Cl5 D2 Fe K2 O Gabas M, Palacio F, Rodriguez-Carvajal J, Visser D Journal of Physics: Condensed Matter 7 (1995) 4725-4738 Magnetic structures of the three-dimensional Heisenberg antiferromagnets K2FeCl5*(D2O) and Rb2FeCl5*(D2O) _cod_database_code 1006099 _database_code_amcsd 0013272 CELL PARAMETERS: 13.5862 9.7087 7.0177 90.000 90.000 90.000 SPACE GROUP: Pnma X-RAY WAVELENGTH: 1.541838 Cell Volume: 925.665 Density (g/cm3): 2.363 MAX. ABS. INTENSITY / VOLUME**2: 14.71889844 RIR: 2.028 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 13.03 1.33 6.7931 2 0 0 2 15.58 45.89 5.6875 0 1 1 4 15.92 58.27 5.5659 2 1 0 4 16.90 2.35 5.2463 1 1 1 8 18.18 19.95 4.8809 2 0 1 4 18.28 3.89 4.8544 0 2 0 2 20.36 2.07 4.3608 2 1 1 8 25.89 9.59 3.4419 2 2 1 8 26.23 8.38 3.3974 1 0 2 4 26.24 5.72 3.3965 4 0 0 2 29.21 14.98 3.0573 4 0 1 4 29.83 21.41 2.9948 3 2 1 8 30.11 5.74 2.9683 2 1 2 8 30.42 9.31 2.9388 0 3 1 4 30.60 3.01 2.9216 2 3 0 4 30.66 3.15 2.9161 4 1 1 8 31.14 1.50 2.8724 1 3 1 8 31.46 9.66 2.8437 0 2 2 4 32.16 52.54 2.7834 1 2 2 8 32.16 47.46 2.7830 4 2 0 4 32.27 39.30 2.7737 3 0 2 4 33.60 2.13 2.6670 3 1 2 8 34.18 1.64 2.6232 2 2 2 8 34.68 3.29 2.5870 4 2 1 8 35.42 2.00 2.5339 5 0 1 4 36.65 1.03 2.4518 5 1 1 8 36.83 21.92 2.4405 4 0 2 4 37.04 47.26 2.4272 0 4 0 2 39.07 2.63 2.3053 1 0 3 4 40.16 1.11 2.2452 2 3 2 8 40.59 1.61 2.2224 4 3 1 8 40.80 5.61 2.2118 2 0 3 4 41.41 4.39 2.1804 4 2 2 8 41.55 4.03 2.1733 2 4 1 8 41.89 1.17 2.1565 2 1 3 8 41.92 3.44 2.1550 6 0 1 4 42.06 15.44 2.1484 5 0 2 4 43.13 7.73 2.0976 5 1 2 8 44.58 4.61 2.0323 3 1 3 8 45.46 1.17 1.9951 5 3 1 8 45.95 2.53 1.9749 1 4 2 8 45.96 2.09 1.9748 4 4 0 4 46.08 2.29 1.9696 6 2 1 8 47.59 2.51 1.9106 3 2 3 8 47.81 1.69 1.9026 6 0 2 4 47.85 5.44 1.9009 4 4 1 8 48.15 3.10 1.8897 4 1 3 8 48.65 1.78 1.8714 0 5 1 4 48.68 2.56 1.8707 7 0 1 4 48.77 2.53 1.8671 6 1 2 8 48.78 5.41 1.8670 2 5 0 4 49.93 17.20 1.8266 3 4 2 8 51.03 3.10 1.7899 5 3 2 8 51.55 3.52 1.7728 5 0 3 4 52.13 1.61 1.7544 0 0 4 2 52.19 1.17 1.7528 5 4 1 8 52.31 2.01 1.7488 3 3 3 8 52.60 5.18 1.7400 1 0 4 4 53.23 11.58 1.7209 4 4 2 8 53.50 3.59 1.7127 1 1 4 8 53.98 2.26 1.6987 2 0 4 4 53.99 5.13 1.6983 8 0 0 2 54.88 1.02 1.6729 8 1 0 4 54.93 1.93 1.6715 1 4 3 8 55.51 1.19 1.6554 4 3 3 8 55.69 2.99 1.6506 8 0 1 4 55.71 1.02 1.6500 0 2 4 4 55.78 1.29 1.6482 2 5 2 8 56.07 1.17 1.6401 6 3 2 8 56.23 1.55 1.6360 3 0 4 4 56.27 3.44 1.6348 2 4 3 8 56.56 2.86 1.6273 8 1 1 8 57.16 2.50 1.6115 6 4 1 8 57.27 9.63 1.6087 5 4 2 8 57.48 1.31 1.6034 2 2 4 8 57.49 1.15 1.6030 8 2 0 4 57.98 1.17 1.5907 3 5 2 8 59.12 2.90 1.5628 8 2 1 8 60.40 1.47 1.5325 1 3 4 8 61.97 1.26 1.4974 6 4 2 8 62.36 1.67 1.4891 3 6 1 8 62.59 2.82 1.4841 4 2 4 8 62.71 1.89 1.4817 7 4 1 8 63.24 1.77 1.4704 8 3 1 8 63.70 3.95 1.4609 1 6 2 8 63.70 3.37 1.4608 4 6 0 4 64.71 2.38 1.4405 5 5 2 8 65.16 2.82 1.4316 5 4 3 8 65.37 1.96 1.4276 7 2 3 8 65.67 1.28 1.4219 0 4 4 4 65.82 1.39 1.4189 3 5 3 8 66.07 4.40 1.4141 1 4 4 8 67.03 1.41 1.3961 1 0 5 4 67.28 1.86 1.3917 2 4 4 8 67.29 4.46 1.3915 8 4 0 4 68.62 1.27 1.3676 4 5 3 8 68.78 2.54 1.3649 8 4 1 8 69.12 1.05 1.3590 6 5 2 8 69.26 1.42 1.3566 3 4 4 8 70.64 2.16 1.3335 6 2 4 8 72.64 1.48 1.3015 7 0 4 4 73.01 1.60 1.2958 1 5 4 8 74.86 1.95 1.2684 9 0 3 4 75.61 1.09 1.2576 8 5 1 8 78.88 2.84 1.2136 0 8 0 2 79.14 1.49 1.2102 1 4 5 8 84.46 1.77 1.1470 7 4 4 8 85.43 1.50 1.1364 9 1 4 8 86.59 2.38 1.1242 9 4 3 8 87.22 1.28 1.1177 12 0 1 4 87.80 2.26 1.1118 3 8 2 8 88.06 1.28 1.1092 5 4 5 8 88.39 1.10 1.1059 4 0 6 4 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.