Li Mo3 O16 P3 Hoareau T, Borel M, Leclaire A, Provost J, Raveau B Materials Research Bulletin 30 (1995) 523-529 Structure and antiferromagnetic properties of a mixed valent molybdeno monophosphate of lithium _cod_database_code 1001635 _database_code_amcsd 0014371 CELL PARAMETERS: 6.3740 7.7090 12.5290 80.030 77.620 81.800 SPACE GROUP: P-1 X-RAY WAVELENGTH: 1.541838 Cell Volume: 588.670 Density (g/cm3): 3.631 MAX. ABS. INTENSITY / VOLUME**2: 14.19090816 RIR: 1.273 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 7.30 4.31 12.1039 0 0 1 2 11.73 20.02 7.5468 0 1 0 2 12.88 1.05 6.8753 0 1 1 2 14.31 1.65 6.1882 1 0 0 2 14.64 1.14 6.0519 0 0 2 2 14.76 51.57 6.0037 1 0 1 2 17.38 1.37 5.1028 0 1 2 2 17.51 4.35 5.0653 1 1 0 2 18.40 8.55 4.8211 1 0 2 2 19.52 1.29 4.5469 -1 1 0 2 19.74 75.80 4.4979 1 1 2 2 20.12 44.85 4.4143 0 -1 2 2 20.49 7.82 4.3345 1 -1 1 2 20.68 83.90 4.2944 -1 -1 1 2 21.24 61.89 4.1826 -1 1 1 2 22.03 100.00 4.0346 0 0 3 2 22.46 2.15 3.9588 -1 0 2 2 23.42 3.98 3.7986 0 1 3 2 23.58 83.38 3.7734 0 2 0 2 23.64 6.71 3.7635 0 2 1 2 23.83 49.05 3.7336 1 -1 2 2 23.87 2.80 3.7279 1 0 3 2 24.40 3.87 3.6483 1 1 3 2 25.53 1.73 3.4895 1 2 1 2 25.68 2.56 3.4684 -1 -1 2 2 25.92 52.18 3.4376 0 2 2 2 26.28 1.42 3.3913 1 2 0 2 26.54 17.56 3.3581 0 -1 3 2 28.35 31.13 3.1483 2 0 1 2 28.78 8.88 3.1024 1 -1 3 2 28.86 2.25 3.0941 2 0 0 2 29.04 1.76 3.0752 -1 2 0 2 29.52 9.17 3.0260 0 0 4 2 29.69 5.04 3.0090 0 -2 2 2 29.76 23.70 3.0019 2 0 2 2 29.81 2.49 2.9974 -1 2 1 2 29.94 44.90 2.9842 0 2 3 2 29.99 36.15 2.9799 2 1 0 2 30.00 8.11 2.9790 2 1 2 2 30.10 1.84 2.9693 1 2 3 2 30.15 1.21 2.9640 1 -2 1 2 30.16 15.46 2.9636 0 1 4 2 30.24 1.55 2.9554 1 1 4 2 30.25 2.84 2.9547 1 0 4 2 30.40 4.10 2.9399 -1 1 3 2 31.20 15.50 2.8668 -2 0 1 2 32.34 9.19 2.7680 -1 2 2 2 32.41 12.68 2.7622 2 -1 1 2 32.46 16.53 2.7586 -2 1 0 2 32.67 4.17 2.7414 -2 -1 1 2 32.68 1.10 2.7401 2 1 3 2 33.23 8.75 2.6962 -1 -2 2 2 33.49 1.08 2.6756 0 -1 4 2 34.25 25.17 2.6182 2 2 1 2 34.87 23.72 2.5731 0 -2 3 2 35.44 5.80 2.5327 2 2 0 2 35.69 9.09 2.5156 0 