K2 O9 P2 W Borel M, Leclaire A, Chardon J, Michel C, Raveau B Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences 324 (1997) 189-195 New molybdeno- and tungstodiphosphates with the (NH4)2MoO2P2O7 chain-like structure _cod_database_code 1001766 _database_code_amcsd 0012320 CELL PARAMETERS: 13.7660 8.0020 15.4970 90.000 98.340 90.000 SPACE GROUP: C2/c X-RAY WAVELENGTH: 1.541838 Cell Volume: 1689.027 Density (g/cm3): 3.680 MAX. ABS. INTENSITY / VOLUME**2: 27.91910071 RIR: 2.470 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 11.54 1.71 7.6666 0 0 2 2 12.83 38.71 6.8994 1 1 0 4 13.00 10.83 6.8102 2 0 0 2 13.68 11.15 6.4723 -1 1 1 4 14.46 100.00 6.1256 1 1 1 4 16.11 54.22 5.5032 -2 0 2 2 17.92 40.49 4.9508 1 1 2 4 18.64 14.74 4.7602 2 0 2 2 20.86 68.02 4.2593 -1 1 3 4 22.52 12.31 3.9488 3 1 0 4 22.53 37.78 3.9462 -3 1 1 4 22.97 77.53 3.8714 0 2 1 4 23.20 37.85 3.8333 0 0 4 2 24.01 20.55 3.7060 -3 1 2 4 24.95 11.74 3.5691 -2 0 4 2 25.11 2.00 3.5470 0 2 2 4 25.74 11.85 3.4605 -1 1 4 4 26.06 28.33 3.4198 -2 2 1 4 26.17 49.63 3.4051 4 0 0 2 26.67 6.21 3.3430 3 1 2 4 26.90 25.17 3.3138 2 2 1 4 27.07 5.06 3.2943 -4 0 2 2 27.44 29.90 3.2510 1 1 4 4 27.56 8.54 3.2361 -2 2 2 4 28.33 2.25 3.1505 0 2 3 4 29.16 5.67 3.0628 2 2 2 4 30.17 3.80 2.9620 -2 2 3 4 30.23 1.12 2.9569 4 0 2 2 30.30 28.21 2.9500 3 1 3 4 30.38 26.00 2.9422 -3 1 4 4 31.03 4.32 2.8820 -1 1 5 4 32.36 7.18 2.7666 2 2 3 4 32.54 2.72 2.7516 -4 0 4 2 32.82 21.64 2.7289 1 1 5 4 34.26 7.13 2.6176 1 3 0 4 34.43 15.20 2.6046 -4 2 1 4 34.47 2.25 2.6021 -5 1 1 4 34.60 2.57 2.5923 -1 3 1 4 34.61 9.24 2.5919 3 1 4 4 34.70 18.41 2.5852 -3 1 5 4 34.79 11.63 2.5788 5 1 0 4 34.93 1.56 2.5684 1 3 1 4 35.16 1.42 2.5524 -5 1 2 4 35.69 5.52 2.5156 -2 0 6 2 35.75 11.02 2.5116 4 2 1 4 35.94 6.95 2.4986 -1 3 2 4 36.10 9.54 2.4878 5 1 1 4 36.58 1.03 2.4564 1 3 2 4 36.82 13.06 2.4410 -5 1 3 4 36.93 28.86 2.4339 0 2 5 4 38.19 5.55 2.3566 -1 3 3 4 38.45 4.06 2.3410 1 1 6 4 39.34 7.17 2.2902 -5 1 4 4 39.41 2.02 2.2863 3 1 5 4 39.42 3.84 2.2860 2 0 6 2 39.51 1.48 2.2807 -3 1 6 4 39.74 8.29 2.2681 -6 0 2 2 39.76 1.74 2.2672 -4 2 4 4 40.07 3.03 2.2502 3 3 1 4 40.10 4.41 2.2488 -3 3 2 4 40.72 2.62 2.2159 4 2 3 4 40.78 6.38 2.2126 2 2 5 4 40.97 2.98 2.2031 -4 0 6 2 41.22 12.65 2.1903 -1 3 4 4 41.83 12.95 2.1596 3 3 2 4 41.95 1.04 2.1537 0 2 6 4 42.35 8.65 2.1342 1 3 4 4 42.37 1.24 2.1335 -1 1 7 4 