Cs(MoO)P2O7
Guesdon A, Borel M, Leclaire A, Grandin A, Raveau B
Journal of Solid State Chemistry 108 (1994) 46-50
A molybdenum (V) diphosphate closely related to the alpha-NaTiP2O7 structure:
Cs(MoO)P2O7
_cod_database_code 1001618
_database_code_amcsd 0013789
CELL PARAMETERS: 5.1340 11.7070 12.0630 90.000 91.770 90.000
SPACE GROUP: P2_1/n
X-RAY WAVELENGTH: 1.541838
Cell Volume: 724.685
Density (g/cm3): 3.838
MAX. ABS. INTENSITY / VOLUME**2: 21.31482994
RIR: 1.808
RIR based on corundum from Acta Crystallographica A38 (1982) 733-739
2-THETA INTENSITY D-SPACING H K L Multiplicity
10.53 4.40 8.3992 0 1 1 4
15.14 6.04 5.8535 0 2 0 2
16.54 5.78 5.3597 0 1 2 4
16.84 15.26 5.2658 0 2 1 4
20.08 12.35 4.4215 -1 1 1 4
20.47 2.68 4.3376 1 1 1 4
21.16 28.95 4.1996 0 2 2 4
23.05 100.00 3.8587 1 2 0 4
23.40 42.34 3.8013 0 1 3 4
23.67 18.32 3.7585 -1 1 2 4
23.97 64.61 3.7127 0 3 1 4
24.05 47.36 3.7001 -1 2 1 4
24.34 37.33 3.6568 1 1 2 4
24.38 53.49 3.6506 1 2 1 4
26.91 73.93 3.3133 0 2 3 4
27.15 24.56 3.2848 -1 2 2 4
27.74 22.14 3.2162 1 2 2 4
27.77 35.35 3.2127 -1 0 3 2
28.63 36.78 3.1177 1 0 3 2
28.74 1.15 3.1062 1 3 0 4
28.82 36.46 3.0981 -1 1 3 4
29.56 5.14 3.0217 -1 3 1 4
29.65 20.19 3.0127 1 1 3 4
29.84 8.69 2.9945 1 3 1 4
30.54 8.21 2.9267 0 4 0 2
30.63 14.38 2.9191 0 1 4 4
31.45 4.68 2.8442 0 4 1 4
31.77 1.81 2.8164 -1 2 3 4
32.17 2.87 2.7825 -1 3 2 4
32.68 8.33 2.7405 1 3 2 4
33.44 3.32 2.6799 0 2 4 4
34.05 13.15 2.6329 0 4 2 4
34.97 53.38 2.5658 2 0 0 2
35.99 12.90 2.4953 -1 4 1 4
36.22 8.92 2.4803 -1 3 3 4
36.22 6.87 2.4800 1 4 1 4
36.39 2.09 2.4687 -2 1 1 4
36.90 1.35 2.4358 1 3 3 4
37.68 2.66 2.3876 -2 0 2 2
37.71 17.08 2.3855 0 3 4 4
38.03 3.32 2.3659 0 4 3 4
38.10 1.35 2.3619 0 1 5 4
38.21 33.19 2.3555 -1 4 2 4
38.32 1.65 2.3491 1 2 4 4
38.65 12.97 2.3298 1 4 2 4
38.84 1.40 2.3189 -2 2 1 4
39.19 2.85 2.2985 0 5 1 4
39.27 1.00 2.2944 2 2 1 4
39.35 5.37 2.2899 2 1 2 4
40.46 8.42 2.2297 0 2 5 4
40.82 9.92 2.2107 -2 2 2 4
40.85 7.49 2.2089 -1 0 5 2
41.35 21.81 2.1837 -1 3 4 4
41.64 8.29 2.1688 2 2 2 4
41.88 7.32 2.1570 1 0 5 2
41.90 2.74 2.1561 -2 1 3 4
42.16 16.31 2.1433 1 3 4 4
42.36 3.87 2.1338 1 4 3 4
42.44 1.30 2.1301 1 5 0 4
42.62 3.37 2.1213 1 1 5 4
