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TiO2 Anatase Phase Analysis PDF#84-1285

The document provides crystallographic data for Anatase (TiO2) with a tetragonal structure and space group I41/amd. It includes detailed measurements such as cell dimensions, density, and strong diffraction lines with corresponding 2-theta values and intensities. The data is calibrated using CuKa1 radiation and references a Level-1 PDF for further validation.

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13 views1 page

TiO2 Anatase Phase Analysis PDF#84-1285

The document provides crystallographic data for Anatase (TiO2) with a tetragonal structure and space group I41/amd. It includes detailed measurements such as cell dimensions, density, and strong diffraction lines with corresponding 2-theta values and intensities. The data is calibrated using CuKa1 radiation and references a Level-1 PDF for further validation.

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smtc7vp8fc
Copyright
© All Rights Reserved
We take content rights seriously. If you suspect this is your content, claim it here.
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PDF#84-1285: QM=Calculated; d=Calculated; I=(Unknown)

Anatase, syn
TiO2
Radiation=CuKa1 Lambda=1.5406 Filter=
Calibration= 2T=25.305-83.158 I/Ic(RIR)=4.99
Ref: Level-1 PDF

Tetragonal, I41/amd(141) Z=4 mp=


CELL: 3.7848 x 3.7848 x 9.5124 <90.0 x 90.0 x 90.0> P.S=
Density(c)=3.894 Density(m)= Mwt= Vol=136.3
Ref: Ibid.

Strong Lines: 3.52/X 1.89/2 2.38/2 1.70/2 1.67/2 1.48/1 1.26/1 2.33/1

2-Theta d(?) I(f) ( h k l) Theta 1/(2d) 2pi/d n^2


25.305 3.5167 100.0 ( 1 0 1) 12.652 0.1422 1.7867
36.953 2.4306 6.0 ( 1 0 3) 18.476 0.2057 2.5851
37.799 2.3781 18.8 ( 0 0 4) 18.899 0.2103 2.6421
38.569 2.3324 7.2 ( 1 1 2) 19.284 0.2144 2.6939
48.038 1.8924 24.6 ( 2 0 0) 24.019 0.2642 3.3202
53.892 1.6998 15.2 ( 1 0 5) 26.946 0.2941 3.6964
55.062 1.6664 15.2 ( 2 1 1) 27.531 0.3000 3.7704
62.110 1.4932 2.7 ( 2 1 3) 31.055 0.3349 4.2079
62.690 1.4808 11.3 ( 2 0 4) 31.345 0.3377 4.2432
68.765 1.3640 4.8 ( 1 1 6) 34.382 0.3666 4.6064
70.289 1.3381 5.2 ( 2 2 0) 35.144 0.3737 4.6955
74.065 1.2790 0.5 ( 1 0 7) 37.032 0.3909 4.9127
75.052 1.2646 7.9 ( 2 1 5) 37.526 0.3954 4.9686
76.035 1.2507 2.1 ( 3 0 1) 38.018 0.3998 5.0239
78.666 1.2153 0.1 ( 2 0 6) 39.333 0.4114 5.1702
80.754 1.1890 0.4 ( 0 0 8) 40.377 0.4205 5.2842
82.160 1.1722 0.5 ( 3 0 3) 41.080 0.4265 5.3601
82.678 1.1662 3.9 ( 2 2 4) 41.339 0.4287 5.3878
83.158 1.1607 1.7 ( 3 1 2) 41.579 0.4308 5.4134

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