Name and formula

Reference code: 01-077-1317

Compound name: Silicon Oxide

Common name: Cristobalite low, syn
PDF index name: Silicon Oxide

Empirical formula: O2Si

Chemical formula: SiO2

Crystallographic parameters

Crystal system: Tetragonal

Space group: P41212
Space group number: 92

a (Å): 4.9877
b (Å): 4.9877
c (Å): 6.9697
Alpha (°): 90.0000
Beta (°): 90.0000
Gamma (°): 90.0000

Volume of cell (10^6 pm^3): 173.39

Z: 4.00

RIR: 5.02

Status, subfiles and quality

Status: Diffraction data collected at non ambient temperature

Alternate Pattern
Subfiles: Alloy, metal or intermetalic
Cement and Hydration Product
Common Phase
Excipient
Forensic
ICSD Pattern
Inorganic
Mineral
Pharmaceutical
Quality: Star (S)

Comments

ANX: AX2
ICSD collection code: 47221
Creation Date: 11/20/2008
Modification Date: 1/19/2011
ANX: AX2
Analysis: O2 Si1
Formula from original source: Si O2
ICSD Collection Code: 47221
Calculated Pattern Original Remarks: Metastable up to 500 K (2nd ref. , Tomaszewski), above Fd3-m
Temperature of Data Collection: 473 K
Wyckoff Sequence: b a(P41212)
Unit Cell Data Source: Powder Diffraction.

References

Primary reference: Pluth, J.J., Smith, J.V., Faber, J., Phase Transitions, 38, 127, (1992)
Structure: Pluth, J.J., Smith, J.V., Faber, J., J. Appl. Phys., 57, 1045, (1985)

