energy.in
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			units lj
			dimension 3

			include ${manifold}.setup

			fix step all nve/manifold/rattle 1e-6 10 ${manifold} ${manifold_params}
			pair_style lj/smooth/linear 2.5
			pair_coeff * * 1.0 1.0
			pair_modify shift yes

			# Rebalance:
			fix load all balance 1000 1.0 shift "xyz" 10 1.05

			timestep 0.0005

			variable t equal time
			variable U equal pe
			variable K equal ke
			variable E equal "v_U + v_K"

			fix therm all print 25000 "$t $U $K $E" file thermo.${manifold}.dat screen no

			dump traj all custom 1000000 dump.${manifold}.gz id type x y z

			thermo_style custom time step temp pe ke etotal
			thermo 10000
			run ${STEPS}

lammps/examples/USER/manifold/energy/energy.in87e06310cb52efficient_neuronet