Ba2 Cl F7 Ni2 Fompeyrine J, Darriet J, Maguer J, Greneche J, Courbion G, Roisnel T, Rodriguez-Carvajal J Journal of Solid State Chemistry 131 (1997) 198-214 Magnetic properties and neutron diffraction study of the chlorofluoride series Ba2 M M' F7 Cl (M, M' = Mn, Fe, Co, Ni, Zn) _cod_database_code 1000447 _database_code_amcsd 0013926 CELL PARAMETERS: 7.6020 5.7660 8.7880 90.000 106.720 90.000 SPACE GROUP: P2_1/m X-RAY WAVELENGTH: 1.541838 Cell Volume: 368.920 Density (g/cm3): 5.045 MAX. ABS. INTENSITY / VOLUME**2: 40.62102868 RIR: 2.622 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 10.51 2.42 8.4165 0 0 1 2 12.16 2.19 7.2806 1 0 0 2 19.64 14.81 4.5201 1 1 0 4 21.11 2.17 4.2082 0 0 2 2 24.45 53.82 3.6403 2 0 0 2 26.22 91.77 3.3992 0 1 2 4 26.23 85.17 3.3975 -1 1 2 4 27.36 16.65 3.2597 1 0 2 2 27.40 21.23 3.2553 -2 0 2 2 29.01 100.00 3.0782 2 1 0 4 30.68 5.75 2.9142 -1 0 3 2 31.02 45.31 2.8830 0 2 0 2 31.53 16.43 2.8376 1 1 2 4 31.56 14.23 2.8347 -2 1 2 4 31.90 1.37 2.8055 0 0 3 2 34.01 1.01 2.6361 -1 2 1 4 34.28 2.85 2.6156 -2 0 3 2 37.04 8.65 2.4269 3 0 0 2 37.83 10.19 2.3784 0 2 2 4 37.84 8.05 2.3778 -1 2 2 4 38.82 1.06 2.3199 -3 1 1 4 39.89 42.02 2.2601 2 2 0 4 40.29 23.99 2.2385 2 1 2 4 40.32 3.22 2.2368 3 1 0 4 40.33 20.47 2.2361 -3 1 2 4 40.77 4.07 2.2131 1 1 3 4 41.08 44.62 2.1970 -1 0 4 2 41.83 25.75 2.1595 1 2 2 4 41.86 30.10 2.1583 -2 2 2 4 42.99 1.31 2.1041 0 0 4 2 43.26 1.56 2.0912 2 2 1 4 45.91 1.84 1.9766 0 1 4 4 45.94 2.07 1.9753 -2 1 4 4 48.36 10.71 1.8821 1 0 4 2 48.39 8.91 1.8811 3 0 2 2 48.42 8.57 1.8798 -3 0 4 2 48.44 9.20 1.8791 -4 0 2 2 49.02 1.45 1.8583 1 3 0 4 49.04 9.78 1.8576 2 2 2 4 49.08 10.67 1.8562 -3 2 2 4 51.05 13.34 1.7892 1 1 4 4 51.11 18.62 1.7873 -3 1 4 4 52.33 10.64 1.7483 0 3 2 4 52.34 10.29 1.7481 -1 3 2 4 52.36 22.15 1.7474 -1 2 4 4 52.74 23.70 1.7357 4 1 0 4 53.95 15.21 1.6996 2 3 0 4 55.50 2.99 1.6556 1 3 2 4 55.52 2.80 1.6550 -2 3 2 4 56.46 1.18 1.6298 2 0 4 2 56.54 1.17 1.6276 -4 0 4 2 58.57 8.80 1.5760 1 2 4 4 58.59 9.34 1.5754 3 2 2 4 58.63 6.11 1.5747 -3 2 4 4 58.64 10.64 1.5743 -4 2 2 4 58.96 1.06 1.5664 -4 1 4 4 61.00 2.99 1.5189 4 0 2 2 61.06 2.83 1.5176 -5 0 2 2 61.53 5.57 1.5072 2 3 2 4 61.56 4.51 1.5065 -3 3 2 4 61.88 1.02 1.4994 1 3 3 4 64.66 11.42 1.4415 0 4 0 2 66.13 4.39 1.4131 -1 1 6 4 66.15 3.85 1.4127 -2 1 6 4 66.19 1.23 1.4119 3 2 3 4 68.89 1.01 1.3630 0 1 6 4 68.90 7.89 1.3628 3 1 4 4 68.94 1.57 1.3620 1 2 5 4 69.00 8.58 1.3611 -5 1 4 4 69.96 4.52 1.3447 1 3 4 4 70.01 6.48 1.3439 -3 3 4 4 70.01 4.90 1.3438 4 2 2 4 70.07 4.66 1.3429 -5 2 2 4 70.23 3.99 1.3402 2 4 0 4 71.37 8.10 1.3216 4 3 0 4 71.57 1.68 1.3183 1 4 2 4 71.59 2.13 1.3181 -2 4 2 4 72.76 2.65 1.2997 5 2 0 4 74.29 3.27 1.2767 1 1 6 4 74.38 2.18 1.2754 -4 1 6 4 74.89 2.31 1.2680 5 0 2 2 74.96 2.31 1.2670 -6 0 2 2 75.35 3.71 1.2614 0 2 6 4 75.40 5.36 1.2606 -3 2 6 4 76.93 1.08 1.2394 3 4 0 4 77.00 2.10 1.2384 5 1 2 4 77.07 2.67 1.2375 -6 1 2 4 78.89 1.71 1.2134 6 0 0 2 79.53 8.43 1.2052 -1 4 4 4 80.08 1.68 1.1984 2 0 6 2 80.20 1.86 1.1968 -5 0 6 2 80.97 2.05 1.1874 6 1 0 4 81.83 1.11 1.1770 0 1 7 4 83.18 1.88 1.1613 -1 3 6 4 83.20 1.67 1.1611 -2 3 6 4 84.70 2.92 1.1444 1 4 4 4 84.72 2.50 1.1442 3 4 2 4 84.74 2.30 1.1439 -3 4 4 4 84.76 2.62 1.1437 -4 4 2 4 85.76 3.86 1.1330 3 3 4 4 85.85 4.11 1.1320 -5 3 4 4 87.07 1.08 1.1192 4 2 4 4 87.15 1.16 1.1184 6 2 0 4 87.18 1.07 1.1180 -6 2 4 4 87.76 2.11 1.1122 0 5 2 4 87.77 1.90 1.1121 -1 5 2 4 88.32 1.17 1.1066 2 2 6 4 88.44 1.67 1.1054 -5 2 6 4 89.05 2.48 1.0994 2 5 0 4 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.