Phillipsite-K Gualtieri A F Journal of Applied Crystallography 33 (2000) 267-278 Accuracy of XRPD QPA using the combined Rietveld-RIR method Locality: Vallerano, Rome, Italy _database_code_amcsd 0012860 CELL PARAMETERS: 9.8881 14.4040 8.6848 90.000 124.271 90.000 SPACE GROUP: P2_1/m X-RAY WAVELENGTH: 1.541838 Cell Volume: 1022.202 Density (g/cm3): 2.173 MAX. ABS. INTENSITY / VOLUME**2: 2.430153934 RIR: 0.364 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 10.83 1.17 8.1714 1 0 0 2 10.90 7.80 8.1146 -1 0 1 2 12.29 71.67 7.2020 0 2 0 2 12.33 65.87 7.1770 0 0 1 2 12.45 32.07 7.1073 1 1 0 4 12.52 8.89 7.0699 -1 1 1 4 13.79 86.98 6.4237 0 1 1 4 16.41 70.42 5.4030 1 2 0 4 16.46 49.80 5.3865 -1 2 1 4 17.44 32.96 5.0837 0 2 1 4 17.94 56.57 4.9439 -2 0 1 2 18.98 8.73 4.6761 -2 1 1 4 20.56 14.00 4.3196 1 0 1 2 20.68 14.18 4.2944 -1 0 2 2 21.47 4.35 4.1396 1 3 0 4 21.48 36.00 4.1375 1 1 1 4 21.50 9.50 4.1322 -1 3 1 4 21.59 26.90 4.1154 -1 1 2 4 21.75 1.46 4.0857 2 0 0 2 21.80 27.36 4.0760 -2 2 1 4 21.91 5.04 4.0573 -2 0 2 2 22.28 1.60 3.9907 0 3 1 4 22.62 5.92 3.9306 2 1 0 4 24.02 2.45 3.7044 1 2 1 4 24.13 2.42 3.6884 -1 2 2 4 25.58 1.07 3.4821 0 1 2 4 25.87 1.71 3.4444 -2 3 1 4 27.06 50.60 3.2952 1 4 0 4 27.09 25.18 3.2915 -1 4 1 4 27.72 100.00 3.2186 0 4 1 4 27.73 41.64 3.2176 -3 0 1 2 27.78 99.81 3.2119 0 2 2 4 27.78 9.20 3.2112 1 3 1 4 27.82 13.32 3.2071 -3 0 2 2 27.87 11.89 3.2009 -1 3 2 4 28.42 57.41 3.1402 -3 1 1 4 28.51 55.12 3.1305 -3 1 2 4 28.69 5.09 3.1116 2 3 0 4 28.81 2.11 3.0990 -2 3 2 4 30.43 23.88 2.9377 -3 2 1 4 30.51 16.69 2.9298 -3 2 2 4 30.68 1.73 2.9145 2 0 1 2 30.90 11.22 2.8939 -2 0 3 2 31.11 1.04 2.8744 0 3 2 4 32.37 11.18 2.7659 1 4 1 4 32.41 24.73 2.7625 1 0 2 2 32.45 28.25 2.7593 -1 4 2 4 32.54 8.04 2.7514 -1 0 3 2 32.97 17.58 2.7169 1 5 0 4 32.99 8.51 2.7148 -1 5 1 4 33.02 26.07 2.7130 1 1 2 4 33.12 5.01 2.7049 -3 0 3 2 33.15 18.05 2.7026 -1 1 3 4 33.16 15.87 2.7016 2 2 1 4 33.16 3.45 2.7015 2 4 0 4 33.27 1.92 2.6932 -2 4 2 4 33.37 21.47 2.6852 -2 2 3 4 33.48 10.25 2.6764 3 1 0 4 33.52 7.48 2.6735 0 5 1 4 33.53 2.40 2.6729 -3 3 1 4 33.60 1.38 2.6669 -3 3 2 4 33.72 13.40 2.6584 -3 1 3 4 