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quantum-espresso/CPV/examples/example06
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Paolo Giannozzi 5790b21d5b Remove examples with obsolete xml input 2019-02-18 09:09:55 +01:00
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reference CPV changed in dir structure. Working src, examples and tests 2011-08-25 12:46:21 +00:00
README CPV changed in dir structure. Working src, examples and tests 2011-08-25 12:46:21 +00:00
run_example MAJOR restructuring of the FFTXlib library 2017-08-01 20:31:02 +00:00

README 

This is a second example of how to use cp.x to calculate Wannier functions 
(contributed by people at IRRMA Lausanne)

The first calculation finds the electronic ground state, while the
subsequent one calculates Wannier orbitals for a water molecule,
using Jacobi Rotation as localization algorithm (wfsd=3).