[QE-users] Post processing for cp.x code in quantum espresso

[Jayraj Anadani]

Hello QE Community Support Team,

There very less number of resources available on post processing and actual
method on specially cp.x code using quantum espresso.
My question is
How we can visualise cp.x output file? There is cppp.x in which we can
convert .pos,.cell, and .for file into xsf or axsf format but how to
analyse different properties like Radial distribution function (RDF) means
squre displacement (MSD) etc.?
Also, most of tools like ovito,xcrysden,VESTA,VMD support lammps and castep
md file directly but cp.x generate completely different file format so
which is the best way or any tool to analyse output of cp.x code. i also
used code "cp2xsf.f90" but it is only convert cp pos,for and cell file into
axsf trajectory how to find RDF and MSD from that ?

Thank you
Jayraj Anadani
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20220913/a284c052/attachment.html>