K Mo2 O12 P3 Leclaire A, Raveau B Acta Crystallographica C44 (1988) 226-229 Small atomic displacements in the molybdenophosphates AMo2P3O12 (A = K, Rb, Tl) _cod_database_code 1001349 _database_code_amcsd 0010063 CELL PARAMETERS: 17.6398 9.1761 12.3000 90.000 90.000 90.000 SPACE GROUP: Pbnm X-RAY WAVELENGTH: 1.541838 Cell Volume: 1990.934 Density (g/cm3): 3.442 MAX. ABS. INTENSITY / VOLUME**2: 21.83825616 RIR: 2.066 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 10.03 2.23 8.8199 2 0 0 2 13.93 13.47 6.3588 2 1 0 4 14.40 19.61 6.1500 0 0 2 2 15.69 83.37 5.6486 2 1 1 8 17.58 9.12 5.0447 2 0 2 4 19.35 26.63 4.5880 0 2 0 2 20.09 3.39 4.4207 2 1 2 8 20.14 38.65 4.4099 4 0 0 2 21.84 4.90 4.0703 2 2 0 4 22.37 30.30 3.9748 4 1 0 4 23.02 26.45 3.8642 2 2 1 8 23.52 6.71 3.7822 4 1 1 8 25.86 100.00 3.4458 2 1 3 8 26.26 4.59 3.3942 2 2 2 8 28.07 72.68 3.1794 4 2 0 4 29.01 11.83 3.0782 4 2 1 8 29.04 22.79 3.0750 0 0 4 2 30.79 14.34 2.9036 2 0 4 4 30.94 15.42 2.8899 2 3 0 4 30.96 2.05 2.8886 2 2 3 8 31.34 4.75 2.8538 4 1 3 8 31.68 16.01 2.8243 4 2 2 8 31.81 28.99 2.8133 2 3 1 8 32.34 13.41 2.7683 2 1 4 8 32.81 18.61 2.7299 6 1 1 8 33.79 2.87 2.6525 6 0 2 4 34.29 1.18 2.6155 2 3 2 8 35.13 12.54 2.5544 0 2 4 4 35.22 1.77 2.5481 6 1 2 8 35.59 5.05 2.5223 4 0 4 4 35.74 1.42 2.5125 4 2 3 8 36.63 3.22 2.4535 2 2 4 8 37.05 1.58 2.4267 6 2 1 8 38.10 2.99 2.3621 2 3 3 8 38.95 13.85 2.3121 6 1 3 8 40.64 1.24 2.2202 2 4 0 4 40.83 11.50 2.2103 4 2 4 8 40.93 2.16 2.2050 8 0 0 2 41.66 1.45 2.1680 0 2 5 4 42.04 2.32 2.1494 0 4 2 4 42.17 3.41 2.1428 4 3 3 8 42.66 3.37 2.1196 6 3 0 4 42.67 2.89 2.1191 6 2 3 8 42.95 1.81 2.1058 2 3 4 8 43.32 9.72 2.0888 6 3 1 8 43.61 1.98 2.0756 8 0 2 4 44.18 10.96 2.0500 0 0 6 2 44.52 9.95 2.0351 4 4 0 4 45.16 2.00 2.0078 4 4 1 8 45.30 3.19 2.0020 0 4 3 4 45.65 12.54 1.9874 8 2 0 4 46.27 3.48 1.9619 8 2 1 8 48.34 12.16 1.8829 6 3 3 8 48.65 6.64 1.8717 0 2 6 4 49.00 10.25 1.8590 4 0 6 4 50.04 7.40 1.8229 4 4 3 8 50.82 7.30 1.7967 2 5 0 4 51.07 3.37 1.7884 8 2 3 8 51.40 3.89 1.7779 2 5 1 8 51.64 2.81 1.7700 8 3 1 8 51.83 1.45 1.7640 10 0 0 2 52.43 3.66 1.7452 6 3 4 8 53.16 6.11 1.7229 4 2 6 8 53.41 6.93 1.7153 10 1 1 8 54.03 12.18 1.6971 4 4 4 8 54.15 10.96 1.6937 2 1 7 8 54.91 2.15 1.6720 2 3 6 8 55.02 11.81 1.6691 8 2 4 8 55.53 1.23 1.6547 6 4 3 8 55.87 4.46 1.6457 2 5 3 8 57.78 6.64 1.5957 10 1 3 8 58.02 7.68 1.5897 8 4 0 4 58.55 1.85 1.5766 8 4 1 8 59.37 6.78 1.5568 6 5 0 4 60.17 2.62 1.5379 4 2 7 8 60.19 2.42 1.5375 0 0 8 2 60.54 1.29 1.5293 0 6 0 2 60.60 1.35 1.5281 10 3 0 4 61.06 2.78 1.5177 0 6 1 4 61.11 1.76 1.5164 10 3 1 8 61.79 8.84 1.5014 2 3 7 8 61.79 1.09 1.5014 8 0 6 4 62.39 7.23 1.4883 6 1 7 8 62.68 1.55 1.4822 8 4 3 8 62.71 1.23 1.4817 8 1 6 8 63.09 2.21 1.4736 6 3 6 8 63.26 2.60 1.4700 12 0 0 2 63.97 1.58 1.4554 6 5 3 8 64.49 1.77 1.4449 4 6 0 4 64.52 4.32 1.4443 4 4 6 8 65.04 1.17 1.4340 4 1 8 8 65.10 3.21 1.4329 0 6 3 4 65.15 4.77 1.4319 10 3 3 8 65.40 5.47 1.4269 8 2 6 8 66.17 2.59 1.4122 8 4 4 8 66.83 2.52 1.3999 12 2 0 4 67.43 3.01 1.3889 6 5 4 8 68.59 1.01 1.3683 10 2 5 8 68.90 1.89 1.3628 4 6 3 8 69.48 4.58 1.3528 6 3 7 8 69.58 4.59 1.3512 2 5 6 8 70.48 2.16 1.3362 2 1 9 8 70.85 1.70 1.3300 4 4 7 8 71.08 5.13 1.3262 12 0 4 4 71.93 1.13 1.3126 12 1 4 8 72.96 1.96 1.2966 2 7 0 4 74.47 1.52 1.2741 12 2 4 8 75.17 1.34 1.2640 2 4 8 8 75.71 2.12 1.2563 2 5 7 8 75.71 1.30 1.2562 8 4 6 8 76.74 1.06 1.2419 14 1 1 8 76.90 1.14 1.2398 6 5 6 8 77.35 4.23 1.2336 10 1 7 8 77.94 1.32 1.2258 0 6 6 4 80.17 1.15 1.1973 6 7 0 4 80.37 2.26 1.1948 2 7 4 8 80.42 1.99 1.1942 14 1 3 8 81.68 1.65 1.1789 8 4 7 8 81.99 1.64 1.1752 10 5 4 8 83.39 1.35 1.1590 10 0 8 4 83.65 1.12 1.1561 12 2 6 8 83.87 2.06 1.1536 0 6 7 4 83.92 1.72 1.1531 10 3 7 8 84.32 1.28 1.1486 6 3 9 8 84.45 2.79 1.1471 4 2 10 8 86.93 2.58 1.1206 14 3 3 8 87.38 1.52 1.1160 4 6 7 8 87.42 1.63 1.1157 6 7 4 8 88.42 1.08 1.1056 4 8 1 8 88.86 1.38 1.1013 2 1 11 8 89.42 1.04 1.0958 2 7 6 8 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.