3 0 2 36.15 1.22 2.4846 1 3 1 2 36.55 1.48 2.4585 -1 1 4 2 36.78 18.28 2.4434 1 1 5 2 36.79 6.95 2.4428 1 3 2 2 37.07 2.86 2.4250 1 3 0 2 37.15 2.34 2.4198 1 0 5 2 37.22 1.63 2.4158 2 -1 3 2 37.30 1.96 2.4108 0 1 5 2 37.30 10.29 2.4105 2 0 4 2 37.41 2.69 2.4040 -2 1 2 2 38.39 6.55 2.3448 -1 -1 4 2 38.55 2.83 2.3354 -1 -2 3 2 39.31 2.93 2.2918 0 3 3 2 39.46 5.52 2.2836 -1 -3 1 2 39.95 6.13 2.2567 2 -2 1 2 40.02 1.72 2.2527 -2 0 3 2 40.09 14.35 2.2490 2 2 4 2 40.39 4.69 2.2329 -1 3 1 2 40.79 3.52 2.2122 0 -1 5 2 40.83 1.99 2.2103 0 -3 2 2 40.89 1.86 2.2072 0 -2 4 2 41.23 5.17 2.1895 0 2 5 2 41.29 6.01 2.1865 1 -1 5 2 41.58 5.71 2.1720 2 -1 4 2 41.82 8.20 2.1600 -2 1 3 2 41.88 4.69 2.1571 -2 -1 3 2 42.05 1.71 2.1489 -1 3 2 2 42.08 4.25 2.1472 -2 -2 2 2 42.37 3.94 2.1333 1 3 4 2 42.54 1.82 2.1251 2 3 2 2 42.67 3.09 2.1189 -1 0 5 2 43.05 4.97 2.1012 3 1 1 2 43.26 1.14 2.0913 -2 2 2 2 43.28 3.60 2.0904 -1 1 5 2 43.51 8.09 2.0800 3 0 2 2 43.81 2.17 2.0666 1 1 6 2 43.82 4.50 2.0659 2 3 0 2 43.84 5.29 2.0650 1 -3 2 2 43.94 1.86 2.0607 2 3 3 2 44.23 3.72 2.0477 3 1 0 2 44.65 2.70 2.0295 -1 -2 4 2 44.72 2.46 2.0266 3 1 3 2 44.93 13.13 2.0173 0 0 6 2 44.98 4.90 2.0154 -1 3 3 2 45.20 4.43 2.0060 0 -3 3 2 46.05 9.86 1.9709 -3 0 1 2 46.32 8.16 1.9601 3 2 2 2 46.40 2.27 1.9569 3 -1 1 2 46.59 1.64 1.9492 2 3 4 2 46.88 1.59 1.9381 2 -1 5 2 46.88 6.82 1.9379 1 3 5 2 46.92 2.73 1.9365 -3 1 0 2 46.92 2.06 1.9363 -2 2 3 2 47.03 5.86 1.9321 -2 -2 3 2 47.24 3.41 1.9242 -1 2 5 2 47.45 3.68 1.9159 3 1 4 2 47.52 1.11 1.9135 1 -3 3 2 47.52 2.10 1.9133 0 -2 5 2 47.68 1.22 1.9075 0 4 1 2 47.90 9.19 1.8993 0 2 6 2 48.23 5.71 1.8867 0 4 0 2 48.37 7.05 1.8818 0 4 2 2 48.40 5.48 1.8808 1 -2 5 2 48.78 1.56 1.8668 2 -2 4 2 48.86 1.30 1.8639 2 0 6 2 49.01 3.96 1.8586 -1 3 4 2 49.12 4.55 1.8548 -2 3 0 2 49.15 1.02 1.8537 3 -1 3 2 49.67 1.78 1.8356 2 -3 1 2 49.79 4.77 1.8313 -2 3 1 2 50.00 1.09 1.8241 2 2 6 2 50.27 2.63 1.8148 0 4 3 2 50.48 1.13 1.8080 -1 1 6 2 50.48 8.11 1.8079 -3 -2 1 2 51.35 1.94 1.7793 -1 -2 5 2 51.41 3.30 1.7774 2 -3 2 2 51.57 