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北京石油化工學(xué)院2026年研究生招生接收調(diào)劑公告

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mattlyzx

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[求助] 求JCPDS 01-077-0179 已有1人參與

求JCPDS 01-077-0179
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mattlyzx: 金幣+20, ★有幫助 2015-12-14 22:59:10

Name and formula

Reference code: 01-077-0179

Mineral name: Ferrisicklerite
Compound name: Lithium Iron Phosphate
Common name: Lithium iron(III) phosphate

Empirical formula: FeLiO4P
Chemical formula: LiFePO4

Crystallographic parameters

Crystal system: Orthorhombic
Space group: Pbnm
Space group number: 62

a (?):    4.7870
b (?):    10.0860
c (?):    5.9390
Alpha (°):    90.0000
Beta (°):    90.0000
Gamma (°):    90.0000

Calculated density (g/cm^3):    3.65
Volume of cell (10^6 pm^3): 286.74
Z:    4.00

RIR:    1.44

Subfiles and quality

Subfiles: Corrosion
ICSD Pattern
Inorganic
Mineral
Quality: Calculated (C)

Comments

ICSD collection code: 038209
Creation Date: 1970/1/1
Modification Date: 1970/1/1
ICSD Collection Code: 038209
Calculated Pattern Original Remarks: Li site partially empty because of Fe(III)
Calculated Pattern Original Remarks: REM    B x-coordinate of O1 corrected
Test from ICSD: No R value given
Test from ICSD: At least one TF missing
Test from ICSD: Published coordinates have been corrected
Sample Source or Locality: Specimen from Varutrask, Sweden
Calculated Pattern Original Remarks: Minus sign for x(O1) added
Additional Patterns: See PDF 00-029-0808. Minerals of the Varutrask pegmatite. IX. X-ray studies on triphylite, varulite, and their oxidation products. d c4 a (PBNM). ABCX4.

References

Primary reference: Calculated from ICSD using POWD-12++, (1997)
Structure: Bjoerling, C.O., Westgren, A., Geol. Foeren. Stockholm Foerh., 60, 67, (1938)