43.13 8.14 2.0976 -4 2 5 4 43.17 4.23 2.0955 6 0 2 2 43.27 5.03 2.0907 -6 0 4 2 44.30 3.82 2.0449 1 1 7 4 44.36 2.86 2.0419 3 3 3 4 44.42 4.05 2.0393 -3 3 4 4 44.60 1.33 2.0317 3 1 6 4 44.71 7.02 2.0270 -3 1 7 4 44.98 2.81 2.0153 5 1 4 4 45.33 8.92 2.0005 0 4 0 2 45.58 3.04 1.9903 -6 2 1 4 45.74 3.29 1.9837 0 4 1 4 46.00 4.60 1.9731 -6 2 2 4 46.22 3.85 1.9641 1 3 5 4 47.15 8.46 1.9277 6 2 1 4 47.21 9.42 1.9252 -6 2 3 4 47.31 3.93 1.9213 0 2 7 4 47.43 8.06 1.9166 0 0 8 2 47.51 3.12 1.9139 -2 2 7 4 47.58 7.53 1.9111 3 3 4 4 47.62 3.63 1.9094 -7 1 1 4 47.65 1.93 1.9084 -3 3 5 4 47.72 4.18 1.9058 5 3 0 4 47.90 2.00 1.8990 -7 1 2 4 48.01 1.53 1.8951 -5 3 2 4 48.34 4.11 1.8827 -1 1 8 4 48.41 2.64 1.8803 4 2 5 4 48.41 4.31 1.8801 -2 4 2 4 48.74 1.19 1.8682 5 3 1 4 48.89 2.48 1.8629 0 4 3 4 48.95 1.21 1.8606 -7 1 3 4 49.19 8.76 1.8524 5 1 5 4 49.39 2.10 1.8451 7 1 1 4 49.42 5.04 1.8443 2 4 2 4 49.70 2.27 1.8344 -6 0 6 2 50.08 6.21 1.8215 -2 4 3 4 50.11 2.90 1.8205 3 1 7 4 50.50 1.65 1.8071 5 3 2 4 50.61 6.58 1.8036 1 3 6 4 51.00 6.20 1.7906 2 2 7 4 51.19 1.84 1.7845 -4 0 8 2 51.33 4.53 1.7801 -5 3 4 4 51.47 10.64 1.7756 -3 3 6 4 51.53 7.87 1.7735 0 4 4 4 52.43 1.82 1.7451 -2 4 4 4 52.92 1.24 1.7303 -2 2 8 4 53.10 6.40 1.7249 4 4 0 4 53.21 3.92 1.7214 -7 1 5 4 53.41 3.77 1.7156 -8 0 2 2 53.85 5.15 1.7026 8 0 0 2 54.03 3.81 1.6971 7 1 3 4 54.52 1.91 1.6830 -1 1 9 4 55.69 4.38 1.6506 -5 1 8 4 55.70 1.21 1.6503 3 3 6 4 55.79 1.04 1.6477 -3 3 7 4 55.81 2.56 1.6471 -8 0 4 2 55.90 1.07 1.6447 3 1 8 4 56.02 4.30 1.6414 5 3 4 4 56.02 2.28 1.6414 -3 1 9 4 56.30 2.08 1.6340 -7 1 6 4 56.59 2.59 1.6264 1 1 9 4 56.91 2.88 1.6181 -4 4 4 4 57.29 2.39 1.6081 7 1 4 4 58.04 1.36 1.5891 4 2 7 4 58.14 2.37 1.5867 6 0 6 2 58.30 1.69 1.5827 -7 3 1 4 58.41 5.30 1.5800 -8 2 1 4 58.48 2.99 1.5783 1 5 1 4 58.54 2.06 1.5767 -7 3 2 4 58.60 4.13 1.5754 4 0 8 2 58.72 2.74 1.5723 6 2 5 4 58.89 3.47 1.5683 -6 2 7 4 58.92 9.46 1.5675 0 2 9 4 58.92 3.19 1.5674 -1 3 8 4 58.99 2.44 1.5658 -2 4 6 4 59.66 2.85 1.5497 5 3 5 4 59.96 3.12 1.5428 -7 1 7 4 60.17 1.64 1.5379 8 2 1 4 60.37 1.23 1.5333 0 0 10 2 60.45 2.26 1.5314 4 4 4 4 60.73 2.90 1.5251 -1 5 3 4 60.84 1.78 1.5225 -8 0 6 2 60.92 3.05 1.5208 -5 1 9 4 61.43 4.24 1.5092 -3 5 1 4 61.60 5.11 1.5056 7 3 2 4 61.61 2.39 1.5055 2 4 6 4 61.76 2.58 1.5020 -4 2 9 4 61.82 2.25 1.5008 -9 1 1 4 61.84 1.93 1.5003 -6 4 2 4 62.11 1.45 