Ba(NH4)P3O9(H2O) Durif A, Marin C, Bassi G Bulletin de la Societe Francaise de Mineralogie et de Cristallographie 98 (1975) 19-24 Donnees cristallographiques sur Ba(NH4)P3O9(H2O) et BaTlP3O9(H2O). Structure cristalline de Ba(NH4)P3O9(H2O) _cod_database_code 1007034 _database_code_amcsd 0012140 CELL PARAMETERS: 11.7000 12.1200 7.5590 90.000 101.050 90.000 SPACE GROUP: P2_1/n X-RAY WAVELENGTH: 1.541838 Cell Volume: 1052.024 Density (g/cm3): 2.552 MAX. ABS. INTENSITY / VOLUME**2: 8.910985906 RIR: 1.137 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 10.61 66.73 8.3358 1 1 0 4 12.91 100.00 6.8595 -1 0 1 2 14.00 21.58 6.3275 0 1 1 4 14.84 61.81 5.9697 -1 1 1 4 15.41 11.29 5.7494 1 0 1 2 15.43 18.34 5.7415 2 0 0 2 16.54 69.73 5.3595 1 2 0 4 17.07 1.26 5.1946 1 1 1 4 17.09 75.97 5.1888 2 1 0 4 18.91 83.41 4.6933 0 2 1 4 19.10 46.13 4.6468 -2 1 1 4 19.55 21.40 4.5415 -1 2 1 4 21.30 26.74 4.1709 1 2 1 4 22.55 5.45 3.9433 2 1 1 4 22.97 11.29 3.8710 -2 2 1 4 23.34 4.96 3.8110 1 3 0 4 23.99 66.77 3.7094 0 0 2 2 24.03 2.17 3.7031 -3 0 1 2 24.39 10.82 3.6500 3 1 0 4 24.88 16.54 3.5790 -1 1 2 4 25.10 16.00 3.5480 0 3 1 4 25.15 17.90 3.5415 -3 1 1 4 25.59 8.06 3.4811 -1 3 1 4 25.94 4.88 3.4354 2 2 1 4 25.98 5.16 3.4297 -2 0 2 2 26.97 25.21 3.3055 1 3 1 4 26.99 24.22 3.3040 2 3 0 4 27.02 2.38 3.3001 -2 1 2 4 27.56 54.59 3.2362 3 2 0 4 27.65 28.35 3.2264 1 1 2 4 28.00 47.80 3.1864 -1 2 2 4 28.21 2.82 3.1638 0 2 2 4 28.21 12.33 3.1635 3 0 1 2 28.24 25.47 3.1598 -3 2 1 4 28.33 19.11 3.1501 -2 3 1 4 29.17 2.98 3.0610 3 1 1 4 29.48 21.43 3.0300 0 4 0 2 30.51 31.33 2.9299 1 2 2 4 30.51 11.28 2.9297 1 4 0 4 30.82 23.20 2.9016 2 3 1 4 31.08 32.43 2.8779 -3 1 2 4 31.11 8.76 2.8747 2 0 2 2 31.15 44.60 2.8708 4 0 0 2 31.90 38.73 2.8051 0 4 1 4 32.06 2.02 2.7916 -4 1 1 4 32.22 4.82 2.7786 3 3 0 4 32.30 2.08 2.7716 -1 4 1 4 32.81 19.86 2.7298 -3 3 1 4 33.44 1.40 2.6797 2 4 0 4 33.67 12.15 2.6616 -3 2 2 4 34.53 1.37 2.5973 2 2 2 4 34.57 2.38 2.5944 4 2 0 4 34.59 16.96 2.5929 -4 2 1 4 35.64 4.11 2.5189 -1 0 3 2 35.69 11.58 2.5156 -4 0 2 2 36.06 12.80 2.4908 3 3 1 4 36.42 1.67 2.4670 4 1 1 4 36.43 2.34 2.4662 -1 1 3 4 36.66 1.07 2.4513 2 4 1 4 37.10 