# 2d Lennard-Jones melt and subsequent energy minimization units lj dimension 2 atom_style atomic lattice sq2 0.8442 region box block 0 20 0 20 -0.1 0.1 create_box 1 box create_atoms 1 box mass 1 1.0 velocity all create 5.0 87287 loop geom pair_style lj/cut 2.5 pair_coeff 1 1 1.0 1.0 2.5 neighbor 0.3 bin neigh_modify delay 0 every 1 check yes fix 1 all nve fix 2 all enforce2d dump 1 all atom 100 dump.min thermo 100 run 1000 neigh_modify delay 0 every 1 check yes dump_modify 1 every 5 thermo 5 minimize 0.001 100 1000