Behoite
Jacobs H, Niemann A, Kockelmann W
Zeitschrift fur Anorganische und Allgemeine Chemie 631 (2005) 1247-1254
Low temperature investigations of hydrogen bridge bonds in the hydroxides
beta-Be(OH)2 and epsilon-Zn(OH)2 by Raman-spectroscopy as well as X-ray and neutron diffraction
Locality: synthetic
Sample: T = 245 K
_database_code_amcsd 0015821
CELL PARAMETERS: 4.5356 4.6317 7.0379 90.000 90.000 90.000
SPACE GROUP: P2_12_12_1
X-RAY WAVELENGTH: 1.541838
Cell Volume: 147.849
Density (g/cm3): 1.933
MAX. ABS. INTENSITY / VOLUME**2: 5.202302367
RIR: 0.876
RIR based on corundum from Acta Crystallographica A38 (1982) 733-739
2-THETA INTENSITY D-SPACING H K L Multiplicity
22.99 68.79 3.8690 0 1 1 4
23.33 51.67 3.8125 1 0 1 4
30.37 24.74 2.9435 1 1 1 4
31.94 1.09 2.8020 0 1 2 4
32.20 26.86 2.7803 1 0 2 4
37.74 100.00 2.3838 1 1 2 4
38.89 2.33 2.3159 0 2 0 2
39.75 7.66 2.2678 2 0 0 2
41.03 18.62 2.1998 0 2 1 4
41.85 2.99 2.1585 2 0 1 4
43.23 1.56 2.0928 0 1 3 4
43.43 3.52 2.0837 1 0 3 4
44.48 6.58 2.0368 2 1 0 4
45.85 17.64 1.9793 1 2 1 4
46.41 18.71 1.9565 2 1 1 4
46.97 1.05 1.9345 0 2 2 4
47.87 13.90 1.9003 1 1 3 4
51.35 8.04 1.7794 1 2 2 4
51.87 1.78 1.7628 2 1 2 4
51.97 3.35 1.7595 0 0 4 2
55.90 6.11 1.6448 0 1 4 4
56.06 1.15 1.6404 1 0 4 4
56.43 4.27 1.6305 2 0 3 4
56.82 2.25 1.6203 2 2 0 4
58.45 3.67 1.5790 2 2 1 4
59.69 3.23 1.5490 1 2 3 4
60.17 3.72 1.5380 2 1 3 4
64.88 1.07 1.4372 3 1 0 4
65.19 3.13 1.4310 1 3 1 4
66.39 2.24 1.4082 3 1 1 4
66.77 1.98 1.4010 0 2 4 4
67.36 2.65 1.3901 2 0 4 4
69.66 1.93 1.3498 1 3 2 4
70.76 3.54 1.3315 2 1 4 4
70.82 2.17 1.3305 3 1 2 4
73.42 2.02 1.2897 0 3 3 4
74.32 3.43 1.2762 2 3 0 4
74.69 4.30 1.2708 3 0 3 4
75.75 1.59 1.2557 2 3 1 4
76.45 1.59 1.2460 3 2 1 4
76.85 3.99 1.2405 1 3 3 4
79.72 3.27 1.2028 0 2 5 4
80.60 1.80 1.1919 2 2 4 4
80.66 4.57 1.1912 3 2 2 4
83.07 1.12 1.1626 1 2 5 4
83.48 2.12 1.1580 2 1 5 4
84.87 1.35 1.1426 0 4 1 4
85.51 1.43 1.1356 1 0 6 4
88.69 1.48 1.1030 1 1 6 4
88.85 1.13 1.1014 4 1 0 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.