1.39 2.4230 0 1 3 4 37.48 10.54 2.3996 -2 1 3 4 37.60 3.99 2.3923 3 1 2 4 37.87 8.43 2.3757 3 4 0 4 37.94 4.64 2.3717 1 5 0 4 38.20 4.82 2.3558 -1 4 2 4 38.36 3.62 2.3466 0 4 2 4 38.43 20.91 2.3423 2 3 2 4 38.69 2.12 2.3275 1 0 3 2 38.70 8.85 2.3266 4 2 1 4 38.71 4.47 2.3260 -1 2 3 4 38.76 3.45 2.3234 -4 2 2 4 38.76 3.11 2.3233 -5 0 1 2 39.35 11.89 2.2896 0 2 3 4 39.41 2.49 2.2865 -3 0 3 2 39.42 1.45 2.2857 1 1 3 4 39.43 2.69 2.2855 -1 5 1 4 39.49 3.00 2.2818 -5 1 1 4 39.71 1.50 2.2699 -2 2 3 4 39.82 18.16 2.2636 3 2 2 4 39.95 4.23 2.2565 5 1 0 4 40.13 8.69 2.2469 -3 1 3 4 40.14 3.99 2.2463 1 4 2 4 40.38 8.27 2.2336 1 5 1 4 40.39 7.17 2.2331 2 5 0 4 41.34 11.32 2.1838 -2 5 1 4 41.63 2.00 2.1693 -5 2 1 4 42.07 2.10 2.1476 5 2 0 4 42.25 9.04 2.1393 -3 2 3 4 42.27 10.37 2.1380 4 3 1 4 42.28 13.58 2.1375 -1 3 3 4 42.32 3.85 2.1355 -4 3 2 4 42.68 1.48 2.1183 -3 4 2 4 42.81 2.92 2.1125 -5 1 2 4 43.16 11.64 2.0958 2 1 3 4 43.17 7.44 2.0957 2 5 1 4 43.21 2.64 2.0937 -2 3 3 4 43.39 3.59 2.0855 2 4 2 4 43.40 10.50 2.0851 4 0 2 2 43.42 5.05 2.0840 5 0 1 2 43.42 5.51 2.0840 4 4 0 4 43.44 14.69 2.0832 -4 4 1 4 44.09 2.02 2.0538 5 1 1 4 44.15 1.27 2.0512 -4 1 3 4 44.23 4.76 2.0479 3 5 0 4 44.68 2.92 2.0281 -3 5 1 4 44.82 1.55 2.0224 -5 2 2 4 44.87 3.17 2.0200 0 6 0 2 44.95 6.92 2.0167 1 3 3 4 45.01 5.69 2.0140 -5 3 1 4 45.59 9.97 1.9899 -3 3 3 4 45.84 17.91 1.9795 -2 5 2 4 46.03 5.87 1.9716 4 2 2 4 46.06 3.56 1.9707 5 2 1 4 46.11 2.58 1.9684 -4 2 3 4 46.24 2.52 1.9632 1 5 2 4 46.89 3.23 1.9377 -1 6 1 4 46.90 13.25 1.9374 4 4 1 4 47.24 1.98 1.9241 3 5 1 4 47.32 6.63 1.9210 -6 1 1 4 47.44 1.75 1.9165 3 0 3 2 47.46 9.44 1.9159 0 4 3 4 47.72 3.55 1.9058 1 6 1 4 48.13 2.21 1.8904 6 1 0 4 48.34 1.40 1.8827 2 3 3 4 48.53 4.07 1.8761 -3 5 2 4 48.66 1.35 1.8711 -5 0 3 2 48.80 1.76 1.8663 -1 1 4 4 49.12 5.16 1.8547 0 0 4 2 49.17 10.13 1.8531 2 5 2 4 49.22 2.22 1.8511 -2 1 4 4 49.25 1.07 1.8502 -4 3 3 4 49.82 1.75 1.8303 -6 1 2 4 49.82 9.73 1.8303 5 4 0 4 49.97 5.03 1.8251 -3 4 3 4 50.99 2.36 1.7910 -3 1 4 4 51.19 3.47 1.7844 5 1 2 4 51.51 2.90 1.7740 0 6 2 4 51.53 1.86 1.7735 0 2 4 4 51.54 6.35 1.7733 -3 6 1 4 51.98 2.97 1.7593 1 1 4 4 52.14 