echo both units real atom_style full bond_style harmonic angle_style harmonic read_restart min2.rs reset_timestep 0 pair_style hybrid lj/cut/coul/long 10.0 buck/coul/long 10.0 pair_coeff 1 1 lj/cut/coul/long 0.1553 3.166 pair_coeff 2 2 lj/cut/coul/long 0.0 0.0 pair_coeff 1 2 buck/coul/long 1 1 1 kspace_style pppm 1.0e-4 fix constr all shake 1.0e-5 20 0 b 1 a 1 thermo 100 thermo_style custom step temp pe etotal press vol fix NVT all nvt temp 298.15 298.15 100.0 neigh_modify delay 2 timestep 4 run_style respa 4 2 2 2 inner 2 4.5 6.0 middle 3 8.0 10.0 outer 4 #run_style respa 3 2 2 inner 2 4.5 6.0 outer 3 #run_style respa 2 2 pair 1 kspace 2 run 100 write_restart equilib.rs