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3 Using PWscf

Input files for pw.x may be either written by hand or produced via the PWgui graphical interface by Anton Kokalj, included in the QUANTUM ESPRESSO distribution. See PWgui-x.y.z/INSTALL (where x.y.z is the version number) for more info on PWgui, or GUI/README if you are using SVN sources.

You may take the tests and examples distributed with QUANTUM ESPRESSO as templates for writing your own input files. In the following, whenever we mention "Example N", we refer to those. Input files are those in the results/ subdirectories, with names ending with .in (they will appear after you have run the examples).



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paolo giannozzi 2014-05-28