Index of /espresso_v6.1/i386_linux26/qe-6.1/Examples/PHonon/example06

      Name                    Last modified       Size  Description

[DIR] Parent Directory 03-Mar-2017 02:09 - [DIR] reference/ 03-Mar-2017 01:46 - [   ] run_example 03-Mar-2017 01:46 4k

This example shows how to use pw.x to calculate phonons with a fully 
relativistic US-PP which includes spin-orbit effects.

The calculation proceeds as follows:

1) make a self-consistent calculation for fcc-Pt
   (input=pt.scf_ph.in, output=pt.scf_ph.out).

2) make a phonon calculation at the Gamma point (input=pt.ph.in,
   output=pt.ph.out).

3) make a phonon calculation at X (input=pt.phX.in, output=pt.phX.out).