Ba2 Cl Co F7 Fe
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 1000449
_database_code_amcsd 0013928
CELL PARAMETERS: 7.7490 5.7710 8.9500 90.000 106.800 90.000
SPACE GROUP: P2_1/m
X-RAY WAVELENGTH: 1.541838
Cell Volume: 383.157
Density (g/cm3): 4.835
MAX. ABS. INTENSITY / VOLUME**2: 67.68373634
RIR: 4.558
RIR based on corundum from Acta Crystallographica A38 (1982) 733-739
2-THETA INTENSITY D-SPACING H K L Multiplicity
10.32 1.48 8.5680 0 0 1 2
11.93 4.47 7.4183 1 0 0 2
19.49 8.60 4.5550 1 1 0 4
20.73 1.70 4.2840 0 0 2 2
23.99 23.31 3.7091 2 0 0 2
25.90 45.47 3.4402 -1 1 2 4
25.90 54.53 3.4398 0 1 2 4
26.86 16.89 3.3187 -2 0 2 2
26.87 8.93 3.3177 1 0 2 2
28.61 67.26 3.1202 2 1 0 4
30.10 3.14 2.9685 -1 0 3 2
30.99 24.75 2.8855 0 2 0 2
31.09 5.17 2.8769 -2 1 2 4
31.09 3.16 2.8763 1 1 2 4
33.62 1.67 2.6658 -2 0 3 2
36.33 6.53 2.4728 3 0 0 2
36.33 1.47 2.4727 2 0 2 2
37.58 4.28 2.3934 -1 2 2 4
37.58 5.31 2.3932 0 2 2 4
38.17 1.05 2.3576 -3 1 1 4
39.57 17.04 2.2775 2 2 0 4
39.65 8.15 2.2734 -3 1 2 4
39.65 14.50 2.2728 2 1 2 4
40.13 1.61 2.2469 1 1 3 4
40.31 24.49 2.2375 -1 0 4 2
41.47 20.92 2.1775 -2 2 2 4
41.47 15.98 2.1772 1 2 2 4
42.19 2.29 2.1420 0 0 4 2
45.14 1.49 2.0084 -2 1 4 4
45.15 1.12 2.0081 0 1 4 4
47.45 3.40 1.9161 -3 0 4 2
47.46 3.69 1.9157 -4 0 2 2
47.46 5.46 1.9156 1 0 4 2
47.47 3.81 1.9153 3 0 2 2
48.48 7.35 1.8779 -3 2 2 4
48.48 7.53 1.8776 2 2 2 4
49.13 1.41 1.8546 4 0 0 2
50.17 13.69 1.8185 -3 1 4 4
50.18 1.97 1.8182 -4 1 2 4
50.18 8.54 1.8181 1 1 4 4
51.70 12.01 1.7682 -1 2 4 4
51.78 13.28 1.7656 4 1 0 4
52.12 4.01 1.7549 -1 3 2 4
52.12 8.01 1.7549 0 3 2 4
53.67 10.46 1.7077 2 3 0 4
55.19 1.19 1.6642 1 3 2 4
55.37 1.09 1.6594 -4 0 4 2
55.39 1.02 1.6589 2 0 4 2
57.76 2.06 1.5962 -3 2 4 4
57.77 5.23 1.5960 -4 2 2 4
57.77 3.87 1.5960 1 2 4 4
57.78 3.11 1.5958 3 2 2 4
59.78 1.80 1.5470 -5 0 2 2
59.79 2.08 1.5467 4 0 2 2
61.02 2.23 1.5185 -3 3 2 4
61.03 2.41 1.5183 2 3 2 4
64.60 5.72 1.4427 0 4 0 2
64.87 1.48 1.4374 -2 1 6 4
64.87 3.43 1.4374 -1 1 6 4
67.58 4.07 1.3863 -5 1 4 4
67.60 4.64 1.3859 3 1 4 4
68.86 2.84 1.3634 -5 2 2 4
68.88 4.27 1.3632 4 2 2 4
69.20 3.76 1.3576 -3 3 4 4
69.21 3.37 1.3574 1 3 4 4
69.97 1.88 1.3446 2 4 0 4
70.54 4.05 1.3351 4 3 0 4
71.27 1.45 1.3231 -2 4 2 4
72.85 2.16 1.2984 1 1 6 4
74.07 4.05 1.2800 -3 2 6 4
74.08 1.92 1.2798 0 2 6 4
75.42 2.04 1.2603 -6 1 2 4
75.44 1.56 1.2601 5 1 2 4
77.15 1.69 1.2364 6 0 0 2
78.96 4.57 1.2125 -1 4 4 4
82.00 1.46 1.1751 -1 3 6 4
83.97 1.15 1.1525 -4 4 2 4
83.97 1.30 1.1525 1 4 4 4
83.98 1.01 1.1524 3 4 2 4
84.49 2.30 1.1466 -5 3 4 4
84.51 1.98 1.1464 3 3 4 4
85.43 1.44 1.1364 6 2 0 4
87.54 1.11 1.1145 -1 5 2 4
87.54 1.06 1.1145 0 5 2 4
88.78 1.56 1.1021 2 5 0 4
89.46 1.17 1.0954 1 3 6 4
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XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs
For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.