4.19 1.7541 6 1 1 4 52.25 2.71 1.7509 -5 4 2 4 52.38 1.08 1.7466 -1 5 3 4 52.76 4.22 1.7350 -3 2 4 4 52.88 1.16 1.7315 3 3 3 4 52.94 2.59 1.7296 6 3 0 4 53.17 2.59 1.7225 -2 5 3 4 53.34 1.84 1.7177 4 4 2 4 53.41 6.72 1.7155 -4 4 3 4 53.43 5.11 1.7149 -4 0 4 2 53.52 2.76 1.7121 1 7 0 4 53.85 1.63 1.7025 3 6 1 4 53.96 3.24 1.6993 -2 3 4 4 54.01 4.45 1.6979 -5 3 3 4 54.52 3.82 1.6832 -6 3 2 4 54.67 7.70 1.6789 1 5 3 4 54.73 4.37 1.6773 -5 5 1 4 55.23 2.28 1.6633 -3 5 3 4 55.30 6.30 1.6613 -6 1 3 4 55.61 1.05 1.6528 2 6 2 4 55.61 4.40 1.6528 4 2 3 4 56.18 7.28 1.6372 -2 7 1 4 56.62 1.38 1.6256 7 1 0 4 57.20 1.89 1.6106 -7 2 1 4 57.40 3.83 1.6052 -7 1 2 4 57.49 2.25 1.6029 -1 4 4 4 57.64 3.01 1.5991 2 5 3 4 57.65 5.70 1.5991 2 7 1 4 58.13 2.17 1.5869 -5 1 4 4 58.27 1.57 1.5834 7 2 0 4 58.33 3.61 1.5819 0 4 4 4 58.34 2.86 1.5818 6 0 2 2 58.37 1.31 1.5809 4 3 3 4 58.40 1.50 1.5802 5 5 1 4 58.47 1.77 1.5785 -4 3 4 4 58.51 2.56 1.5775 3 7 0 4 58.58 4.49 1.5759 -1 6 3 4 58.61 3.25 1.5751 -4 6 2 4 58.75 2.32 1.5717 -1 7 2 4 59.65 1.18 1.5501 5 4 2 4 59.81 3.47 1.5462 2 3 4 4 59.91 3.14 1.5439 -7 3 1 4 59.93 1.08 1.5435 3 1 4 4 60.05 1.65 1.5407 7 0 1 2 60.17 1.83 1.5379 1 7 2 4 60.58 1.29 1.5284 7 1 1 4 61.07 1.41 1.5173 -6 5 1 4 61.23 1.36 1.5138 -3 6 3 4 61.52 3.52 1.5072 3 2 4 4 62.00 2.38 1.4968 -2 1 5 4 62.08 2.27 1.4950 -7 1 3 4 62.11 1.66 1.4944 4 4 3 4 62.20 1.52 1.4924 -4 4 4 4 62.68 1.95 1.4821 -2 5 4 4 62.81 2.48 1.4793 -1 8 1 4 63.12 2.44 1.4729 6 3 2 4 63.19 3.70 1.4714 -6 5 2 4 63.24 1.03 1.4704 -6 1 4 4 63.50 1.47 1.4650 1 8 1 4 63.55 1.48 1.4641 -1 2 5 4 64.20 3.29 1.4508 4 6 2 4 64.21 1.08 1.4504 5 6 1 4 64.61 1.48 1.4426 7 4 0 4 64.68 1.38 1.4412 0 2 5 4 64.71 1.95 1.4406 5 3 3 4 64.76 1.46 1.4396 7 3 1 4 64.87 1.93 1.4373 4 0 4 2 64.97 1.68 1.4354 8 0 0 2 65.20 1.96 1.4310 6 5 1 4 65.33 1.75 1.4283 -7 4 2 4 65.40 1.27 1.4270 4 7 1 4 65.68 1.48 1.4217 -8 2 1 4 66.01 4.59 1.4153 -5 4 4 4 66.10 4.08 1.4136 -2 7 3 4 66.21 1.99 1.4115 -7 3 3 4 66.69 1.11 1.4025 0 8 2 4 66.71 1.54 1.4022 6 4 2 4 67.00 1.46 1.3967 8 2 0 4 67.02 2.07 1.3965 -4 2 5 4 67.27 1.17 1.3918 -3 3 5 4 67.33 3.29 1.3908 -6 3 4 4 67.35 3.28 1.3903 3 