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This is useful if the sample is too thick for X-rays to transmit through it. The diffracting planes in the crystal are determined by knowing that the normal to the diffracting plane bisects the angle between the incident beam and the diffracted beam. A Greninger chart can be used [30] to interpret the back reflection Laue photograph.
The distance between two bonded atoms is a sensitive measure of the bond strength and its bond order; thus, X-ray crystallographic studies have led to the discovery of even more exotic types of bonding in inorganic chemistry, such as metal-metal double bonds, [63] [64] [65] metal-metal quadruple bonds, [66] [67] [68] and three-center, two ...
There are several ways to determine the absolute structure by X-ray crystallography. For example, a comparison of the intensities of Bijvoet pairs or of the R-factors for the two possible structures can suggest the correct absolute structure. One of the more powerful and simple approaches is using the Flack parameter, because this single ...
The Scherrer equation, in X-ray diffraction and crystallography, is a formula that relates the size of sub-micrometre crystallites in a solid to the broadening of a peak in a diffraction pattern.
X-ray diffraction computed tomography, often abbreviated as XRD-CT, typically refers to the technique invented by Harding et al. [1] which assumes that the acquired data are powder diffraction data. For this reason, it has also been mentioned as powder diffraction computed tomography [ 7 ] and diffraction scattering computed tomography (DSCT ...
Results from the XRD are then compared to pre-established values assigned to metamorphic zones/metamorphic facies. The targets of the results are the peaks on the XRD plots. Width of the illite XRD peak at one half of its height is collected and recorded with units of ∆ °2θ (XRD angle). [ 1 ]
The pseudo-Voigt function, like the Gaussian and Lorentz functions, is a centrosymmetric function, and as such does not model asymmetry. This can be problematic for non-ideal powder XRD data, such as those collected at synchrotron radiation sources, which generally exhibit asymmetry due to the use of multiple focusing optics.
In other words, it is a measure of how well the refined structure predicts the observed data. [1] The value is also sometimes called the discrepancy index, as it mathematically describes the difference between the experimental observations and the ideal calculated values. [2] It is defined by the following equation: