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software:polyxsim

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PolyXSim

PolyXSim allows you to simulate crystallographic patterns and diffraction patterns. The first step is to create an input file (ASCII-file with .inp ending)

The format of the file should look like the following:

Software instructions

You will find an extensive example of how to use PolyXSim in this section: Creation of a synthetic dataset

Running the simulation

For running the simulation, navigate to the folder where the input file is saved and type to the Konsole

  PolyXSim.py -i 'inputfile'.inp
software/polyxsim.1529792692.txt.gz · Last modified: 2019/02/18 10:11 (external edit)