Peak list

No. h k l    d [A]    2Theta[deg] I [%]
  1 0 2 0    5.04300 17.572    26.9
  2 1 1 0    4.32463 20.520    22.5
  3 0 2 1    3.84410 23.119    10.1
  4 1 0 1    3.72703 23.856    5.0
  5 1 1 1    3.49598 25.458    87.3
  6 1 2 0    3.47190 25.637    20.6
  7 1 2 1    2.99731 29.784    5.5
  8 0 0 2    2.96950 30.069    58.1
  9 1 3 0    2.75126 32.518    10.1
10 0 2 2    2.55884 35.040    1.1
11 0 4 0    2.52150 35.576    2.0
12 1 3 1    2.49640 35.945    100.0
13 1 1 2    2.44797 36.682    30.7
14 2 0 0    2.39350 37.547    1.3
15 2 1 0    2.32882 38.631    3.2
16 0 4 1    2.32098 38.767    19.3
17 1 2 2    2.25667 39.918    10.2
18 1 4 0    2.23093 40.398    18.6
19 2 1 1    2.16810 41.622    4.5
20 2 2 0    2.16231 41.739    16.4
21 1 4 1    2.08845 43.288    4.7
22 2 2 1    2.03183 44.558    0.7
23 1 3 2    2.01818 44.876    13.3
24 2 3 0    1.94984 46.539    0.4
25 0 4 2    1.92205 47.253    4.1
26 2 0 2    1.86352 48.832    9.4
27 1 5 0    1.85890 48.961    5.4
28 2 1 2    1.83250 49.714    14.7
29 1 0 3    1.82940 49.804    8.2
30 1 1 3    1.80003 50.673    6.7
31 1 4 2    1.78365 51.172    0.3
32 1 5 1    1.77403 51.470    5.3
33 2 2 2    1.74799 52.294    33.0
34 2 4 0    1.73595 52.685    4.3
35 1 2 3    1.71974 53.220    2.2
36 0 6 0    1.68100 54.547    1.3
37 2 4 1    1.66623 55.071    8.9
38 2 3 2    1.62988 56.408    0.5
39 0 6 1    1.61746 56.880    7.4
40 1 3 3    1.60691 57.288    18.8
41 1 6 0    1.58605 58.113    1.1
42 3 1 0    1.57564 58.534    2.4
43 0 4 3    1.55710 59.300    7.0
44 2 5 0    1.54246 59.920    1.4
45 1 6 1    1.53235 60.357    0.2
46 3 1 1    1.52334 60.751    5.7
47 3 2 0    1.52133 60.840    4.0
48 2 1 3    1.50833 61.421    1.6
49 2 4 2    1.49865 61.861    0.5
50 2 5 1    1.49293 62.124    4.8
51 0 0 4    1.48475 62.505    12.1
52 1 4 3    1.48074 62.693    6.9
53 3 2 1    1.47374 63.025    3.6
54 0 6 2    1.46287 63.548    11.4
55 2 2 3    1.46014 63.680    6.1
56 3 3 0    1.44154 64.601    3.0
57 0 2 4    1.42430 65.480    0.7
58 1 1 4    1.40429 66.533    1.2
59 3 3 1    1.40087 66.717    3.9
60 1 6 2    1.39900 66.817    1.8
61 2 3 3    1.38917 67.353    0.2
62 1 7 0    1.37971 67.877    4.6
63 2 6 0    1.37563 68.106    3.4
64 1 2 4    1.36516 68.701    0.6
65 3 2 2    1.35398 69.349    7.9
66 3 4 0    1.34836 69.680    1.8
67 1 7 1    1.34392 69.944    0.9
68 2 6 1    1.34015 70.169    4.3
69 3 4 1    1.31490 71.722    2.8
70 1 3 4    1.30662 72.248    1.8
71 2 4 3    1.30521 72.339    2.0
72 3 3 2    1.29681 72.882    0.1
73 0 6 3    1.28137 73.905    2.5
74 2 0 4    1.26171 75.254    0.7
75 3 5 0    1.25125 75.995    4.4
76 2 6 2    1.24820 76.214    2.5
77 3 0 3    1.24234 76.638    0.2
78 1 6 3    1.23779 76.971    0.7
79 1 4 4    1.23604 77.100    1.7
80 0 8 1    1.23303 77.323    4.5
81 3 4 2    1.22772 77.721    0.6
82 3 5 1    1.22398 78.003    3.2
83 2 5 3    1.21674 78.556    1.5
84 3 2 3    1.20628 79.371    1.1
85 4 0 0    1.19675 80.131    0.8
86 1 8 1    1.19427 80.331    0.4
87 4 1 0    1.18841 80.809    2.3
88 2 3 4    1.18126 81.400    0.2
89 3 3 3    1.16533 82.755    1.7
90 1 5 4    1.16012 83.209    0.2
91 3 6 0    1.15730 83.457    0.4
92 0 2 5    1.15616 83.558    0.5
93 3 5 2    1.15323 83.818    1.1
94 1 1 5    1.14538 84.525    1.3
95 4 2 1    1.14266 84.773    1.3
96 2 7 2    1.13987 85.029    0.6
97 3 6 1    1.13593 85.394    0.3
98 2 6 3    1.12967 85.982    2.1
99 1 8 2    1.12782 86.157    2.7
100 3 4 3    1.11442 87.452    1.8
101 0 6 4    1.11282 87.610    1.3
102 4 0 2    1.11000 87.889    0.9
103 4 3 1    1.10767 88.122    0.3
104 4 1 2    1.10334 88.558    0.6
105 2 8 1    1.09630 89.278    0.6
106 1 3 5    1.09051 89.880    3.9

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