34.78 6.17 2.5792 1 2 2 4 34.91 2.75 2.5703 -1 2 3 4 35.23 7.22 2.5477 3 2 0 4 35.31 4.04 2.5419 0 4 2 4 35.45 13.55 2.5322 -3 2 3 4 36.09 2.97 2.4891 -2 5 1 4 36.24 1.31 2.4785 -2 3 3 4 36.89 1.24 2.4363 -4 1 2 4 37.48 14.45 2.3993 -3 4 1 4 37.55 22.36 2.3950 -3 4 2 4 37.56 3.32 2.3944 1 3 2 4 37.60 1.98 2.3923 0 0 3 2 38.13 1.41 2.3600 0 1 3 4 38.23 12.60 2.3544 2 5 0 4 38.32 2.51 2.3489 -2 5 2 4 38.50 6.59 2.3381 -4 2 2 4 38.61 1.72 2.3319 -4 0 3 2 38.95 1.76 2.3122 -4 1 1 4 39.13 1.77 2.3019 -4 1 3 4 39.79 8.93 2.2655 2 4 1 4 40.14 5.53 2.2465 0 5 2 4 41.07 3.51 2.1978 -4 3 2 4 41.19 1.79 2.1918 1 4 2 4 41.29 2.49 2.1863 -1 4 3 4 41.57 6.30 2.1723 3 4 0 4 41.77 16.37 2.1627 -3 4 3 4 41.83 1.08 2.1598 2 0 2 2 41.83 1.38 2.1595 -2 6 1 4 42.20 1.83 2.1412 0 3 3 4 42.32 2.30 2.1359 2 1 2 4 43.11 2.68 2.0984 1 6 1 4 43.17 2.89 2.0955 -1 6 2 4 43.51 2.49 2.0802 3 2 1 4 43.76 1.56 2.0688 2 2 2 4 43.82 2.92 2.0661 -2 6 2 4 44.01 4.79 2.0577 -2 2 4 4 44.21 1.39 2.0488 2 5 1 4 44.34 3.15 2.0428 4 0 0 2 44.37 3.75 2.0416 -2 5 3 4 45.09 2.28 2.0108 1 0 3 2 45.23 3.86 2.0049 -1 0 4 2 45.45 4.24 1.9954 1 7 0 4 45.55 1.39 1.9915 1 1 3 4 45.84 1.69 1.9795 3 3 1 4 46.03 1.83 1.9719 -3 5 3 4 46.14 1.29 1.9674 -3 3 4 4 46.19 1.84 1.9653 4 2 0 4 46.30 6.69 1.9610 -5 0 2 2 46.39 2.84 1.9573 -4 4 3 4 46.40 1.49 1.9571 -5 0 3 2 46.75 2.47 1.9431 -5 1 2 4 47.24 1.30 1.9241 -3 6 1 4 47.30 2.50 1.9219 -3 6 2 4 48.96 1.73 1.8604 3 4 1 4 49.42 1.84 1.8442 -2 4 4 4 49.53 6.04 1.8405 0 5 3 4 50.35 1.65 1.8123 -5 3 3 4 50.36 3.88 1.8120 1 6 2 4 50.47 4.94 1.8084 -5 1 4 4 50.70 17.35 1.8005 0 8 0 2 50.89 7.41 1.7942 0 0 4 2 51.17 1.17 1.7851 0 7 2 4 51.43 10.60 1.7768 4 4 0 4 51.72 10.59 1.7675 -4 4 4 4 52.37 2.13 1.7470 3 0 2 2 52.56 1.31 1.7410 0 2 4 4 52.75 2.31 1.7353 -3 0 5 2 52.77 4.38 1.7347 3 5 1 4 52.79 1.26 1.7342 3 1 2 4 52.81 1.50 1.7335 -3 7 1 4 52.86 2.21 1.7319 -3 7 2 4 53.04 3.18 1.7265 -3 5 4 4 53.07 6.21 1.7255 4 0 1 2 53.16 1.00 1.7228 -3 1 5 4 53.18 11.45 1.7222 -4 6 2 4 53.50 5.24 1.7127 -4 0 5 2 54.12 7.07 1.6946 0 6 3 4 54.38 1.02 1.6870 -3 2 5 4 54.54 4.09 1.6826 -2 0 5 2 54.60 6.89 1.6807 0 3 4 4 55.75 3.40 1.6489 