Kafehydrocyanite
Taylor J C, Mueller M H, Hitterman R L
Acta Crystallographica A26 (1970) 559-567
A neutron diffraction study of ferroelectric KFCT, K4Fe(CN)6*3D2O, above the
Curie temperature
Locality: synthetic
_database_code_amcsd 0009321
CELL PARAMETERS: 9.4150 17.0060 9.3820 90.000 90.030 90.000
SPACE GROUP: A2/a
X-RAY WAVELENGTH: 1.541838
Cell Volume: 1502.166
Density (g/cm3): 1.867
MAX. ABS. INTENSITY / VOLUME**2: 5.545609735
RIR: 0.967
RIR based on corundum from Acta Crystallographica A38 (1982) 733-739
2-THETA INTENSITY D-SPACING H K L Multiplicity
10.40 49.82 8.5030 0 2 0 2
10.77 9.36 8.2148 0 1 1 4
14.03 18.11 6.3104 1 2 0 4
14.31 14.81 6.1913 -1 1 1 4
14.31 16.63 6.1885 1 1 1 4
18.29 9.08 4.8518 0 3 1 4
18.85 7.40 4.7075 2 0 0 2
18.92 4.89 4.6910 0 0 2 2
20.59 4.86 4.3133 -1 3 1 4
20.60 4.51 4.3124 1 3 1 4
20.89 34.38 4.2515 0 4 0 2
21.58 3.47 4.1185 2 2 0 4
21.64 3.88 4.1074 0 2 2 4
21.76 19.96 4.0836 2 1 1 4
22.95 7.41 3.8748 1 4 0 4
23.63 54.17 3.7654 -1 2 2 4
26.38 31.36 3.3781 2 3 1 4
26.82 9.70 3.3237 -2 0 2 2
26.84 8.19 3.3220 2 0 2 2
27.90 11.66 3.1976 0 5 1 4
28.84 3.81 3.0956 -2 2 2 4
28.85 5.64 3.0942 2 2 2 4
29.91 1.05 2.9877 -1 4 2 4
29.91 1.00 2.9871 1 4 2 4
30.49 99.71 2.9321 -3 1 1 4
30.58 100.00 2.9233 1 1 3 4
31.57 65.74 2.8343 0 6 0 2
33.00 7.52 2.7140 1 6 0 4
33.89 4.26 2.6453 -2 5 1 4
33.89 4.75 2.6449 2 5 1 4
34.02 2.62 2.6354 -3 3 1 4
34.10 2.29 2.6290 1 3 3 4
34.24 6.08 2.6185 -2 4 2 4
34.26 7.92 2.6177 2 4 2 4
34.85 1.17 2.5743 2 1 3 4
36.01 1.53 2.4943 -3 2 2 4
36.02 1.07 2.4932 3 2 2 4
38.01 1.97 2.3674 -2 3 3 4
38.24 1.81 2.3537 4 0 0 2
38.31 9.39 2.3493 -1 6 2 4
38.32 4.31 2.3490 1 6 2 4
38.38 1.87 2.3455 0 0 4 2
39.49 1.37 2.2818 -1 7 1 4
39.49 1.94 2.2817 1 7 1 4
39.73 1.06 2.2684 4 2 0 4
40.26 33.92 2.2400 -3 5 1 4
40.34 36.17 2.2360 1 5 3 4
40.57 1.09 2.2237 -3 4 2 4
41.89 2.26 2.1567 -2 6 2 4
41.90 1.71 2.1562 2 6 2 4
42.69 1.53 2.1179 -4 3 1 4
42.99 9.08 2.1038 2 7 1 4
43.00 3.54 2.1035 3 6 0 4
43.00 17.18 2.1033 4 0 2 2
43.08 15.53 2.0998 -2 0 4 2
43.78 1.88 2.0677 2 5 3 4
43.97 3.44 2.0592 4 4 0 4
44.10 2.54 2.0537 0 4 4 4
44.35 1.12 2.0426 -4 2 2 4
44.37 3.55 2.0418 4 2 2 4
44.44 4.61 2.0385 -2 2 4 4
45.19 1.07 2.0063 1 4 4 4
46.90 2.12 1.9374 2 8 0 4
46.93 2.48 1.9362 0 8 2 4
47.37 1.93 1.9191 3 6 2 4
47.38 1.04 1.9185 0 7 3 4
47.97 5.07 1.8966 -1 8 2 4
47.99 1.11 1.8957 -4 5 1 4
48.27 8.74 1.8852 4 4 2 4
48.34 10.11 1.8827 -2 4 4 4
48.36 4.01 1.8821 -3 7 1 4
48.42 3.51 1.8798 1 7 3 4
48.70 3.83 1.8697 -4 1 3 4
48.83 4.54 1.8651 0 1 5 4
49.19 1.66 1.8524 0 9 1 4
49.58 6.58 1.8385 5 2 0 4
49.67 2.75 1.8356 -5 1 1 4
49.71 7.36 1.8341 3 2 4 4
49.85 2.18 1.8293 1 1 5 4
50.19 2.79 1.8176 -1 9 1 4
50.20 2.30 1.8175 1 9 1 4
51.16 4.46 1.7854 -4 3 3 4
51.29 3.75 1.7813 0 3 5 4
51.50 1.27 1.7745 1 6 4 4
53.32 1.01 1.7181 3 4 4 4
54.31 5.03 1.6891 4 6 2 4
54.38 4.58 1.6872 -2 6 4 4
54.86 2.79 1.6735 1 10 0 4
55.14 1.11 1.6658 2 3 5 4
55.28 1.64 1.6619 -4 0 4 2
55.31 1.74 1.6610 4 0 4 2
58.56 1.55 1.5762 1 10 2 4
58.88 1.08 1.5684 5 6 0 4
58.99 1.03 1.5657 3 6 4 4
60.71 2.81 1.5254 0 11 1 4
62.06 2.26 1.4955 -4 8 2 4
62.08 1.05 1.4952 3 10 0 4
62.15 1.98 1.4936 2 8 4 4
62.39 5.63 1.4884 -6 0 2 2
62.41 1.38 1.4879 6 0 2 2
62.44 2.21 1.4874 -4 7 3 4
62.55 2.69 1.4850 0 7 5 4
62.61 5.83 1.4837 2 0 6 2
64.18 1.75 1.4512 -2 11 1 4
64.18 1.16 1.4511 2 11 1 4
66.31 1.40 1.4095 5 8 0 4
66.42 1.65 1.4076 3 8 4 4
66.57 1.14 1.4048 -6 4 2 4
66.78 1.34 1.4009 2 4 6 4
66.96 1.26 1.3975 6 1 3 4
67.85 2.37 1.3813 -3 2 6 4
68.43 1.11 1.3711 1 11 3 4
68.93 1.11 1.3622 1 10 4 4
68.99 1.60 1.3612 6 3 3 4
70.08 1.07 1.3428 -1 12 2 4
71.02 2.54 1.3272 7 1 1 4
71.13 2.48 1.3254 -5 1 5 4
71.17 2.48 1.3248 5 1 5 4
71.28 2.79 1.3230 -1 1 7 4
71.32 1.25 1.3224 4 10 2 4
71.37 1.32 1.3215 -2 10 4 4
71.61 3.17 1.3177 -6 6 2 4
71.81 3.22 1.3145 2 6 6 4
76.90 1.66 1.2397 7 5 1 4
77.01 1.54 1.2383 -5 5 5 4
77.05 1.63 1.2377 5 5 5 4
77.16 1.65 1.2362 -1 5 7 4
78.47 1.02 1.2188 -5 10 2 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.