1.4944 -3 1 10 4 62.45 3.52 1.4870 9 1 0 4 62.51 1.50 1.4857 -9 1 3 4 62.56 2.60 1.4848 2 2 9 4 62.74 1.46 1.4810 -4 4 6 4 62.74 2.40 1.4808 -4 0 10 2 62.84 2.53 1.4789 -6 4 3 4 62.91 4.54 1.4773 -8 2 5 4 63.07 2.22 1.4740 1 1 10 4 63.73 1.26 1.4602 9 1 1 4 63.82 3.03 1.4585 5 3 6 4 64.17 1.48 1.4514 2 0 10 2 64.39 2.08 1.4470 6 4 2 4 64.46 2.14 1.4454 -6 4 4 4 64.50 3.99 1.4448 8 2 3 4 65.30 6.21 1.4290 3 5 3 4 65.47 2.95 1.4257 -5 3 8 4 65.66 2.25 1.4219 3 3 8 4 65.71 1.59 1.4210 -1 5 5 4 65.77 1.59 1.4198 -3 3 9 4 66.03 3.13 1.4150 -7 3 6 4 66.60 1.09 1.4041 6 4 3 4 66.74 3.55 1.4015 1 5 5 4 66.93 1.15 1.3980 7 3 4 4 67.70 2.28 1.3840 0 4 8 4 67.79 2.74 1.3824 6 2 7 4 67.87 3.94 1.3809 -3 5 5 4 68.75 2.66 1.3654 5 5 1 4 69.21 2.53 1.3575 -5 5 3 4 69.25 2.53 1.3568 4 2 9 4 69.53 1.24 1.3520 -6 4 6 4 69.85 1.44 1.3465 -10 0 4 2 70.28 1.30 1.3394 5 1 9 4 71.05 2.95 1.3267 -2 2 11 4 71.21 2.11 1.3242 9 1 4 4 71.38 1.75 1.3214 -3 3 10 4 71.70 2.05 1.3163 9 3 0 4 72.28 1.20 1.3072 1 3 10 4 72.76 1.28 1.2998 6 4 5 4 72.94 1.60 1.2969 -1 5 7 4 72.97 2.23 1.2966 8 4 0 4 72.99 1.69 1.2962 -9 3 4 4 72.99 1.70 1.2961 -2 6 2 4 73.10 1.48 1.2945 -5 5 5 4 73.20 2.23 1.2930 -10 2 3 4 73.78 2.01 1.2842 2 6 2 4 73.89 1.86 1.2826 -7 1 10 4 74.31 1.52 1.2765 -2 6 3 4 74.72 1.83 1.2704 10 2 1 4 74.83 1.76 1.2689 9 1 5 4 75.08 1.51 1.2653 3 1 11 4 75.40 1.60 1.2606 2 2 11 4 75.50 1.09 1.2592 -4 4 9 4 76.52 1.84 1.2450 5 1 10 4 76.65 1.29 1.2432 6 4 6 4 76.99 1.47 1.2385 -8 2 9 4 77.05 1.18 1.2377 4 4 8 4 77.16 1.03 1.2363 -11 1 2 4 77.50 1.21 1.2317 -8 0 10 2 77.99 1.06 1.2251 5 5 5 4 78.67 1.18 1.2162 6 2 9 4 78.71 1.48 1.2158 3 5 7 4 78.91 3.11 1.2131 -6 2 11 4 79.04 1.51 1.2115 -8 4 6 4 79.24 1.08 1.2089 -9 1 9 4 79.29 2.38 1.2083 -5 5 7 4 79.89 1.67 1.2007 8 2 7 4 80.00 1.28 1.1993 9 3 4 4 80.75 1.74 1.1901 8 0 8 2 80.78 1.49 1.1897 -6 0 12 2 80.84 1.16 1.1890 8 4 4 4 81.85 1.93 1.1769 7 5 3 4 83.21 1.19 1.1611 -1 3 12 4 83.73 1.55 1.1552 -9 3 8 4 83.90 1.11 1.1532 11 1 3 4 84.22 2.15 1.1496 -6 6 2 4 85.09 1.04 1.1401 -11 1 7 4 85.56 1.20 1.1350 12 0 0 2 85.64 1.07 1.1342 10 2 5 4 85.91 1.89 1.1313 0 2 13 4 86.50 1.13 1.1251 6 6 2 4 86.84 1.65 1.1216 -7 5 7 4 86.87 1.22 1.1213 -4 2 13 4 87.49 1.21 1.1149 -5 3 12 4 88.98 1.25 1.1001 -12 2 1 4 89.85 1.33 1.0917 3 7 2 4 89.94 1.58 1.0909 11 3 2 4 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.