Na3Al3(AsO4)3 Masquelier C, d'Yvoire F, Collin G Journal of Solid State Chemistry 118 (1995) 33-42 Crystal structure of Na7Fe4(AsO4)6 and alpha-Na3Al2(AsO4)3, two sodium ion conductors structurally related to II-Na3Fe2(AsO4)3 Locality: synthetic _database_code_amcsd 0019958 CELL PARAMETERS: 14.5760 13.4090 9.7280 90.000 96.950 90.000 SPACE GROUP: C2 X-RAY WAVELENGTH: 1.541838 Cell Volume: 1887.363 Density (g/cm3): 3.798 MAX. ABS. INTENSITY / VOLUME**2: 9.891616937 RIR: 0.848 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 9.16 1.30 9.6565 0 0 1 2 12.23 45.60 7.2344 2 0 0 2 12.31 70.29 7.1925 -1 1 1 2 13.21 1.71 6.7045 0 2 0 1 13.37 6.48 6.6235 1 1 1 2 16.09 2.16 5.5073 0 2 1 2 18.04 1.65 4.9175 2 2 0 2 19.56 19.51 4.5383 3 1 0 2 19.57 19.92 4.5355 -2 2 1 2 19.81 13.40 4.4824 -1 1 2 2 20.66 20.45 4.3001 -3 1 1 2 20.80 43.60 4.2705 1 3 0 2 20.85 5.39 4.2611 -2 0 2 2 20.94 63.30 4.2432 2 2 1 2 21.16 43.67 4.1997 1 1 2 2 22.46 10.60 3.9583 -1 3 1 2 22.58 15.54 3.9383 3 1 1 2 22.70 12.09 3.9180 0 2 2 2 23.07 13.74 3.8551 1 3 1 2 23.36 4.71 3.8088 2 0 2 2 24.76 3.69 3.5963 -2 2 2 2 26.59 26.99 3.3523 0 4 0 1 26.92 54.97 3.3117 2 2 2 2 28.01 27.41 3.1851 -3 3 1 2 28.03 26.37 3.1835 4 2 0 2 28.18 17.82 3.1669 0 4 1 2 28.39 14.46 3.1436 1 3 2 2 28.46 27.81 3.1364 -1 1 3 2 28.48 14.18 3.1336 3 1 2 2 29.00 41.91 3.0792 -4 0 2 2 29.36 2.35 3.0416 2 4 0 2 29.49 3.22 3.0294 3 3 1 2 29.91 4.79 2.9874 1 1 3 2 30.36 22.68 2.9443 -2 4 1 2 30.49 13.71 2.9320 4 2 1 2 30.81 23.73 2.9017 0 2 3 2 31.63 100.00 2.8287 5 1 0 2 31.70 97.18 2.8222 -3 3 2 2 31.90 2.04 2.8056 -5 1 1 2 31.95 90.73 2.8008 -2 2 3 2 32.21 1.07 2.7791 -3 1 3 2 34.00 14.97 2.6369 1 5 0 2 34.03 5.47 2.6347 -2 4 2 2 34.06 8.92 2.6319 5 1 1 2 34.28 8.03 2.6158 -1 3 3 2 34.30 10.62 2.6141 3 3 2 2 34.54 13.66 2.5971 2 2 3 2 35.49 25.60 2.5296 1 5 1 2 35.68 27.77 2.5164 2 4 2 2 36.00 26.49 2.4949 3 1 3 2 36.55 5.69 2.4587 4 4 0 2 36.98 16.21 2.4310 -4 4 1 2 37.01 16.21 2.4291 5 3 0 2 37.25 5.16 2.4141 0 0 4 2 37.51 1.72 2.3975 -3 3 3 2 37.63 14.48 2.3905 -1 1 4 2 38.54 3.22 2.3360 -1 5 2 2 38.75 3.34 2.3237 5 1 2 2 38.78 2.66 2.3218 0 4 3 2 39.01 4.02 2.3090 -3 5 1 2 39.15 4.87 2.3011 5 3 1 2 39.68 3.61 2.2714 0 2 4 2 39.72 1.52 2.2692 6 2 0 2 39.75 2.65 2.2677 -4 4 2 2 39.81 1.12 2.2643 -5 3 2 2 40.12 2.86 2.2476 3 5 1 2 40.24 1.94 2.2412 -2 2 4 2 40.36 4.16 2.2348 0 6 0 1 40.81 3.94 2.2111 2 0 4 2 40.87 8.27 2.2078 3 3 3 2 41.47 9.13 2.1773 0 6 1 2 41.89 7.93 2.1566 2 4 3 2 41.99 6.02 2.1518 4 2 3 2 44.68 2.10 2.0281 0 6 2 2 44.92 1.00 2.0181 1 5 3 2 