units lj atom_style full neighbor 0.36 bin neigh_modify delay 2 pair_style lj/cut 2.5 bond_style fene special_bonds lj 0.0 1.0 1.0 read_data 0_0238_rho_HET_20_HET_15 pair_coeff * * 1.0 1.0 2.5 bond_coeff * 30.0 1.5 1.0 1.0 pair_modify shift yes timestep 0.010 reset_timestep 0 fix 1 all langevin 1.0 1.0 2.0 542305 fix 2 all press/berendsen iso 0.0 0.0 10.0 fix 3 all nve thermo 10 thermo_style custom step temp pe etotal epair pxx pyy pzz lx ly lz run 100 unfix 2 fix 4 all deform 1 x erate 0.00001 y volume z volume compute p all pressure thermo_temp fix 5 all ave/time 4 25 100 c_p[1] c_p[2] c_p[3] c_p[4] c_p[5] c_p[6] file press.1 # restart 2000000 lmp_500-500_1.0_pa lmp_500-500_1.0_pb # dump 1 all custom 200000 *_Monomer_Coordinates id type x y z ix iy iz run 1000 write_data *_Strain_Rate_Loading_10mu.data