K(H2O)In(H1.5AsO4)2(H2AsO4) Schwendtner K, Kolitsch U European Journal of Mineralogy 19 (2007) 399-409 Two new structure types: KFe3(AsO4)2(HAsO4)2 and K(H2O)M3+(H1.5AsO4)2(H2AsO4) (M3+ = Fe, Ga, In) - synthesis, crystal structure and spectroscopy _database_code_amcsd 0007223 CELL PARAMETERS: 4.7980 8.8320 13.9710 90.000 94.680 90.000 SPACE GROUP: P2/n X-RAY WAVELENGTH: 1.541838 Cell Volume: 590.060 Density (g/cm3): 3.341 MAX. ABS. INTENSITY / VOLUME**2: 39.24168639 RIR: 3.824 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 10.02 1.91 8.8320 0 1 0 2 11.87 100.00 7.4582 0 1 1 4 12.71 21.87 6.9622 0 0 2 2 16.21 25.66 5.4677 0 1 2 4 19.13 3.98 4.6405 -1 0 1 2 20.11 3.38 4.4160 0 2 0 2 21.11 9.06 4.2094 0 2 1 4 21.63 2.84 4.1087 0 1 3 4 22.52 2.19 3.9480 1 1 1 4 23.86 1.31 3.7291 0 2 2 4 23.92 12.53 3.7196 -1 1 2 4 25.52 28.90 3.4904 1 1 2 4 25.59 3.84 3.4811 0 0 4 2 25.63 13.56 3.4753 -1 0 3 2 27.49 32.75 3.2443 1 2 0 4 27.54 14.95 3.2386 0 1 4 4 27.58 14.19 3.2340 -1 1 3 4 27.86 15.20 3.2026 1 0 3 2 27.89 9.63 3.1993 0 2 3 4 27.89 3.91 3.1990 -1 2 1 4 28.59 13.60 3.1217 1 2 1 4 29.67 12.58 3.0107 1 1 3 4 29.73 5.14 3.0050 -1 2 2 4 30.36 3.89 2.9440 0 3 0 2 31.05 5.10 2.8803 0 3 1 4 32.18 10.22 2.7813 -1 1 4 4 32.79 31.88 2.7310 -1 2 3 4 33.04 1.23 2.7115 0 3 2 4 33.75 1.32 2.6560 0 1 5 4 34.60 1.70 2.5926 1 2 3 4 34.61 13.27 2.5917 1 1 4 4 36.13 6.08 2.4861 0 3 3 4 36.13 9.76 2.4859 -1 3 1 4 37.61 2.71 2.3916 -1 3 2 4 37.62 6.12 2.3910 2 0 0 2 38.80 4.22 2.3207 0 0 6 2 38.81 1.65 2.3203 -2 0 2 2 39.06 4.79 2.3063 -2 1 1 4 41.55 4.77 2.1734 -1 2 5 4 41.67 1.53 2.1674 1 3 3 4 42.21 2.76 2.1409 2 1 2 4 43.04 1.47 2.1014 -2 2 1 4 44.01 5.47 2.0576 1 2 5 4 44.09 1.82 2.0540 -2 2 2 4 44.80 3.23 2.0231 0 3 5 4 45.23 1.76 2.0046 1 4 0 4 45.41 2.38 1.9974 -2 1 4 4 45.49 6.72 1.9939 0 4 3 4 45.49 2.70 1.9938 -1 4 1 4 46.10 2.00 1.9691 -2 2 3 4 46.81 4.30 1.9406 0 1 7 4 46.85 3.38 1.9390 -1 2 6 4 47.88 1.80 1.8999 2 0 4 2 48.82 1.45 1.8656 2 2 3 4 48.84 4.73 1.8646 0 4 4 4 49.05 2.18 1.8574 2 1 4 4 49.11 1.81 1.8552 -2 3 1 4 49.54 4.46 1.8399 1 2 6 4 49.98 1.38 1.8248 1 3 5 4 49.99 3.02 1.8247 2 3 1 4 51.77 2.65 1.7657 2 3 2 4 51.88 3.12 1.7622 -2 3 3 4 52.58 1.66 1.7406 0 0 8 2 52.62 1.37 1.7393 -1 2 7 4 52.67 4.08 1.7377 -2 0 6 2 52.92 1.52 1.7302 0 4 5 4 53.53 1.68 1.7120 2 1 5 4 54.39 3.32 1.6869 2 3 3 4 54.54 1.74 1.6826 -2 3 4 4 55.45 4.89 1.6570 1 5 0 4 55.68 1.35 1.6509 0 5 3 4 55.77 1.79 1.6482 0 3 7 4 56.74 1.13 1.6223 -1 5 2 4 57.56 4.32 1.6013 2 0 6 2 57.57 1.14 1.6011 2 4 1 4 57.94 4.02 1.5918 -1 3 7 4 57.94 2.06 1.5917 -2 3 5 4 58.80 1.27 1.5704 -1 2 8 4 58.85 1.73 1.5691 -2 1 7 4 59.20 1.78 1.5608 2 4 2 4 59.30 3.25 1.5584 -2 4 3 4 60.65 2.05 1.5268 1 3 7 4 61.60 2.62 1.5056 2 4 3 4 61.64 2.22 1.5046 3 1 2 4 61.74 2.21 1.5025 -2 4 4 4 61.87 1.20 1.4997 -2 2 7 4 61.89 1.42 1.4993 3 2 0 4 62.85 2.40 1.4787 3 2 1 4 63.01 2.67 1.4752 -3 1 4 4 63.49 1.76 1.4652 -2 0 8 2 63.75 1.03 1.4599 -3 2 3 4 64.90 1.44 1.4367 -2 4 5 4 66.57 1.87 1.4048 -3 3 1 4 67.06 1.19 1.3957 3 2 3 4 68.34 1.45 1.3726 1 6 2 4 68.51 1.45 1.3696 0 3 9 4 68.64 1.28 1.3674 1 2 9 4 68.66 1.65 1.3669 -1 5 6 4 69.58 2.65 1.3511 -1 1 10 4 70.80 3.06 1.3308 1 5 6 4 73.08 1.01 1.2948 -3 4 1 4 73.16 1.54 1.2936 1 6 4 4 74.95 1.28 1.2671 0 4 9 4 75.53 1.01 1.2587 0 3 10 4 78.57 1.02 1.2175 3 3 5 4 81.30 1.21 1.1834 3 5 0 4 88.13 1.31 1.1085 0 7 6 4 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.