Molybdite
Sitepu H
Powder Diffraction 24 (2009) 315-326
Texture and structural refinement using neutron diffraction data from
molybdite (MoO3) and calcite (CaCO3) powders and a Ni-rich Ni50.7Ti49.30 alloy
Note: Generalized spherical-harmonic model
Locality: synthetic
_database_code_amcsd 0018894
CELL PARAMETERS: 3.9624 13.8600 3.6971 90.000 90.000 90.000
SPACE GROUP: Pbnm
X-RAY WAVELENGTH: 1.541838
Cell Volume: 203.041
Density (g/cm3): 4.708
MAX. ABS. INTENSITY / VOLUME**2: 69.96470254
RIR: 4.839
RIR based on corundum from Acta Crystallographica A38 (1982) 733-739
2-THETA INTENSITY D-SPACING H K L Multiplicity
12.77 31.24 6.9300 0 2 0 2
23.35 74.63 3.8098 1 1 0 4
25.71 34.69 3.4650 0 4 0 2
25.90 24.11 3.4398 1 2 0 4
27.34 100.00 3.2619 0 2 1 4
29.70 6.23 3.0077 1 3 0 4
33.14 14.61 2.7032 1 0 1 4
33.78 27.32 2.6532 1 1 1 8
34.38 2.92 2.6084 1 4 0 4
35.51 7.66 2.5282 0 4 1 4
38.59 8.97 2.3331 1 3 1 8
38.99 21.83 2.3100 0 6 0 2
39.68 13.73 2.2714 1 5 0 4
42.41 7.63 2.1313 1 4 1 8
45.45 1.70 1.9956 1 6 0 4
45.80 8.80 1.9812 2 0 0 2
46.29 7.30 1.9613 2 1 0 4
46.35 7.77 1.9590 0 6 1 4
49.30 17.06 1.8485 0 0 2 2
50.10 10.26 1.8208 2 3 0 4
51.14 1.56 1.7861 0 2 2 4
51.60 2.10 1.7712 1 7 0 4
52.08 4.19 1.7561 1 6 1 8
52.84 14.42 1.7326 2 1 1 8
53.26 1.95 1.7199 2 4 0 4
54.16 6.61 1.6933 2 2 1 8
55.23 12.02 1.6631 1 1 2 8
56.32 2.22 1.6335 2 3 1 8
56.42 6.94 1.6310 0 4 2 4
56.52 4.84 1.6283 1 2 2 8
57.71 13.34 1.5973 1 7 1 8
58.11 2.23 1.5874 1 8 0 4
58.62 1.55 1.5749 1 3 2 8
58.87 12.78 1.5688 0 8 1 4
61.48 1.02 1.5082 1 4 2 8
61.68 3.39 1.5039 2 6 0 4
62.90 10.91 1.4775 2 5 1 8
64.57 7.61 1.4433 0 6 2 4
64.97 3.21 1.4354 1 9 0 4
65.05 6.44 1.4337 1 5 2 8
66.80 4.69 1.4005 2 7 0 4
67.20 1.17 1.3930 2 6 1 8
67.59 3.08 1.3860 0 10 0 2
69.55 3.71 1.3516 2 0 2 4
69.93 3.58 1.3452 2 1 2 8
72.91 4.03 1.2974 3 2 0 4
72.92 6.06 1.2972 2 3 2 8
74.14 1.10 1.2789 1 7 2 8
75.50 1.27 1.2592 2 4 2 8
76.60 4.07 1.2438 3 0 1 4
77.37 1.91 1.2333 1 10 1 8
77.63 3.18 1.2299 2 8 1 8
78.90 3.67 1.2133 0 2 3 4
79.60 1.63 1.2043 1 8 2 8
82.21 1.67 1.1725 1 1 3 8
82.38 3.60 1.1707 3 4 1 8
82.73 2.39 1.1666 2 6 2 8
83.74 3.90 1.1550 2 9 1 8
84.91 3.20 1.1420 1 11 1 8
85.07 1.51 1.1404 1 3 3 8
85.68 2.83 1.1337 1 9 2 8
87.36 4.27 1.1163 2 7 2 8
88.09 2.86 1.1089 0 10 2 4
88.74 2.91 1.1025 0 12 1 4
89.49 3.08 1.0951 3 6 1 8
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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.