42.64 11.60 2.1202 -2 3 1 4
43.03 8.88 2.1023 -1 5 1 4
43.04 7.65 2.1014 2 3 1 4
43.11 5.75 2.0984 2 1 3 4
43.22 10.82 2.0931 1 5 1 4
44.09 6.56 2.0541 -2 2 3 4
44.80 1.14 2.0231 0 5 3 4
45.25 3.85 2.0041 2 2 3 4
45.26 1.69 2.0037 2 3 2 4
45.33 1.59 2.0004 1 5 2 4
45.81 9.15 1.9806 0 1 6 4
46.41 5.11 1.9564 -2 1 4 4
46.55 5.62 1.9512 0 6 0 2
47.10 2.31 1.9294 2 4 0 4
47.19 1.53 1.9261 0 6 1 4
47.29 1.18 1.9223 -1 3 5 4
47.56 3.83 1.9121 -2 4 1 4
47.90 5.05 1.8992 2 1 4 4
47.92 7.18 1.8982 2 4 1 4
48.78 10.71 1.8669 -1 1 6 4
49.07 1.27 1.8564 0 6 2 4
49.25 5.51 1.8501 -2 4 2 4
49.28 27.58 1.8491 0 5 4 4
49.85 5.85 1.8291 1 1 6 4
49.97 8.03 1.8253 2 4 2 4
50.01 1.49 1.8238 1 6 0 4
50.71 4.16 1.8003 1 6 1 4
51.13 3.31 1.7866 0 3 6 4
51.68 3.43 1.7688 -2 3 4 4
51.78 1.03 1.7656 1 2 6 4
51.86 1.71 1.7631 -1 4 5 4
52.24 3.83 1.7510 -1 6 2 4
52.59 2.87 1.7404 1 6 2 4
52.72 1.87 1.7364 1 4 5 4
52.95 1.07 1.7292 1 5 4 4
53.05 3.33 1.7262 2 3 4 4
53.13 1.59 1.7238 2 4 3 4
53.52 3.03 1.7121 2 1 5 4
53.69 5.10 1.7073 -2 2 5 4
53.70 1.50 1.7070 2 5 1 4
53.87 3.62 1.7018 -1 3 6 4
54.88 3.09 1.6730 1 3 6 4
55.36 7.73 1.6597 2 2 5 4
55.47 2.46 1.6566 0 4 6 4
55.47 2.23 1.6566 0 7 1 4
55.56 1.16 1.6540 1 6 3 4
56.01 8.00 1.6419 3 2 0 4
56.15 1.51 1.6380 0 6 4 4
56.33 2.98 1.6333 -3 2 1 4
56.71 4.09 1.6232 -2 3 5 4
56.82 4.88 1.6204 3 2 1 4
56.96 5.35 1.6167 3 1 2 4
57.16 4.74 1.6116 0 7 2 4
57.35 2.03 1.6067 -1 5 5 4
57.76 2.62 1.5962 -3 2 2 4
57.94 3.74 1.5917 -3 0 3 2
57.95 3.50 1.5914 -2 1 6 4
58.07 1.13 1.5884 -1 4 6 4
58.14 6.21 1.5866 -1 2 7 4
58.47 2.27 1.5784 -1 7 1 4
58.52 5.53 1.5772 -3 1 3 4
58.58 2.59 1.5758 0 3 7 4
58.72 1.19 1.5724 3 2 2 4
59.03 2.74 1.5649 1 4 6 4
59.25 5.19 1.5594 1 2 7 4
59.37 3.00 1.5567 3 0 3 2
59.52 2.75 1.5531 2 6 0 4
59.74 2.11 1.5480 3 3 1 4
59.86 1.86 1.5452 2 1 6 4
59.91 2.19 1.5440 -2 6 1 4
59.95 1.15 1.5431 3 1 3 4
60.78 1.25 1.5239 -2 4 5 4
61.23 13.56 1.5138 -2 5 4 4
61.36 3.05 1.5108 -2 6 2 4
61.53 5.92 1.5072 0 0 8 2
61.56 1.18 1.5064 2 2 6 4
61.58 1.12 1.5059 3 3 2 4
62.09 1.18 1.4948 0 1 8 4
62.33 1.18 1.4897 2 4 5 4
62.46 10.80 1.4868 2 5 4 4
62.57 4.95 1.4845 0 4 7 4
62.62 4.80 1.4835 -1 7 3 4
63.08 1.00 1.4738 -3 3 3 4
