read_restart nvt.restart lattice fcc 5.376 orient x 1 0 0 orient y 0 1 0 orient z 0 0 1 region box block 0 5 0 5 0 5 pair_coeff 1 1 0.2381 3.405 group internal region box fix ATC internal atc hardy fix_modify ATC fem create mesh 1 1 1 box p p p fix_modify ATC atom_element_map eulerian 100 fix_modify ATC transfer fields none fix_modify ATC transfer fields add density energy stress temperature fix_modify ATC transfer output nvtFE 100 text thermo 100 compute_modify thermo_temp extra 0 thermo_style custom step temp etotal ke pe press log nvt.log timestep 4.0 reset_timestep 0 fix NVT all nvt 30 30 10 drag 0.2 run 1000