|From:||Dundar Yilmaz <duy42@...122...>|
|Date:||Thu, 19 Oct 2017 11:52:21 -0400|
|Hi LAMMPS Users:|
I am trying to develop an analysis project which runs lammps simulations from a python code via python library.
Is there anyway to access already calculated interatomic distances from python side as a pointer similar to coordinates with command:
If not is it possible to implement? I am trying to avoid additional overhead to calculate already calculated distances at the python side.
Dundar Yilmaz, Ph. D.Post Doctoral Researcher
Department of Mechanical and Nuclear Engineering
138 Research East Building
Penn State University
University Park, PA 16802