[Pw_forum] QE MD trajectory

[Prateek Mehta]

Hi all,

I am using pwscf to perform MD.

I was wondering if the atomic positions in the output file are the unfolded
coordinates or are they refolded back into the periodic cell. I see there
is a flag "refold_pos" which is specified as false in a default MD run. I
ask because I want to calculate the mean square displacements.

Prateek
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