 73.28 1.42 1.2917 9 1 3 4 73.31 5.12 1.2914 7 3 3 4 73.42 1.22 1.2896 9 2 1 4 73.46 2.06 1.2891 1 1 8 4 74.79 2.26 1.2694 1 4 5 4 75.06 4.58 1.2656 5 4 3 4 75.55 7.75 1.2585 8 2 4 4 75.59 4.09 1.2580 4 4 4 4 75.65 1.50 1.2570 4 2 7 4 76.04 1.63 1.2516 8 1 5 4 76.50 3.29 1.2452 2 5 1 4 76.64 3.07 1.2433 6 4 2 4 77.35 1.07 1.2336 6 0 7 2 77.80 1.24 1.2276 1 3 7 4 78.01 1.18 1.2249 3 5 0 4 78.17 3.41 1.2227 4 0 8 2 78.18 2.63 1.2226 0 2 8 2 78.63 2.09 1.2168 3 5 1 4 79.05 1.45 1.2113 6 1 7 4 79.49 2.54 1.2058 5 2 7 4 79.72 1.85 1.2028 8 3 3 4 79.74 2.12 1.2025 6 4 3 4 80.29 1.41 1.1957 7 4 1 4 81.19 2.85 1.1848 3 3 7 4 81.34 3.43 1.1829 9 3 0 4 81.58 1.66 1.1800 4 5 1 4 81.96 1.40 1.1756 9 3 1 4 82.14 1.34 1.1734 7 4 2 4 83.23 1.79 1.1608 9 1 5 4 83.25 1.95 1.1606 7 3 5 4 83.55 1.26 1.1572 3 5 3 4 83.59 1.34 1.1568 2 0 9 2 83.59 2.29 1.1567 0 1 9 2 83.80 2.98 1.1544 9 3 2 4 84.49 1.51 1.1467 1 5 4 4 84.91 4.93 1.1420 4 2 8 4 85.28 1.28 1.1380 11 1 1 4 85.97 1.66 1.1307 8 4 0 4 86.85 1.50 1.1215 9 3 3 4 87.11 2.48 1.1188 11 1 2 4 87.18 1.30 1.1181 5 5 2 4 87.86 1.11 1.1112 8 2 6 4 87.89 1.88 1.1109 4 4 6 4 89.93 1.65 1.0909 6 5 1 4 89.95 2.46 1.0907 7 3 6 4 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.