[ase-users] LAMMPS run calculator fix command?

[Spencer Hills]

Dear all,

I am trying to fix atoms based on the region that they are in using ASE's
LAMMPSrun calculator.

With ase.constraints.FixAtoms passed to the constraints of the atoms
object, I am trying to fix a region of atoms based on position. When I use
this and LAMMPSrun calculator, the atoms will move.

I looked into the documentation of LAMMPSrun calculator and did not see a
way to pass the constraints to it. Does anyone know a way to do this?

Thanks,
Spencer Hills
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