[ase-users] Printing Pressure or Stress from NpT MD Trajectory

[Danjo De Chavez]

Hi all,

I'm trying out MD simulations using ASE.
Currently, I am running an NPT ensemble to equilibrate my simulation box to
a fixed pressure.
Using the GUI of ASE, it is easy to plot the instantaneous temperature of
my system.
But I can't seem to see a keyword to do the similar for pressure.

Of course I could check the dimensions of my simulation box as function of
time to check the progress of equilibration,
but is there a way to print out or directly plot the pressure with time?

Thank you

Cheers,
Danjo

*========================================================================*
*デチャベズ・ダンジョ*
博士2年生、触媒理論研究部門
触媒科学研究所
北海道大学

*De Chavez, Danjo P.*
*D2 Student, Theoretical Catalytic Chemistry Laboratory*
*Institute for Catalysis*
*Hokkaido University*

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