Corrections for surface X-ray diffraction measurements using theZ-axis geometry: finite size effects in direct and reciprocal space

2000 ◽  
Vol 33 (4) ◽  
pp. 1006-1018 ◽  
Author(s):  
O. Robach ◽  
Y. Garreau ◽  
K. Aïd ◽  
M. B. Véron-Jolliot

X-ray diffraction data have to be corrected by geometrical correction factors prior to any quantitative analysis. Here the case of grazing incidence X-ray diffraction measurements is considered, including the case of high exit angles. First, an approach taking into account the evolution of the diffracting area during an ω scan is presented. From the calculation of the effective part of the sample surface that participates in the diffraction phenomena at each step of the scan, a more accurate correction factor than those commonly used is derived and the evolution of the line shape along a zero-width rod is explained. Secondly, the case of finite-width rods, under the point-like sample approximation, is considered: the influence of the partial integration, as a result of the detector in-plane acceptance, of a rod with an anisotropic in-plane shape, is studied and leads to an analytical expression for the corresponding correction factor. Finally, a full numerical simulation is presented, which provides an alternative method for correcting the experimental intensities and shows in which conditions the previous formulae are no longer valid.

2000 ◽  
Vol 33 (6) ◽  
pp. 1365-1375 ◽  
Author(s):  
Nathalie Jedrecy

The intensity line shape, as provided by a rocking scan, and the derivation of the structure factor from the integrated intensity are reviewed in the context of surface X-ray diffraction, focusing on thez-axis geometry. In a first step, under the assumption of a Dirac-like rod and a point-like sample, the effects of the detector slit settings on the scan width and on the integrated rod height are described. In a second step, it is shown that it is incorrect to treat the integrated intensity as being proportional to the active areaAof the surface, defined as the sample area that is illuminated by the incident beam and viewed by the detector. Indeed, one must take account of the changes in the scattering direction that occur during the θ scan, and define at every θ the surface fractionA(θ) that scatters into the detector. In a third step, a rod with finite width is considered, and the spilling and travelling of the diffracted spot, arising from the centre of the sample, over the detector window is described. The spots emerging from any other sample position are then considered. By coupling spatial and angular variables, the scan line shape can be simulated quantitatively, by means of the in-plane intensity distribution of the rod. The resulting integrated intensity provides the correction factor to be applied to the raw data for the derivation of the structure-factor amplitude. This correction factor is compared to the usual correction (ALΔl), whereAis assumed to be constant,Lis the Lorentz factor and Δlis thelrange as integrated during the scan (in the context of the Dirac-like rod). Significant differences occur at largelvalues when using grazing-incidence conditions.


2001 ◽  
Vol 34 (4) ◽  
pp. 427-435 ◽  
Author(s):  
S. J. Skrzypek ◽  
A. Baczmański ◽  
W. Ratuszek ◽  
E. Kusior

A new development in the determination of residual stresses in thin surface layers and coatings is presented. The procedure, based on the grazing-incidence X-ray diffraction geometry (referred to here as the `g-sin2 ψ' geometry), enables non-destructive measurement at a chosen depth below the sample surface. The penetration depth of the X-ray radiation is well defined and does not change during the experiment. The method is particularly useful for the analysis of non-uniform stresses in near-surface layers. The g-sin2 ψ geometry was applied for measurements of the residual stresses in TiN coatings. Anisotropic diffraction elastic constants of textured material were used to determine the stress value from the measured lattice strains. A new method of data treatment enables reference-free measurements of residual stresses.


1994 ◽  
Vol 367 ◽  
Author(s):  
Z. H. Ming ◽  
S. Huang ◽  
Y. L. Soo ◽  
Y. H. Kao ◽  
T. Carns ◽  
...  

AbstractRoughness parameters of sample surface and buried interfaces in a series of thin layers of Si0.4 GeO.6 grown on Si(100) by molecular beam epitaxy (MBE) were measured by using the technique of grazing-incidence x-ray scattering (GIXS). The strain in the layer and the critical thickness of the film were determined from x-ray diffraction of the Si(004) peak. The roughness parameters can be described by a scaling-law with an exponent β = 0.71 for both the surface and interfacial roughness. Establishment of a scaling law thus allows a possibility of predicting the interfacial roughness as a function of the epilayer thickness.


2000 ◽  
Vol 628 ◽  
Author(s):  
Sophie Besson ◽  
Catherine Jacquiod ◽  
Thierry Gacoin ◽  
André Naudon ◽  
Christian Ricolleau ◽  
...  

ABSTRACTA microstructural study on surfactant templated silica films is performed by coupling traditional X-Ray Diffraction (XRD) and Transmission Electronic Microscopy (TEM) to Grazing Incidence Small Angle X-Ray Scattering (GISAXS). By this method it is shown that spin-coating of silicate solutions with cationic surfactant cetyltrimethylammonium bromide (CTAB) as a templating agent provides 3D hexagonal structure (space group P63/mmc) that is no longer compatible with the often described hexagonal arrangement of tubular micelles but rather with an hexagonal arrangement of spherical micelles. The extent of the hexagonal ordering and the texture can be optimized in films by varying the composition of the solution.


Materials ◽  
2021 ◽  
Vol 14 (12) ◽  
pp. 3191
Author(s):  
Arun Kumar Mukhopadhyay ◽  
Avishek Roy ◽  
Gourab Bhattacharjee ◽  
Sadhan Chandra Das ◽  
Abhijit Majumdar ◽  
...  

We report the surface stoichiometry of Tix-CuyNz thin film as a function of film depth. Films are deposited by high power impulse (HiPIMS) and DC magnetron sputtering (DCMS). The composition of Ti, Cu, and N in the deposited film is investigated by X-ray photoelectron spectroscopy (XPS). At a larger depth, the relative composition of Cu and Ti in the film is increased compared to the surface. The amount of adventitious carbon which is present on the film surface strongly decreases with film depth. Deposited films also contain a significant amount of oxygen whose origin is not fully clear. Grazing incidence X-ray diffraction (GIXD) shows a Cu3N phase on the surface, while transmission electron microscopy (TEM) indicates a polycrystalline structure and the presence of a Ti3CuN phase.


2007 ◽  
Vol 75 (3) ◽  
Author(s):  
Aparna Pareek ◽  
Xavier Torrelles ◽  
Jordi Rius ◽  
Uta Magdans ◽  
Hermann Gies

2011 ◽  
Vol 44 (5) ◽  
pp. 983-990 ◽  
Author(s):  
Chris Elschner ◽  
Alexandr A. Levin ◽  
Lutz Wilde ◽  
Jörg Grenzer ◽  
Christian Schroer ◽  
...  

The electrical and optical properties of molecular thin films are widely used, for instance in organic electronics, and depend strongly on the molecular arrangement of the organic layers. It is shown here how atomic structural information can be obtained from molecular films without further knowledge of the single-crystal structure. C60 fullerene was chosen as a representative test material. A 250 nm C60 film was investigated by grazing-incidence X-ray diffraction and the data compared with a Bragg–Brentano X-ray diffraction measurement of the corresponding C60 powder. The diffraction patterns of both powder and film were used to calculate the pair distribution function (PDF), which allowed an investigation of the short-range order of the structures. With the help of the PDF, a structure model for the C60 molecular arrangement was determined for both C60 powder and thin film. The results agree very well with a classical whole-pattern fitting approach for the C60 diffraction patterns.


Sign in / Sign up

Export Citation Format

Share Document