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Structure and properties of nanostructured materials from atomistic modeling and advanced diffraction methods

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Figure

Table 2.1: Thermodynamic ensembles. The acronym in the first column isconstructed from corresponding fixed variables
Figure 3.1: An X-ray impinging with wavevectordefinition of the wavevector transfer ( k on the charge elementof an isolated atom at position r is elastically scattered to k′
Figure 3.2: Formic acid molecule. Nucleus of the carbon atom (yellow) isconnected to the origin of the reference frame (O) by vector rn.
Figure 3.3: Portion of a small palladium spherical crystal showing a de-(isosurfaces) aroundformation and a twin fault
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