Debyer

The Debyer project is a software program that takes an input file containing atom positions and outputs a variety of useful data on x-ray and neutron diffraction patterns. This program is also capable of creating total scattering structure functions, pair distribution functions (PDF), and other related functions such as reduced PDF and RDF.

One of the most attractive aspects of Debyer is its compatibility with a range of platforms. If you have a modern Linux or MS Windows workstation, you can run this program with ease. It's also designed to run on large computer clusters, making it an ideal choice for academic or research institutions.

In addition, the parallel version of the Debyer project utilizes the MPI library, which makes this software program even faster and more effective than ever before.

Finally, the Debyer project is distributed under the GNU General Public License, which means that it can be used and modified by individuals and organizations alike. This makes it an outstanding choice for those who require high-quality diffraction data but don't want to pay the prohibitively high prices charged by some commercial software packages.