1 5 3 4 55.78 12.10 1.6480 -6 0 3 2 55.79 1.07 1.6479 -1 7 3 4 56.33 1.17 1.6332 -5 4 1 4 56.79 1.29 1.6211 -5 5 2 4 56.88 1.81 1.6189 -5 5 3 4 57.11 1.85 1.6127 -5 1 5 4 57.18 1.84 1.6110 3 6 1 4 57.25 3.55 1.6093 0 8 2 4 57.27 1.38 1.6088 -6 0 2 2 57.36 1.78 1.6065 -6 2 3 4 57.38 5.38 1.6059 0 4 4 4 57.44 4.64 1.6044 -3 6 4 4 57.47 1.06 1.6036 -6 0 4 2 57.59 1.87 1.6004 -2 6 4 4 58.77 1.25 1.5712 -3 8 1 4 58.81 2.88 1.5701 -6 2 2 4 58.94 1.06 1.5670 1 1 4 4 59.14 3.89 1.5621 0 9 1 4 59.77 5.49 1.5471 5 3 0 4 59.82 3.52 1.5460 -4 7 1 4 60.08 1.32 1.5399 1 2 4 4 60.23 1.38 1.5365 -1 2 5 4 60.57 2.01 1.5288 -2 8 3 4 60.71 1.09 1.5254 -6 3 2 4 61.47 1.68 1.5084 1 8 2 4 61.82 2.18 1.5007 1 9 1 4 61.87 1.54 1.4997 -1 9 2 4 62.14 2.11 1.4938 3 5 2 4 62.48 1.59 1.4865 -3 5 5 4 63.31 4.62 1.4689 -6 4 2 4 63.51 1.28 1.4649 -6 4 4 4 63.63 1.43 1.4623 -6 2 5 4 63.84 2.20 1.4581 2 5 3 4 64.15 2.31 1.4517 -5 6 4 4 64.24 1.23 1.4498 4 1 2 4 64.53 1.96 1.4441 1 4 4 4 65.11 1.52 1.4327 3 1 3 4 65.33 1.41 1.4283 0 1 5 4 66.22 1.12 1.4114 -5 1 6 4 66.41 2.42 1.4077 0 2 5 4 67.58 1.88 1.3861 -6 4 1 4 67.65 6.46 1.3848 1 9 2 4 67.80 1.03 1.3822 -3 8 4 4 67.93 3.40 1.3799 3 9 0 4 67.94 1.75 1.3796 -2 8 4 4 67.95 5.79 1.3795 -6 4 5 4 68.07 2.79 1.3774 -3 9 3 4 69.14 1.81 1.3587 -6 6 3 4 69.97 1.19 1.3445 -5 6 5 4 70.43 3.67 1.3369 3 4 3 4 70.44 2.59 1.3367 0 10 2 4 70.64 2.98 1.3334 0 4 5 4 70.84 5.90 1.3302 -3 4 6 4 71.75 1.18 1.3155 -1 6 5 4 73.07 1.33 1.2949 1 0 5 2 73.20 1.06 1.2930 -4 5 6 4 73.31 1.25 1.2913 2 10 1 4 73.43 2.32 1.2895 -2 10 3 4 73.49 1.13 1.2886 3 9 1 4 73.72 1.43 1.2851 -2 4 6 4 74.67 1.03 1.2712 -7 0 1 2 74.69 1.34 1.2709 0 8 4 4 74.73 1.10 1.2702 -7 4 2 4 75.04 1.66 1.2657 -7 4 5 4 75.16 1.44 1.2641 -7 -5 3 4 75.19 2.02 1.2637 -7 0 6 2 76.14 1.47 1.2503 1 3 5 4 76.46 2.39 1.2458 4 8 1 4 77.67 1.50 1.2293 -2 8 5 4 78.06 1.30 1.2242 -6 5 6 4 78.66 1.17 1.2164 3 0 4 2 78.93 1.55 1.2129 -3 11 1 4 78.98 1.37 1.2123 -3 11 2 4 78.99 1.39 1.2121 3 1 4 4 81.52 1.05 1.1808 6 3 1 4 81.84 1.84 1.1769 4 4 3 4 85.14 1.05 1.1395 -5 9 5 4 86.56 1.07 1.1245 3 8 3 4 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.