63.08 7.06 1.4738 1 7 3 4
63.23 1.40 1.4706 -3 4 1 4
63.58 1.12 1.4634 0 8 0 2
63.63 2.37 1.4624 -1 6 5 4
63.69 1.66 1.4611 3 4 1 4
64.11 1.58 1.4525 1 5 6 4
64.57 6.73 1.4433 -3 4 2 4
65.47 1.58 1.4256 3 4 2 4
65.97 1.37 1.4160 1 4 7 4
65.97 1.10 1.4160 -3 0 5 2
66.02 2.49 1.4151 -1 2 8 4
66.43 3.22 1.4073 1 8 0 4
66.48 2.24 1.4065 -3 3 4 4
66.78 2.46 1.4009 1 7 4 4
67.13 1.24 1.3944 -2 7 1 4
67.21 2.93 1.3929 1 2 8 4
68.14 2.20 1.3761 -3 5 1 4
68.16 1.16 1.3759 2 4 6 4
68.19 2.25 1.3753 3 0 5 2
68.20 2.19 1.3751 0 8 3 4
68.24 1.46 1.3744 3 4 3 4
68.25 3.36 1.3743 3 3 4 4
68.32 1.30 1.3730 -1 8 2 4
68.50 1.94 1.3698 -2 7 2 4
68.58 1.96 1.3684 3 5 1 4
68.71 1.22 1.3660 -1 3 8 4
68.72 1.08 1.3659 3 1 5 4
69.06 2.52 1.3600 -2 3 7 4
69.08 3.55 1.3597 2 7 2 4
69.77 1.44 1.3478 -1 5 7 4
70.05 1.26 1.3432 1 6 6 4
70.64 2.41 1.3334 -1 7 5 4
70.79 1.84 1.3311 1 5 7 4
71.09 1.34 1.3262 2 3 7 4
71.36 4.08 1.3217 1 7 5 4
71.63 3.98 1.3174 -2 0 8 2
71.81 3.41 1.3145 -3 1 6 4
72.15 1.40 1.3092 -2 1 8 4
72.74 1.60 1.3000 -2 4 7 4
73.18 1.62 1.2933 0 9 1 4
73.70 2.51 1.2855 0 7 6 4
73.87 4.85 1.2829 4 0 0 2
73.91 5.31 1.2824 2 0 8 2
74.35 1.04 1.2759 3 6 1 4
74.67 1.11 1.2712 2 8 0 4
74.95 1.73 1.2671 0 3 9 4
75.50 2.03 1.2592 -1 6 7 4
75.95 2.39 1.2528 -3 3 6 4
76.08 1.50 1.2510 0 8 5 4
76.48 1.75 1.2454 1 6 7 4
77.17 2.06 1.2361 -1 9 2 4
77.30 1.90 1.2344 -4 2 2 4
77.45 4.01 1.2323 1 9 2 4
77.89 1.56 1.2264 -4 1 3 4
79.23 2.11 1.2090 4 3 1 4
79.41 1.31 1.2067 -4 2 3 4
79.44 1.66 1.2064 -3 2 7 4
81.07 1.45 1.1862 4 2 3 4
81.51 1.84 1.1809 0 2 10 4
81.77 1.06 1.1778 1 4 9 4
81.99 1.43 1.1751 3 4 6 4
82.33 1.24 1.1712 3 2 7 4
82.76 1.17 1.1662 4 4 1 4
83.43 1.69 1.1585 -2 7 6 4
83.62 1.40 1.1564 -2 9 1 4
83.92 2.17 1.1530 -3 7 3 4
84.36 1.59 1.1482 -2 5 8 4
84.80 1.10 1.1433 1 2 10 4
85.07 1.55 1.1403 2 7 6 4
85.15 1.66 1.1395 3 7 3 4
85.88 1.21 1.1317 -2 8 5 4
86.27 1.39 1.1276 1 5 9 4
86.69 1.74 1.1232 2 3 9 4
87.24 1.56 1.1175 2 8 5 4
87.78 1.10 1.1120 3 8 0 4
88.91 1.39 1.1008 -4 3 5 4
89.14 1.59 1.0985 4 2 5 4
89.41 2.59 1.0959 -1 4 10 4
89.58 1.70 1.0942 3 2 8 4
89.81 1.51 1.0920 -4 1 6 4
89.88 1.04 1.0913 0 1 11 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.