Fe2 O13 V4 Permer L, Laligant Y European Journal of Solid State and Inorganic Chemistry 34 (1997) 41-52 Crystal structure of the tetrapolyvanadate Fe2 V4 O13 _cod_database_code 1000431 _database_code_amcsd 0012606 CELL PARAMETERS: 8.3125 9.4055 14.5768 90.000 102.231 90.000 SPACE GROUP: P2_1/c X-RAY WAVELENGTH: 1.541838 Cell Volume: 1113.792 Density (g/cm3): 3.121 MAX. ABS. INTENSITY / VOLUME**2: 11.84138051 RIR: 1.235 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 10.89 2.24 8.1238 1 0 0 2 11.27 2.07 7.8491 0 1 1 4 12.43 97.84 7.1230 0 0 2 2 14.41 14.67 6.1480 1 1 0 4 14.70 8.62 6.0259 -1 0 2 2 14.75 6.77 6.0060 -1 1 1 4 15.61 4.12 5.6784 0 1 2 4 16.60 3.75 5.3418 1 1 1 4 17.48 2.47 5.0739 -1 1 2 4 18.87 29.29 4.7028 0 2 0 2 19.88 2.08 4.4657 0 2 1 4 20.54 8.30 4.3238 1 1 2 4 20.96 1.25 4.2390 0 1 3 4 21.74 16.72 4.0886 -1 1 3 4 21.84 3.54 4.0700 1 2 0 4 21.88 6.23 4.0619 2 0 0 2 22.07 4.97 4.0280 -1 2 1 4 22.66 100.00 3.9246 0 2 2 4 22.79 1.57 3.9021 -2 0 2 2 23.36 9.15 3.8081 1 2 1 4 23.86 57.03 3.7290 2 1 0 4 24.00 9.29 3.7074 -1 2 2 4 24.70 69.25 3.6043 -2 1 2 4 25.08 3.08 3.5501 -1 0 4 2 25.85 1.35 3.4470 2 1 1 4 26.35 1.80 3.3825 1 2 2 4 26.77 88.41 3.3307 0 1 4 4 26.84 4.18 3.3214 -1 1 4 4 27.30 7.25 3.2663 -1 2 3 4 28.71 2.48 3.1094 -2 2 1 4 29.05 27.00 3.0740 2 2 0 4 29.11 22.10 3.0676 2 1 2 4 29.75 21.93 3.0030 -2 2 2 4 30.40 10.29 2.9399 1 2 3 4 30.73 23.27 2.9092 -1 3 1 4 31.17 3.96 2.8693 -2 1 4 4 31.51 32.17 2.8392 0 2 4 4 31.70 5.72 2.8230 1 3 1 4 32.45 6.31 2.7594 -1 1 5 4 32.80 1.40 2.7306 -3 0 2 2 32.84 1.41 2.7268 0 1 5 4 33.08 1.63 2.7079 3 0 0 2 33.55 22.33 2.6709 2 2 2 4 33.73 17.14 2.6573 -3 1 1 4 34.19 3.17 2.6224 -3 1 2 4 34.27 2.02 2.6164 0 3 3 4 35.38 3.11 2.5369 -2 2 4 4 35.81 7.25 2.5073 -3 1 3 4 36.19 1.61 2.4819 2 3 0 4 36.34 1.30 2.4724 3 1 1 4 36.77 9.27 2.4440 -2 3 2 4 36.89 3.56 2.4368 0 2 5 4 36.92 8.36 2.4344 2 0 4 2 37.89 1.45 2.3743 0 0 6 2 38.11 1.13 2.3614 -3 2 2 4 38.25 6.07 2.3533 0 3 4 4 38.28 5.86 2.3514 0 4 0 2 38.36 