Description
The FDMNES program calculates the spectra of different spectroscopies related to the real or virtual absorption of x-ray in material. It gives the absorption cross sections around the ionization edges, that is in the XANES energy range. Calculations can be performed along all the conditions of linear or circular polarization. In the same way, it calculates the structure factors and intensities of anomalous or resonant diffraction spectra (DAFS or RXD) for 3D diffraction and for surface diffraction (SRXRD). FDMNES also allows the comparison of the simulated spectra to experimental ones with the help of objective criteria.
More information
- Homepage: https://fdmnes.neel.cnrs.fr - Example job scripts are in $PC2SW/FDMNES
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