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A Transformation of anatase into rutile DICP(锐钛矿向金红石DICP的转换)
Exercise-Course-XRD.doc 1/12 04/06/2012
A - Transformation of anatase into rutile
Anatase and rutile are two distinct phases of titanium dioxide TiO . The stable phase is rutile.
2
1. Structural study
Anatase: tetragonal system. (see PDF file)
1.1 Determine the Bravais lattice. Determine the number Z of chemical formula per unit
cell.
1.2 Determine the position of the most intense diffraction peak for λ (Cu K ).
α
Rutile: tetragonal system (see PDF file)
1.3 Determine the Bravais lattice.
1.4 Determine the indices and the line parameter of the line defined by the points 1 0 0
and 1 1 2.
1.5 Determine the angle between the lines [1 0 0] and [ 1 1 2].
1.6 Determine the indices of the plane family containing the lines [1 0 0] and [1 1 2].
1.7 Determine the Miller indices of the plane containing the points 1 0 0, 1 1 2 and -1 0 0.
2. Experimental study
The sample holder is a circular silicon wafer (face 511) with diameter 50 mm. The powder is sieved
and homogeneously spread on the wafer on a circular area with diameter 35 mm. The recording
parameters are:
- Sample holder: Si wafer (face 511), diameter 50 mm
- Mass of the sample: 30 mg
- Diameter of the sample: 35 mm
- recording : 10 to 80 ° 2θ
- step : 0.04 ° 2θ
- dwell time for one step : 2 s
- λ(CuKα1) : 1.5405981 Å
- Fixed slit opening 0.6 °
- Sampl
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