4.24 2.3467 3 2 0 4 38.39 1.11 2.3448 -1 1 6 4 38.47 2.06 2.3403 -3 1 4 4 39.20 2.16 2.2981 3 1 2 4 39.59 3.25 2.2764 -3 2 3 4 39.71 4.16 2.2700 -2 0 6 2 39.91 1.04 2.2587 1 4 0 4 40.05 2.62 2.2514 -1 4 1 4 40.90 2.09 2.2067 -2 1 6 4 41.21 2.66 2.1905 -1 4 2 4 41.97 1.95 2.1527 -1 2 6 4 41.98 1.86 2.1519 -3 1 5 4 42.66 5.45 2.1195 0 2 6 4 42.89 1.00 2.1085 0 3 5 4 43.34 3.04 2.0880 -1 4 3 4 43.57 1.20 2.0774 2 1 5 4 43.60 1.26 2.0759 -3 3 1 4 43.68 5.99 2.0723 -4 0 2 2 43.97 3.80 2.0591 -3 3 2 4 44.19 1.03 2.0493 3 3 0 4 44.29 1.92 2.0452 -2 4 1 4 44.31 1.65 2.0443 -2 2 6 4 44.52 2.57 2.0350 2 4 0 4 44.60 3.12 2.0316 -1 1 7 4 45.01 1.19 2.0140 -2 4 2 4 45.14 3.12 2.0086 -3 0 6 2 45.30 7.02 2.0020 -3 3 3 4 45.47 3.98 1.9946 1 4 3 4 45.61 2.44 1.9891 0 1 7 4 45.70 1.72 1.9852 4 1 0 4 45.73 9.30 1.9841 3 3 1 4 46.21 1.07 1.9644 3 0 4 2 46.22 1.27 1.9643 -3 1 6 4 46.27 4.35 1.9623 0 4 4 4 47.27 1.82 1.9229 3 1 4 4 47.44 3.19 1.9163 -1 3 6 4 47.51 3.36 1.9139 -3 3 4 4 47.60 3.41 1.9104 -4 1 4 4 47.77 1.76 1.9041 2 4 2 4 47.80 2.12 1.9028 -1 2 7 4 47.97 5.13 1.8964 -4 2 2 4 48.07 4.98 1.8928 0 3 6 4 48.13 2.30 1.8906 3 3 2 4 48.33 11.14 1.8833 2 0 6 2 49.15 1.82 1.8537 -2 4 4 4 49.33 2.07 1.8472 -3 2 6 4 49.87 1.86 1.8287 -1 5 1 4 50.16 1.95 1.8187 0 5 2 4 50.20 1.93 1.8175 4 1 2 4 50.52 9.07 1.8066 -3 3 5 4 51.03 3.34 1.7896 -3 1 7 4 51.31 7.36 1.7806 3 3 3 4 51.48 1.03 1.7750 -2 0 8 2 51.90 1.39 1.7619 2 3 5 4 52.29 4.86 1.7497 0 1 8 4 52.46 1.52 1.7444 -3 4 3 4 52.67 2.36 1.7378 -1 5 3 4 53.14 1.08 1.7235 4 2 2 4 53.70 1.23 1.7069 2 5 0 4 53.97 1.05 1.6990 -1 2 8 4 54.12 1.22 1.6945 -2 5 2 4 54.24 8.32 1.6913 2 4 4 4 54.96 5.20 1.6707 0 4 6 4 55.01 3.50 1.6692 3 4 2 4 55.15 8.26 1.6653 0 2 8 4 55.47 1.21 1.6565 -4 3 4 4 55.49 2.67 1.6561 2 1 7 4 56.19 1.59 1.6369 -5 1 2 4 56.33 6.10 1.6331 -2 4 6 4 56.48 3.68 1.6292 -5 1 1 4 56.71 3.40 1.6232 -5 1 3 4 57.07 1.30 1.6138 1 3 7 4 58.57 6.38 1.5760 -1 5 5 4 58.58 3.09 1.5759 -3 3 7 4 59.09 3.36 1.5635 -3 2 8 4 59.39 6.35 1.5562 -3 