1.34 1.7721 -2 2 4 2 52.14 1.10 1.7543 -1 4 1 2 52.27 1.00 1.7502 3 -1 4 2 52.27 1.29 1.7501 1 3 6 2 52.32 1.12 1.7486 -2 0 5 2 52.38 3.49 1.7468 3 0 5 2 52.44 2.02 1.7448 2 4 2 2 52.52 3.63 1.7423 0 1 7 2 52.69 1.97 1.7373 2 4 1 2 52.92 3.17 1.7302 0 -4 2 2 52.95 3.50 1.7291 0 0 7 2 53.12 2.47 1.7242 3 3 3 2 53.21 2.55 1.7214 3 2 5 2 53.23 1.65 1.7208 -1 4 2 2 53.32 2.13 1.7181 -1 -3 4 2 53.46 1.10 1.7140 1 -4 1 2 53.64 4.16 1.7088 3 -2 2 2 54.08 2.40 1.6956 2 4 0 2 54.22 5.07 1.6918 -3 2 1 2 54.33 3.11 1.6884 3 3 0 2 54.41 1.20 1.6861 2 1 7 2 54.42 1.67 1.6860 -1 -4 2 2 54.62 4.09 1.6802 -2 3 3 2 54.66 3.39 1.6791 0 -2 6 2 54.77 3.04 1.6761 -2 -3 3 2 55.02 2.34 1.6689 1 -2 6 2 55.42 6.63 1.6580 2 4 4 2 55.61 3.21 1.6526 2 0 7 2 55.79 1.04 1.6477 1 4 5 2 55.81 1.31 1.6472 1 -4 2 2 56.13 5.36 1.6387 2 2 7 2 56.38 1.79 1.6319 3 -1 5 2 56.51 1.50 1.6285 0 -3 5 2 56.58 2.27 1.6266 -2 -4 1 2 56.67 1.47 1.6243 -3 2 2 2 56.84 1.27 1.6199 0 -4 3 2 57.32 5.93 1.6075 0 4 5 2 57.33 1.48 1.6070 3 0 6 2 57.67 2.22 1.5986 1 -3 5 2 58.09 1.47 1.5879 -1 1 7 2 58.13 2.79 1.5870 2 -3 4 2 58.31 10.86 1.5823 4 1 1 2 58.67 1.76 1.5736 4 0 1 2 58.85 1.23 1.5692 3 -2 4 2 58.89 3.27 1.5683 -3 0 4 2 59.03 8.22 1.5647 1 1 8 2 59.19 2.05 1.5609 1 -4 3 2 59.36 1.08 1.5569 -2 0 6 2 59.56 1.08 1.5521 -1 -3 5 2 59.61 3.24 1.5510 2 -1 7 2 59.70 2.06 1.5488 4 0 3 2 59.96 3.93 1.5428 -2 1 6 2 60.06 1.84 1.5405 1 0 8 2 60.08 1.85 1.5399 -2 -4 2 2 60.18 1.11 1.5376 -3 -1 4 2 60.32 2.04 1.5345 0 3 7 2 60.44 1.93 1.5318 1 5 2 2 60.71 5.10 1.5254 4 1 4 2 60.72 2.06 1.5252 3 4 2 2 60.75 1.30 1.5247 4 2 3 2 60.92 1.23 1.5207 -1 -1 7 2 61.04 2.30 1.5180 0 5 2 2 61.37 2.22 1.5106 3 -1 6 2 61.43 3.04 1.5094 0 5 0 2 61.43 1.51 1.5093 1 5 3 2 61.52 4.62 1.5074 -2 -1 6 2 61.78 4.98 1.5017 4 -1 1 2 61.89 5.86 1.4993 3 3 6 2 62.22 3.48 1.4921 0 4 6 2 62.27 1.32 1.4909 0 -2 7 2 62.43 1.72 1.4875 0 5 3 2 62.65 1.64 1.4828 3 4 4 2 62.88 1.22 1.4780 2 -3 5 2 62.89 3.26 1.4778 -1 4 5 2 62.93 1.66 1.4770 3 -2 5 2 63.19 1.59 1.4714 0 -3 6 2 63.20 1.87 1.4714 0 -5 1 