6 3 4 67.41 1.07 1.3892 1 7 3 4 67.46 1.11 1.3883 -5 7 1 4 67.78 1.03 1.3825 5 7 0 4 67.87 3.70 1.3810 6 1 3 4 67.97 1.59 1.3792 -6 5 3 4 68.33 1.15 1.3727 -5 6 3 4 68.61 1.22 1.3678 7 2 2 4 68.75 1.13 1.3654 2 1 5 4 68.78 2.07 1.3649 -6 6 2 4 69.14 1.90 1.3586 7 5 0 4 69.24 1.06 1.3569 -7 1 4 4 69.42 2.32 1.3539 1 3 5 4 69.80 1.41 1.3474 -5 7 2 4 69.85 1.57 1.3466 -7 5 2 4 70.06 3.15 1.3430 2 7 3 4 70.25 1.34 1.3399 4 8 0 4 70.69 2.17 1.3326 0 4 5 4 71.18 1.89 1.3247 6 5 2 4 71.65 1.41 1.3171 -8 4 1 4 72.03 2.33 1.3111 2 9 0 4 72.68 2.43 1.3010 5 5 3 4 72.88 1.28 1.2978 -4 8 2 4 72.94 1.89 1.2970 -4 4 5 4 73.26 1.72 1.2920 -6 1 5 4 73.57 2.95 1.2874 -7 6 1 4 74.01 2.53 1.2809 -1 5 5 4 74.32 1.99 1.2763 -1 7 4 4 74.82 2.37 1.2690 -5 8 1 4 75.12 1.01 1.2646 5 8 0 4 75.91 1.18 1.2535 7 1 3 4 75.91 2.65 1.2535 -2 9 2 4 76.05 1.44 1.2514 -3 7 4 4 76.21 1.08 1.2492 5 7 2 4 76.73 1.90 1.2421 -3 1 6 4 76.75 1.75 1.2418 8 4 1 4 76.84 1.97 1.2405 -8 4 3 4 76.85 2.98 1.2405 1 7 4 4 76.98 1.94 1.2387 6 7 1 4 77.69 2.47 1.2292 -1 2 6 4 77.95 1.59 1.2256 4 8 2 4 77.97 1.72 1.2254 5 8 1 4 78.07 1.62 1.2240 -4 0 6 2 78.15 1.72 1.2230 -3 2 6 4 78.42 4.47 1.2195 2 9 2 4 78.44 1.06 1.2192 4 9 0 4 78.46 1.01 1.2190 9 0 1 2 78.61 1.46 1.2170 -7 1 5 4 78.89 1.25 1.2134 5 4 4 4 78.93 1.39 1.2129 9 1 1 4 79.25 1.39 1.2088 -1 6 5 4 79.58 1.76 1.2046 -6 7 3 4 79.76 1.09 1.2024 -2 3 6 4 80.44 1.21 1.1939 -5 5 5 4 81.36 1.39 1.1827 -9 4 2 4 81.43 1.16 1.1819 1 2 6 4 81.54 1.05 1.1805 -9 3 3 4 81.93 1.25 1.1759 9 4 0 4 82.35 1.16 1.1709 1 6 5 4 82.37 1.22 1.1707 -7 3 5 4 82.43 1.65 1.1701 8 6 0 4 82.47 2.79 1.1695 -8 6 2 4 82.60 2.31 1.1680 6 3 4 4 82.69 1.17 1.1670 9 3 1 4 82.97 2.57 1.1638 -10 1 1 4 83.53 1.18 1.1574 3 7 4 4 83.91 1.45 1.1531 -1 10 2 4 85.35 1.94 1.1373 -2 7 5 4 85.44 1.13 1.1363 4 4 5 4 85.58 1.01 1.1349 -5 6 5 4 86.10 1.31 1.1293 8 2 3 4 86.76 1.42 1.1225 -10 1 3 4 87.34 1.36 1.1164 -10 3 2 4 88.38 1.25 1.1060 5 3 5 4 88.52 1.99 1.1046 10 3 0 4 88.96 1.11 1.1003 -5 8 4 4 88.98 1.15 1.1000 -6 3 6 4 89.27 1.66 1.0973 3 2 6 4 89.67 1.22 1.0934 -2 9 4 4 89.79 1.15 1.0922 4 10 1 4 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.