Peak list
No. h k l d [A] 2Theta[deg] I [%]
1 1 0 1 4.05610 21.895 100.0
2 1 1 0 3.52680 25.232 0.4
3 1 1 1 3.14690 28.338 7.4
4 1 0 2 2.85670 31.287 8.5
5 2 0 0 2.49380 35.984 12.0
6 1 1 2 2.47890 36.208 5.5
7 2 0 1 2.34810 38.301 0.2
8 2 1 0 2.23060 40.404 0.1
9 2 1 1 2.12440 42.519 2.4
10 1 0 3 2.10600 42.909 0.2
11 2 0 2 2.02800 44.647 2.5
12 1 1 3 1.94010 46.787 4.1
13 2 1 2 1.87870 48.412 4.2
14 2 2 0 1.76340 51.803 0.4
15 0 0 4 1.74240 52.475 0.6
16 2 2 1 1.70960 53.561 0.1
17 2 0 3 1.69990 53.891 1.8
18 1 0 4 1.64490 55.847 0.4
19 3 0 1 1.61720 56.890 3.3
20 2 1 3 1.60900 57.207 1.8
21 3 1 0 1.57720 58.471 0.2
22 2 2 2 1.57340 58.626 0.3
23 1 1 4 1.56220 59.087 0.1
24 3 1 1 1.53840 60.095 2.0
25 3 0 2 1.50050 61.776 1.9
26 3 1 2 1.43690 64.835 2.6
27 2 0 4 1.42830 65.274 1.4
28 2 2 3 1.40460 66.516 1.1
29 3 2 0 1.38330 67.677 0.1
30 2 1 4 1.37310 68.249 1.8
31 3 2 1 1.35690 69.179 0.9
32 3 0 3 1.35200 69.465 0.7
33 1 0 5 1.34250 70.029 1.3
34 3 1 3 1.30490 72.359 1.5
35 1 1 5 1.29640 72.909 0.1
36 3 2 2 1.28570 73.615 1.6
37 4 0 0 1.24690 76.307 0.1
38 2 2 4 1.23940 76.853 0.8
39 4 0 1 1.22740 77.745 0.9
40 2 0 5 1.21680 78.552 0.1
41 4 1 0 1.20970 79.103 1.3
42 3 0 4 1.20280 79.647 0.1
43 4 1 1 1.19190 80.523 0.1
44 3 2 3 1.18860 80.793 1.2
45 2 1 5 1.18210 81.330 1.1
46 3 3 0 1.17560 81.876 0.2
47 4 0 2 1.17400 82.011 0.2
48 3 1 4 1.16930 82.412 0.5
49 3 3 1 1.15920 83.289 0.3
50 4 1 2 1.14280 84.760 0.2
51 1 0 6 1.13130 85.828 0.1
52 3 3 2 1.11390 87.503 0.4
53 1 1 6 1.10330 88.562 1.1
54 4 2 1 1.10130 88.765 0.8
55 4 0 3 1.09870 89.031 0.2
56 2 2 5 1.09360 89.557 0.1
57 3 2 4 1.08340 90.633 0.2
58 4 1 3 1.07300 91.762 0.1
59 3 0 5 1.06820 92.294 0.1
60 4 2 2 1.06220 92.970 0.3
61 2 0 6 1.05300 94.029 0.1
62 3 3 3 1.04900 94.499 0.1
63 3 1 5 1.04450 95.035 0.2
64 2 1 6 1.03030 96.774 0.1
65 4 0 4 1.01400 98.869 0.1
66 4 2 3 1.00540 100.021 0.2
67 4 3 0 0.99750 101.109 0.3
68 4 1 4 0.99370 101.643 0.6
69 4 3 1 0.98750 102.530 0.2
70 3 2 5 0.98190 103.349 0.1
71 5 1 0 0.97820 103.899 0.1
72 1 0 7 0.97640 104.169 0.2
73 3 3 4 0.97450 104.456 0.1
74 2 2 6 0.97010 105.130 0.1
75 5 1 1 0.96870 105.346 0.2
76 5 0 2 0.95900 106.880 0.3
77 3 0 6 0.95220 107.991 0.1
78 5 1 2 0.94180 109.751 0.1
79 4 2 4 0.93930 110.185 0.1
80 3 1 6 0.93530 110.891 0.1
81 4 0 5 0.92940 111.954 0.1
82 2 0 7 0.92470 112.822 0.1
83 5 2 1 0.91810 114.073 0.1
84 4 3 3 0.91660 114.362 0.3
85 4 1 5 0.91360 114.948 0.1
86 2 1 7 0.90920 115.823 0.3
87 5 1 3 0.90150 117.401 0.1
88 3 3 5 0.89870 117.991 0.1
89 5 2 2 0.89510 118.762 0.3
90 3 2 6 0.88960 119.970 0.2
91 4 4 0 0.88170 121.772 0.1
92 4 4 1 0.87470 123.440 0.1
93 4 2 5 0.87080 124.402 0.2
94 0 0 8 0.87080 124.402 0.2
 95 2 2 7 0.86700 125.362 0.1
96 5 0 4 0.86570 125.696 0.2
97 5 2 3 0.86030 127.116 0.1
98 1 0 8 0.85820 127.683 0.1
99 5 3 0 0.85540 128.452 0.2
100 3 0 7 0.85480 128.618 0.2
101 4 4 2 0.85480 128.618 0.2
102 5 1 4 0.85300 129.123 0.1
103 4 0 6 0.84990 130.009 0.1
104 5 3 1 0.84900 130.270 0.1
105 1 1 8 0.84580 131.214 0.1
106 3 1 7 0.84190 132.398 0.1
107 4 1 6 0.83790 133.654 0.1
108 6 0 0 0.83130 135.828 0.1
109 5 3 2 0.83070 136.033 0.1
110 6 0 1 0.82540 137.893 0.2
111 4 4 3 0.82430 138.292 0.1
112 2 0 8 0.82250 138.955 0.1
113 6 1 0 0.82000 139.899 0.3
114 5 2 4 0.81780 140.752 0.1
115 6 1 1 0.81440 142.117 0.1
116 4 3 5 0.81150 143.329 0.3
117 2 1 8 0.81150 143.329 0.3
118 3 2 7 0.80810 144.812 0.1
119 6 0 2 0.80810 144.812 0.1
120 4 2 6 0.80450 146.467 0.1
121 5 3 3 0.80270 147.331 0.1
122 5 1 5 0.80070 148.322 0.5
123 6 1 2 0.79820 149.613 0.1

Stick Pattern