2 63.27 1.80 1.4697 4 -1 3 2 63.77 2.46 1.4595 1 -1 8 2 63.79 1.69 1.4590 -1 -5 1 2 64.15 1.42 1.4518 -3 3 2 2 64.15 3.88 1.4518 -3 -2 4 2 64.32 1.02 1.4483 2 5 1 2 64.49 1.03 1.4448 3 -3 3 2 64.50 1.37 1.4446 -2 -4 3 2 64.50 4.49 1.4446 -3 2 4 2 64.94 1.83 1.4360 4 2 5 2 65.15 1.69 1.4319 3 4 5 2 65.16 2.31 1.4317 1 3 8 2 65.21 1.15 1.4307 -1 5 0 2 65.46 3.51 1.4258 -4 -1 2 2 65.55 1.25 1.4240 4 -1 4 2 65.69 3.43 1.4215 -3 -4 1 2 65.76 3.15 1.4201 4 3 1 2 66.10 1.12 1.4137 2 -2 7 2 66.27 1.98 1.4104 -2 -2 6 2 66.40 2.31 1.4079 -1 0 8 2 66.44 1.28 1.4071 -1 -3 6 2 66.48 1.78 1.4065 1 5 5 2 66.57 1.68 1.4047 4 3 4 2 67.26 1.75 1.3919 0 -4 5 2 67.30 1.84 1.3913 -4 1 2 2 67.34 1.69 1.3906 -1 5 3 2 67.48 2.42 1.3879 2 4 7 2 67.62 1.30 1.3855 3 -3 4 2 68.47 2.46 1.3704 -1 2 8 2 68.65 1.71 1.3671 1 -4 5 2 69.06 2.22 1.3600 -2 3 6 2 69.25 3.10 1.3568 -1 -1 8 2 69.30 1.39 1.3559 -3 -4 2 2 69.51 1.00 1.3524 -4 2 1 2 69.54 1.16 1.3519 3 0 8 2 69.66 2.30 1.3499 0 -5 3 2 70.97 1.42 1.3280 -1 -5 3 2 71.17 2.19 1.3248 3 5 3 2 71.65 1.10 1.3171 3 -4 1 2 72.04 2.02 1.3110 -3 4 1 2 72.72 2.11 1.3003 -2 5 1 2 73.63 1.70 1.2866 0 -4 6 2 73.88 1.39 1.2828 -4 -3 2 2 74.76 1.19 1.2698 2 -3 7 2 74.89 2.21 1.2679 3 1 9 2 75.15 1.62 1.2642 4 4 5 2 75.40 3.03 1.2607 2 -5 2 2 75.71 1.16 1.2563 -4 1 4 2 76.17 1.18 1.2498 5 2 3 2 76.69 1.06 1.2426 3 0 9 2 76.71 1.32 1.2423 2 6 2 2 76.87 1.65 1.2402 -4 3 1 2 77.48 1.86 1.2320 3 5 6 2 77.58 1.47 1.2306 4 -3 3 2 77.95 1.11 1.2256 4 -1 7 2 78.21 1.28 1.2223 4 2 8 2 78.31 1.01 1.2209 3 -4 4 2 78.68 1.26 1.2162 5 2 0 2 78.68 1.20 1.2161 3 3 9 2 78.85 5.11 1.2139 -3 0 7 2 79.21 1.15 1.2093 2 -4 6 2 79.39 1.60 1.2070 -1 6 0 2 81.20 1.12 1.1846 -4 1 5 2 81.49 1.37 1.1812 -2 -6 1 2 81.59 1.03 1.1799 -4 -4 2 2 82.52 1.47 1.1690 -3 2 7 2 82.63 1.01 1.1677 -2 -4 6 2 84.07 1.62 1.1513 3 6 1 2 85.29 1.19 1.1380 1 1 11 2 85.33 1.36 1.1375 4 -4 1 2 86.22 1.06 1.1281 -4 3 4 2 87.47 1.11 1.1152 3 -2 9 2 87.96 1.67 1.1102 4 -3 6 2 88.85 1.28 1.1013 1 -4 8 2 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.