45.10 3.39 2.0102 5 1 3 2 46.13 3.10 1.9677 -7 1 2 2 46.25 2.39 1.9629 -6 2 3 2 46.34 4.01 1.9592 -5 5 1 2 46.38 2.44 1.9576 6 4 0 2 46.48 3.76 1.9540 -5 1 4 2 47.15 28.04 1.9275 2 6 2 2 47.21 2.31 1.9253 -1 1 5 2 47.76 13.84 1.9044 4 0 4 2 47.84 14.06 1.9012 4 6 0 2 47.90 4.82 1.8990 1 7 0 2 47.95 16.23 1.8971 5 5 1 2 48.19 5.79 1.8883 -4 6 1 2 48.34 5.59 1.8829 6 4 1 2 48.40 5.85 1.8807 4 4 3 2 48.64 4.68 1.8718 3 3 4 2 48.80 11.59 1.8663 1 1 5 2 49.09 6.87 1.8558 0 2 5 2 49.93 11.96 1.8265 -7 1 3 2 50.13 6.32 1.8198 -6 0 4 2 50.46 4.54 1.8086 8 0 0 2 50.77 7.74 1.7981 -4 4 4 2 51.32 1.22 1.7803 3 7 0 2 51.60 1.72 1.7714 5 5 2 2 51.80 3.73 1.7649 -3 7 1 2 52.08 1.56 1.7562 -6 2 4 2 52.11 2.96 1.7551 6 4 2 2 52.13 4.76 1.7546 -8 2 1 2 52.25 5.56 1.7507 -6 4 3 2 52.30 1.07 1.7493 2 2 5 2 52.71 2.35 1.7366 1 3 5 2 52.76 4.49 1.7352 -4 2 5 2 53.69 8.67 1.7071 -8 2 2 2 53.79 8.48 1.7043 -7 3 3 2 54.10 19.37 1.6951 -3 7 2 2 54.25 7.72 1.6908 -5 1 5 2 54.37 19.74 1.6873 7 3 2 2 54.47 1.38 1.6846 -4 6 3 2 54.48 1.74 1.6842 8 2 1 2 54.86 17.02 1.6734 0 4 5 2 55.01 1.69 1.6693 -2 4 5 2 55.66 2.36 1.6514 0 8 1 2 55.82 1.60 1.6471 -1 7 3 2 56.07 8.86 1.6402 -7 5 1 2 56.11 7.54 1.6392 6 6 0 2 56.14 1.85 1.6384 7 1 3 2 56.29 2.32 1.6343 3 5 4 2 56.34 2.93 1.6329 2 8 0 2 56.40 1.71 1.6315 5 3 4 2 56.51 2.00 1.6285 -2 6 4 2 56.67 1.06 1.6243 1 7 3 2 56.83 2.44 1.6202 5 5 3 2 56.94 1.54 1.6173 -2 8 1 2 57.10 5.26 1.6129 -2 0 6 2 57.24 3.39 1.6094 0 0 6 2 57.33 1.94 1.6072 3 3 5 2 57.45 1.15 1.6041 6 4 3 2 57.50 1.41 1.6028 2 8 1 2 57.72 3.94 1.5973 5 7 0 2 57.76 1.07 1.5962 9 1 0 2 57.82 3.29 1.5946 6 6 1 2 57.84 2.80 1.5941 2 4 5 2 58.04 1.12 1.5892 7 5 1 2 58.48 1.29 1.5783 4 2 5 2 58.70 3.20 1.5729 -9 1 2 2 58.90 3.04 1.5679 1 1 6 2 58.94 3.52 1.5671 -7 3 4 2 59.15 10.61 1.5620 -8 4 2 2 59.19 3.23 1.5611 -6 2 5 2 59.24 4.57 1.5598 -2 8 2 2 59.71 6.02 1.5486 7 3 3 2 59.85 1.55 1.5453 9 1 1 2 59.99 3.28 1.5421 -4 6 4 2 59.99 4.01 1.5420 1 5 5 2 60.02 5.58 1.5413 -4 0 6 2 60.27 3.59 1.5355 -3 5 5 2 60.33 1.03 1.5341 2 8 2 2 60.90 2.65 1.5213 -9 3 1 2 60.92 1.14 1.5208 4 8 0 2 60.99 2.62 1.5193 -7 5 3 2 61.76 2.63 1.5022 -4 2 6 2 62.14 1.64 1.4937 2 2 6 2 62.18 2.58 1.4929 -9 3 2 2 62.25 1.81 1.4913 -8 4 3 2 62.47 1.09 1.4866 0 8 3 2 62.98 1.83 1.4759 -5 1 6 2 63.14 6.89 1.4725 -2 8 3 2 63.16 2.13 1.4722 -4 8 2 2 63.37 3.29 1.4676 -1 9 1 2 63.45 1.18 1.4660 8 4 2 2 63.51 6.87 1.4648 8 2 3 2 63.68 6.81 1.4613 0 6 5 2 64.12 3.09 1.4523 6 4 4 2 64.19 2.06 1.4509 0 4 6 2 64.27 3.46 1.4493 3 5 5 2 64.39 9.88 1.4469 10 0 0 2 