5 1 4 59.42 1.63 1.5554 5 1 1 4 59.65 2.28 1.5500 3 3 5 4 59.69 1.40 1.5491 -3 5 2 4 59.72 2.59 1.5484 0 3 8 4 60.09 1.87 1.5398 -5 1 5 4 60.26 2.80 1.5357 5 2 0 4 60.33 2.76 1.5342 3 2 6 4 60.35 1.38 1.5338 4 2 4 4 60.47 4.77 1.5309 0 6 2 4 60.63 2.78 1.5273 -3 4 6 4 60.76 3.26 1.5243 -3 5 3 4 61.08 1.53 1.5171 -1 6 2 4 61.11 2.74 1.5164 3 5 1 4 61.13 1.95 1.5160 5 0 2 2 61.51 2.03 1.5075 3 4 4 4 61.56 1.33 1.5065 -4 0 8 2 61.96 1.14 1.4976 2 1 8 4 62.12 2.92 1.4941 -3 1 9 4 62.53 1.02 1.4855 -1 5 6 4 62.58 2.70 1.4843 -3 5 4 4 62.72 1.51 1.4814 -5 2 5 4 63.10 1.94 1.4734 3 5 2 4 63.26 1.47 1.4700 2 4 6 4 63.60 2.36 1.4631 -5 3 1 4 63.81 2.66 1.4587 -5 3 3 4 64.55 5.96 1.4437 2 2 8 4 64.80 2.11 1.4388 -1 3 9 4 65.00 1.83 1.4348 0 6 4 4 65.11 1.50 1.4326 -3 5 5 4 65.27 1.33 1.4295 5 1 3 4 65.43 1.10 1.4265 -2 1 10 4 65.52 2.16 1.4246 0 0 10 2 66.21 2.74 1.4115 2 6 2 4 66.32 1.49 1.4094 -5 1 7 4 67.07 2.23 1.3954 -1 5 7 4 67.33 3.06 1.3906 -2 6 4 4 67.47 2.27 1.3881 4 1 6 4 67.49 1.15 1.3877 -3 0 10 2 67.64 4.51 1.3851 -6 0 2 2 67.94 1.90 1.3797 -2 2 10 4 68.74 1.38 1.3655 2 3 8 4 68.76 1.16 1.3653 -6 0 4 2 68.79 1.61 1.3647 2 1 9 4 70.08 1.68 1.3427 -3 6 3 4 70.62 1.20 1.3337 -1 4 9 4 70.85 1.13 1.3300 -5 4 4 4 71.21 1.69 1.3242 -1 7 1 4 71.45 1.55 1.3204 0 7 2 4 71.62 1.47 1.3175 5 2 4 4 72.04 1.22 1.3110 -2 3 10 4 73.50 2.03 1.2884 -6 1 6 4 73.68 1.11 1.2858 5 1 5 4 74.15 1.05 1.2787 -3 6 5 4 74.47 1.40 1.2741 5 4 2 4 74.78 1.38 1.2696 6 1 2 4 74.97 1.40 1.2669 -3 1 11 4 75.07 1.13 1.2654 -5 1 9 4 75.64 1.80 1.2573 5 3 4 4 75.90 2.51 1.2536 -6 2 6 4 76.82 1.41 1.2409 -5 3 8 4 77.01 1.67 1.2383 -1 4 10 4 78.45 1.79 1.2191 -1 3 11 4 78.50 1.18 1.2184 0 4 10 4 79.27 1.12 1.2086 5 5 1 4 79.50 1.23 1.2056 -3 7 2 4 81.87 1.13 1.1766 0 6 8 4 81.95 1.28 1.1757 0 8 0 2 84.50 2.30 1.1466 5 5 3 4 85.19 1.23 1.1390 -3 6 8 4 85.46 1.31 1.1361 -5 5 7 4 86.10 1.31 1.1293 2 8 0 4 86.21 1.05 1.1281 5 6 0 4 86.27 1.51 1.1275 3 6 6 4 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.