64.81 17.82 1.4385 -5 5 5 2 65.58 1.13 1.4235 3 9 0 2 66.19 4.27 1.4119 1 9 2 2 66.65 4.01 1.4032 3 7 4 2 66.83 1.42 1.3999 3 3 6 2 67.13 3.47 1.3945 6 2 5 2 67.14 1.23 1.3942 5 7 3 2 67.63 8.22 1.3853 -9 5 1 2 67.63 8.48 1.3853 -8 6 2 2 67.93 2.26 1.3798 -7 7 2 2 67.99 2.10 1.3789 9 5 0 2 68.10 1.15 1.3768 0 8 4 2 68.49 1.90 1.3700 -2 8 4 2 68.70 2.00 1.3662 9 1 3 2 68.78 1.77 1.3650 -1 7 5 2 68.84 7.73 1.3638 -3 1 7 2 69.20 1.75 1.3576 -2 2 7 2 69.34 2.09 1.3552 -10 2 3 2 69.47 1.43 1.3531 -9 3 4 2 69.49 1.30 1.3526 -1 9 3 2 69.51 2.46 1.3524 3 9 2 2 69.72 3.28 1.3488 4 8 3 2 69.95 2.22 1.3448 -7 1 6 2 70.04 1.82 1.3434 1 7 5 2 70.10 1.53 1.3424 8 2 4 2 70.19 10.07 1.3409 0 10 0 1 70.68 2.76 1.3327 5 1 6 2 70.95 2.08 1.3284 10 4 0 2 70.95 1.79 1.3284 -7 7 3 2 70.96 1.50 1.3282 0 10 1 2 71.18 19.10 1.3247 5 5 5 2 71.18 6.81 1.3246 5 9 0 2 71.46 7.24 1.3202 7 7 2 2 71.54 1.45 1.3189 -10 4 2 2 71.60 1.63 1.3180 -9 5 3 2 71.86 1.98 1.3138 4 6 5 2 71.98 1.32 1.3119 6 4 5 2 72.06 1.84 1.3106 -3 3 7 2 72.09 1.43 1.3101 -9 1 5 2 72.57 2.90 1.3027 5 9 1 2 72.58 1.07 1.3025 2 10 1 2 72.61 1.20 1.3021 -5 1 7 2 72.70 5.87 1.3007 2 2 7 2 72.73 3.03 1.3001 6 8 2 2 72.85 1.99 1.2983 -6 8 3 2 72.96 2.13 1.2967 10 4 1 2 73.99 1.97 1.2811 -2 4 7 2 74.07 2.38 1.2799 3 1 7 2 74.74 2.28 1.2701 -1 9 4 2 75.03 2.40 1.2659 0 8 5 2 75.20 1.87 1.2635 9 1 4 2 75.32 2.12 1.2618 11 3 0 2 75.43 2.94 1.2602 -7 7 4 2 76.32 2.44 1.2477 -4 4 7 2 77.67 3.96 1.2294 -4 10 2 2 77.87 1.02 1.2267 11 1 2 2 77.96 1.04 1.2255 -4 8 5 2 78.07 1.05 1.2241 -11 3 3 2 78.20 4.04 1.2224 9 5 3 2 78.73 1.03 1.2155 -8 8 2 2 78.80 1.22 1.2146 10 6 0 2 78.87 2.94 1.2136 -11 1 4 2 79.04 2.74 1.2114 -10 2 5 2 79.04 3.49 1.2114 1 5 7 2 79.29 2.69 1.2082 -9 1 6 2 79.37 1.29 1.2072 -10 6 2 2 80.33 1.03 1.1952 -2 2 8 2 80.46 1.05 1.1937 7 5 5 2 80.55 1.71 1.1925 -7 9 2 2 80.74 2.04 1.1902 10 6 1 2 81.81 1.25 1.1773 -3 11 1 2 82.21 1.17 1.1726 -1 3 8 2 82.54 1.10 1.1687 8 4 5 2 82.60 1.08 1.1681 8 6 4 2 83.35 1.13 1.1594 3 5 7 2 83.38 4.31 1.1591 -12 2 3 2 83.64 3.86 1.1561 -10 4 5 2 84.21 1.23 1.1498 -11 5 3 2 84.21 3.57 1.1498 -8 2 7 2 84.92 1.35 1.1420 -12 4 1 2 85.05 1.52 1.1406 -9 7 4 2 86.27 1.80 1.1276 -5 3 8 2 86.67 1.54 1.1234 5 11 0 2 86.81 1.31 1.1219 12 2 2 2 86.83 1.56 1.1217 -5 9 5 2 87.17 1.51 1.1182 8 8 3 2 87.26 1.99 1.1173 -13 1 1 2 87.79 1.96 1.1119 -8 6 6 2 88.12 1.87 1.1086 -7 5 7 2 88.61 1.53 1.1037 3 3 8 2 89.10 1.63 1.0989 3 11 3 2 89.36 1.21 1.0964 4 10 4 2 89.51 1.31 1.0949 2 12 1 2 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.